Chemical compounds for High-Throughput screening and
Building Blocks for Combinatorial chemistry

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STK639294
Synonyms: N- [(2S)- 1- (morpholin- 4- yl)- 1- oxo- 3- phenylpropan- 2- yl]pyridine- 3- carboxamide
Smiles: O=C([C@@H](NC(=O)c1cccnc1)Cc1ccccc1)N1CCOCC1

STK639295
Synonyms: 2- (5- methoxy- 1H- indol- 1- yl)- N- [2- (piperidin- 1- ylcarbonyl)phenyl]acetamide
Smiles: COc1ccc2c(c1)ccn2CC(=O)Nc1ccccc1C(=O)N1CCCCC1

STK639297
Synonyms: 4- chloro- N- [2- (2,5- dimethoxyphenyl)ethyl]- 3- (1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)benzamide
Smiles: COc1ccc(cc1CCNC(=O)c1ccc(c(c1)N1C(=O)CCS1(=O)=O)Cl)OC

STK639298
Synonyms: N- (4- cyano- 1H- pyrazol- 3- yl)- N'- [(1- ethylpyrrolidin- 2- yl)methyl]ethanediamide
Smiles: CCN1CCCC1CNC(=O)C(=O)Nc1n[nH]cc1C#N

STK639299
Synonyms: 3- chloro- N- [3- methyl- 1- (4- nitrophenyl)- 1H- pyrazol- 5- yl]quinoxalin- 2- amine
Smiles: Cc1nn(c(c1)Nc1nc2ccccc2nc1Cl)c1ccc(cc1)[N+](=O)[O-]

STK639300
Synonyms: 9- cyclopentyl- 3- (3,4- dimethoxyphenyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1cc(ccc1OC)c1coc2c(c1=O)ccc1c2CN(CO1)C1CCCC1

STK639301
Synonyms: 1- [(3- fluorophenyl)carbonyl]- N- {2- [2- methyl- 5- (trifluoromethoxy)- 1H- indol- 3- yl]ethyl}piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)C(=O)c1cccc(c1)F)NCCc1c(C)[nH]c2c1cc(cc2)OC(F)(F)F

STK639302
Synonyms: 7,8- dimethyl- N- [3- (morpholin- 4- yl)propyl]pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 4- amine
Smiles: Cc1nc2sc3c(c2cc1C)ncnc3NCCCN1CCOCC1

STK639305
Synonyms: N- (2,4- dimethoxyphenyl)- 5- fluoro- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: COc1ccc(c(c1)OC)NC(=O)c1cc(F)ccc1n1cnnn1

STK639306
Synonyms: N- [1- (cyclopropylcarbonyl)- 2,3- dihydro- 1H- indol- 6- yl]- 3- (3,4- dimethoxyphenyl)propanamide
Smiles: COc1cc(CCC(=O)Nc2ccc3c(c2)N(CC3)C(=O)C2CC2)ccc1OC

STK639310
Synonyms: 2- (4- chlorophenyl)- 4,5- dimethylthieno[2,3- d]pyrimidine- 6- carboxamide
Smiles: Clc1ccc(cc1)c1nc(C)c2c(n1)sc(c2C)C(=O)N

STK857725
Synonyms: N- (4- acetylphenyl)- 4- methoxy- 3- nitrobenzenesulfonamide
Smiles: COc1ccc(cc1[N+](=O)[O-])S(=O)(=O)Nc1ccc(cc1)C(=O)C

STK639312
Synonyms: 5- benzyl- 2,3,6- trimethyl- 1- (pyridin- 4- ylmethyl)- 1H- pyrrolo[2,3- b]pyridin- 4- amine
Smiles: Cc1nc2n(Cc3ccncc3)c(c(c2c(c1Cc1ccccc1)N)C)C

STK639318
Synonyms: 5,7- dimethoxy- 4- methyl- 3- {2- oxo- 2- [4- (pyridin- 2- yl)piperazin- 1- yl]ethyl}- 2H- chromen- 2- one
Smiles: COc1cc(OC)cc2c1c(C)c(c(=O)o2)CC(=O)N1CCN(CC1)c1ccccn1

STK639319
Synonyms: (3,5- dichloro- 4- methoxyphenyl)(1- oxa- 5- azaspiro[5.5]undec- 5- yl)methanone
Smiles: COc1c(Cl)cc(cc1Cl)C(=O)N1CCCOC21CCCCC2

STK639321
Synonyms: N- {2- [(3- chloro- 4- methoxyphenyl)amino]- 2- oxoethyl}- 4- methoxy- 1H- indole- 2- carboxamide
Smiles: COc1ccc(cc1Cl)NC(=O)CNC(=O)c1cc2c([nH]1)cccc2OC

STK639322
Synonyms: 4- chloro- 3- (1,1- dioxido- 1,2- thiazinan- 2- yl)- N- (3- methylbutyl)benzamide
Smiles: CC(CCNC(=O)c1ccc(c(c1)N1CCCCS1(=O)=O)Cl)C

STK639323
Synonyms: 2,3,5- trimethyl- 6- phenyl- 1- (pyridin- 3- ylmethyl)- 1H- pyrrolo[2,3- b]pyridin- 4- amine
Smiles: Nc1c(C)c(nc2c1c(C)c(n2Cc1cccnc1)C)c1ccccc1

STK639324
Synonyms: 4- {[({[(4- hydroxy- 6,7- dimethoxyquinazolin- 2- yl)methyl]sulfanyl}acetyl)amino]methyl}cyclohexanecarboxylicacid
Smiles: COc1cc2nc(CSCC(=O)NCC3CCC(CC3)C(=O)O)nc(c2cc1OC)O

STK639326
Synonyms: 2- [(2- hydroxy- 4,5- dihydro- 3H- 1- benzazepin- 3- yl)sulfanyl]- N- (3- methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSC1CCc2c(N=C1O)cccc2

STK639329
Synonyms: N- {[2- (3- chlorophenyl)- 1,3- thiazol- 4- yl]acetyl}- L- methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)Cc1csc(n1)c1cccc(c1)Cl

STK639337
Synonyms: 2- ({2- [(6- methyl- 7- oxo- 7H- [1,3]thiazolo[3,2- b][1,2,4]triazin- 3- yl)amino]- 2- oxoethyl}sulfanyl)pyridine- 3- carboxylicacid
Smiles: O=C(Nc1csc2n1nc(C)c(=O)n2)CSc1ncccc1C(=O)O

STK639339
Synonyms: 6- methyl- 2- [(4- methylquinazolin- 2- yl)amino]- 5- (prop- 2- en- 1- yl)pyrimidin- 4- ol
Smiles: C=CCc1c(C)nc(nc1O)Nc1nc(C)c2c(n1)cccc2

STK639342
Synonyms: 4- methyl- 7- [(2- methylprop- 2- en- 1- yl)oxy]- 6- {3- oxo- 3- [4- (pyridin- 2- yl)piperazin- 1- yl]propyl}- 2H- chromen- 2- one
Smiles: CC(=C)COc1cc2oc(=O)cc(c2cc1CCC(=O)N1CCN(CC1)c1ccccn1)C

STK639343
Synonyms: 1- (4- chlorophenyl)- N- [1- (cyclopropylcarbonyl)- 2,3- dihydro- 1H- indol- 5- yl]methanesulfonamide
Smiles: Clc1ccc(cc1)CS(=O)(=O)Nc1ccc2c(c1)CCN2C(=O)C1CC1

STK639344
Synonyms: methyl3- (4- chlorophenyl)- 2- (7- methoxy- 8- methyl- 2- oxo- 2H- chromen- 4- yl)propanoate
Smiles: COC(=O)C(c1cc(=O)oc2c1ccc(c2C)OC)Cc1ccc(cc1)Cl

STK639345
Synonyms: 5- (3- bromo- 4- fluorophenyl)- 4- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1ccc(cc1Br)c1n[nH]c(=S)n1c1ccc2c(c1)OCCO2

STK639347
Synonyms: 3- methyl- 5- (2- methylpropyl)- 1- [2- oxo- 2- (piperidin- 1- yl)ethyl]thieno[2,3- d]pyrimidine- 2,4(1H,3H)- dione
Smiles: CC(Cc1csc2c1c(=O)n(c(=O)n2CC(=O)N1CCCCC1)C)C

STK639348
Synonyms: 3- methyl- 1- [4- (piperidin- 1- ylsulfonyl)- 2- (propan- 2- yloxy)phenyl]imidazolidine- 2,4- dione
Smiles: CC(Oc1cc(ccc1N1CC(=O)N(C1=O)C)S(=O)(=O)N1CCCCC1)C

STK639349
Synonyms: 5- imino- 1- (6- methylheptan- 2- yl)- 4- (4- methyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: CC(CCCC(N1CC(=C(C1=N)c1scc(n1)C)O)C)C

STK639350
Synonyms: 6- [(3,5- dimethyl- 1H- pyrazol- 4- yl)sulfanyl]- 1,2,4- triazine- 3,5- diol
Smiles: Oc1nnc(c(n1)O)Sc1c(C)n[nH]c1C

STK639353
Synonyms: N- (3- acetylphenyl)- 2- [(2- hydroxy- 4,5- dihydro- 3H- 1- benzazepin- 3- yl)sulfanyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(=O)C)CSC1CCc2c(N=C1O)cccc2

STK639354
Synonyms: 2- (4- carbamoylpiperidin- 1- yl)- N- (3,5- dichlorophenyl)- 7- hydroxy- 4- oxo- 3,4,5,6- tetrahydropyrido[2,3- d]pyrimidine- 5- carboxamide
Smiles: O=C(C1CC(=Nc2c1c(=O)[nH]c(n2)N1CCC(CC1)C(=O)N)O)Nc1cc(Cl)cc(c1)Cl

STK639355
Synonyms: 8- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 7- heptyl- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCCCCCCn1c(nc2c1c(O)nc(=O)n2C)n1nc(cc1C)C

STK639358
Synonyms: (5- methoxy- 1H- indol- 3- yl)[4- (pyridin- 4- ylmethyl)piperazin- 1- yl]aceticacid
Smiles: COc1ccc2c(c1)c(c[nH]2)C(N1CCN(CC1)Cc1ccncc1)C(=O)O

STK639359
Synonyms: 1- [2- methyl- 4- (pyridin- 2- yl)- 4,10- dihydropyrimido[1,2- a]benzimidazol- 3- yl]ethanone
Smiles: CC(=O)C1=C(C)N=c2n(C1c1ccccn1)c1ccccc1[nH]2

STK639360
Synonyms: N,N- dimethyl- N'- (1- methylpiperidin- 4- yl)ethane- 1,2- diamine
Smiles: CN(CCNC1CCN(CC1)C)C

STK639364
Synonyms: 2- (4- chlorophenyl)- N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 4- methyl- 1,3- thiazole- 5- carboxamide
Smiles: Clc1ccc(cc1)c1nc(c(s1)C(=O)Nc1ccc2c(c1)OCCO2)C

STK639367
Synonyms: 3- [7- hydroxy- 5- methyl- 2- (pyridin- 4- yl)[1,2,4]triazolo[1,5- a]pyrimidin- 6- yl]propanoicacid
Smiles: OC(=O)CCc1c(C)nc2n(c1O)nc(n2)c1ccncc1

STK639368
Synonyms: N- {4- [(difluoromethyl)sulfanyl]phenyl}- 2- [2- (morpholin- 4- yl)- 4- oxo- 4,5- dihydro- 1,3- thiazol- 5- yl]acetamide
Smiles: FC(Sc1ccc(cc1)NC(=O)CC1SC(=NC1=O)N1CCOCC1)F

STK639369
Synonyms: methyl4- [({4- [2- (2,5- dimethyl- 1H- pyrrol- 1- yl)ethyl]piperazin- 1- yl}carbonothioyl)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=S)N1CCN(CC1)CCn1c(C)ccc1C

STK639372
Synonyms: 2- (2,5- dimethyl- 1H- pyrrol- 1- yl)- N- [(2E)- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]- 1,3- benzothiazole- 6- carboxamide
Smiles: Cc1cs/c(=N/C(=O)c2ccc3c(c2)sc(n3)n2c(C)ccc2C)/[nH]1

STK639373
Synonyms: 2- [(4- chlorophenyl)imino]- 5- ethyl- 5- (pentan- 2- yl)- 2,5- dihydropyrimidine- 4,6- diol
Smiles: CCCC(C1(CC)C(=N/C(=N/c2ccc(cc2)Cl)/N=C1O)O)C

STK639379
Synonyms: 5- (furan- 2- yl)- 2,2- dimethyl- 9- (2- oxo- 2- phenylethyl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 8(9H)- one
Smiles: O=C(c1ccccc1)Cn1cnc2c(c1=O)oc1c2c2CC(C)(C)OCc2c(n1)c1ccco1

STK639384
Synonyms: 10- [2- (dimethylamino)ethyl]- 8,9- dimethyl- 6,10- dihydro- 5H- benzo[h]pyrrolo[2,3- b]quinolin- 7- amine
Smiles: CN(CCn1c(C)c(c2c1nc1c3ccccc3CCc1c2N)C)C

STK639387
Synonyms: (3- fluorophenyl){4- [(1- methyl- 1H- indol- 2- yl)carbonyl]piperazin- 1- yl}methanone
Smiles: Fc1cccc(c1)C(=O)N1CCN(CC1)C(=O)c1cc2c(n1C)cccc2

STK639392
Synonyms: 9- benzyl- 5- {[2- (morpholin- 4- yl)ethyl]amino}- 7,8,9,10- tetrahydro[1,2,4]triazolo[3,4- a][2,7]naphthyridine- 6- carbonitrile
Smiles: N#Cc1c2CCN(Cc2c2n(c1NCCN1CCOCC1)cnn2)Cc1ccccc1

STK639393
Synonyms: (2E)- 2- (acetylimino)- N- [2- (4- hydroxyphenyl)ethyl]- 2,3- dihydro- 1,3- benzothiazole- 6- carboxamide
Smiles: Oc1ccc(cc1)CCNC(=O)c1ccc2c(c1)s/c(=N/C(=O)C)/[nH]2

STK639395
Synonyms: 2- [(2- hydroxy- 4,5- dihydro- 3H- 1- benzazepin- 3- yl)sulfanyl]- N- (1,3- thiazol- 2- yl)acetamide
Smiles: O=C(Nc1nccs1)CSC1CCc2c(N=C1O)cccc2

STK639396
Synonyms: 6- (3- methylthiophen- 2- yl)- 3- (pyridin- 3- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Cc1ccsc1c1nn2c(s1)nnc2c1cccnc1

STK639397
Synonyms: N- [3- (acetylamino)phenyl]- 2- hydroxyquinoline- 4- carboxamide
Smiles: CC(=O)Nc1cccc(c1)NC(=O)c1cc(O)nc2c1cccc2

STK639401
Synonyms: N- cycloheptyl- 3- (1H- indol- 6- yl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)c1ccc2c(c1)[nH]cc2)NC1CCCCCC1

STK639404
Synonyms: 1- {2- [(4- fluorobenzyl)oxy]- 4- (pyrrolidin- 1- ylsulfonyl)phenyl}- 3- methylimidazolidine- 2,4- dione
Smiles: Fc1ccc(cc1)COc1cc(ccc1N1CC(=O)N(C1=O)C)S(=O)(=O)N1CCCC1

STK639406
Synonyms: 5- (4- fluorophenyl)- 2- (morpholin- 4- yl)pyrido[2,3- d]pyrimidin- 4- ol
Smiles: Fc1ccc(cc1)c1ccnc2c1c(O)nc(n2)N1CCOCC1

STK639409
Synonyms: N- {2- [(pyridin- 2- ylcarbonyl)amino]ethyl}- 1H- indole- 3- carboxamide
Smiles: O=C(c1ccccn1)NCCNC(=O)c1c[nH]c2c1cccc2

STK639411
Synonyms: 1- [(4- hydroxyphthalazin- 1- yl)acetyl]- N- (1,3- thiazol- 2- yl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)C(=O)Cc1nnc(c2c1cccc2)O)Nc1nccs1

STK639415
Synonyms: 5- (3,4- dimethoxyphenyl)[1,2,4]triazolo[4,3- a]pyrimidine
Smiles: COc1cc(ccc1OC)c1ccnc2n1cnn2

STK639416
Synonyms: 4,6- dimethyl- N- [(2Z)- 4,6,8- trimethylquinazolin- 2(1H)- ylidene]pyrimidin- 2- amine
Smiles: Cc1cc(C)nc(n1)/N=c/1\nc(C)c2c([nH]1)c(C)cc(c2)C

STK639418
Synonyms: 5- amino- 7- hydroxy[1,2,4]triazolo[4,3- a]pyrimidine- 3(2H)- thione
Smiles: Oc1cc(N)n2c(n1)n[nH]c2=S

STK857726
Synonyms: N'- [(E)- (2- hydroxyquinolin- 3- yl)methylidene]- 4- methoxybenzohydrazide
Smiles: COc1ccc(cc1)C(=O)N/N=C/c1cc2ccccc2nc1O

STK639423
Synonyms: N- (1,3- dihydro- 2H- benzimidazol- 2- ylidene)- 3- (5- methoxy- 1H- indol- 1- yl)propanamide
Smiles: COc1ccc2c(c1)ccn2CCC(=O)/N=c/1\[nH]c2c([nH]1)cccc2

STK639426
Synonyms: N- (diphenylmethyl)- 2,4- dihydroxy- 6- methylpyrimidine- 5- sulfonamide
Smiles: Oc1nc(C)c(c(n1)O)S(=O)(=O)NC(c1ccccc1)c1ccccc1

STK639428
Synonyms: 9- [3- (morpholin- 4- yl)propyl]- 3- phenyl- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: O=c1c(coc2c1ccc1c2CN(CO1)CCCN1CCOCC1)c1ccccc1

STK639433
Synonyms: 4- chloro- N- [2- (4- sulfamoylphenyl)ethyl]- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: Clc1ccc(c(c1)n1cnnn1)C(=O)NCCc1ccc(cc1)S(=O)(=O)N

STK639434
Synonyms: 2- (4- bromophenoxy)- 1- (3- hydroxyquinoxalin- 1(2H)- yl)ethanone
Smiles: Brc1ccc(cc1)OCC(=O)N1CC(=Nc2c1cccc2)O

STK639435
Synonyms: N- methyl- 3- (pyridin- 4- yl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: CNC(=O)c1onc(n1)c1ccncc1

STK639437
Synonyms: 4- amino- N- (2,4- dichlorophenyl)- 7- hydroxy- 2- (pyrrolidin- 1- yl)- 5,6- dihydropyrido[2,3- d]pyrimidine- 5- carboxamide
Smiles: OC1=Nc2nc(nc(c2C(C1)C(=O)Nc1ccc(cc1Cl)Cl)N)N1CCCC1

STK639438
Synonyms: {[5- cyano- 8- (furan- 2- yl)- 3,3- dimethyl- 3,4- dihydro- 1H- pyrano[3,4- c]pyridin- 6- yl]oxy}aceticacid
Smiles: N#Cc1c(OCC(=O)O)nc(c2c1CC(C)(C)OC2)c1ccco1

STK639439
Synonyms: (2E)- 3- acetyl- 2- {[2- (trifluoromethyl)phenyl]imino}- 2,3- dihydro- 1,3- thiazol- 4- ylacetate
Smiles: CC(=O)Oc1cs/c(=N/c2ccccc2C(F)(F)F)/n1C(=O)C

STK639440
Synonyms: N- [1- (pyridin- 3- ylcarbonyl)- 1,2,3,4- tetrahydroquinolin- 6- yl]ethanesulfonamide
Smiles: CCS(=O)(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccnc1

STK639444
Synonyms: 1- [(2S)- 2- (1- oxo- 1,3- dihydro- 2H- isoindol- 2- yl)- 2- phenylacetyl]piperidine- 4- carboxamide
Smiles: NC(=O)C1CCN(CC1)C(=O)[C@@H](N1Cc2c(C1=O)cccc2)c1ccccc1

STK639446
Synonyms: N- (1- benzyl- 1H- pyrazol- 5- yl)- 2- oxo- 2H- chromene- 3- carboxamide
Smiles: O=C(c1cc2ccccc2oc1=O)Nc1ccnn1Cc1ccccc1

STK639447
Synonyms: 1H- benzimidazol- 6- yl[4- (pyrimidin- 2- yl)piperazin- 1- yl]methanone
Smiles: O=C(c1ccc2c(c1)[nH]cn2)N1CCN(CC1)c1ncccn1

STK639449
Synonyms: 4- (3- bromo- 4,5- dimethoxyphenyl)- 5- hydroxy- 8- methyl- 4,8- dihydropyrimido[4,5- d]pyrimidine- 2,7(1H,3H)- dione
Smiles: COc1c(Br)cc(cc1OC)C1NC(=O)Nc2c1c(O)nc(=O)n2C

STK639450
Synonyms: ethyl3- [4- (propan- 2- yloxy)phenyl]- 1,2,4- oxadiazole- 5- carboxylate
Smiles: CCOC(=O)c1onc(n1)c1ccc(cc1)OC(C)C

STK639452
Synonyms: N- {1- [(2E)- 1,3- benzothiazol- 2(3H)- ylideneamino]- 1- oxopropan- 2- yl}- 5,6- dimethoxy- 1H- indole- 2- carboxamide
Smiles: COc1cc2[nH]c(cc2cc1OC)C(=O)NC(C(=O)/N=c\1/sc2c([nH]1)cccc2)C

STK639453
Synonyms: (5- methoxy- 1H- indol- 3- yl)[4- (phenylsulfonyl)piperazin- 1- yl]aceticacid
Smiles: COc1ccc2c(c1)c(c[nH]2)C(N1CCN(CC1)S(=O)(=O)c1ccccc1)C(=O)O

STK639456
Synonyms: N- (4- hydroxyphenyl)- 1- methyl- 5- oxo- 2- phenylpyrrolidine- 3- carboxamide
Smiles: O=C(C1CC(=O)N(C1c1ccccc1)C)Nc1ccc(cc1)O

STK639457
Synonyms: 3- [(2E)- 2- (2,4- dichlorobenzylidene)hydrazinyl]- 6- methyl- 1,2,4- triazin- 5- ol
Smiles: Clc1ccc(c(c1)Cl)/C=N/Nc1nnc(c(n1)O)C

STK639459
Synonyms: N- [3- (2,3- dihydro- 1,4- benzodioxin- 6- ylamino)- 3- oxopropyl]- 4,5- dimethoxy- 1H- indole- 2- carboxamide
Smiles: COc1ccc2c(c1OC)cc([nH]2)C(=O)NCCC(=O)Nc1ccc2c(c1)OCCO2

STK639460
Synonyms: N- [3- (1,3- dihydro- 2H- benzimidazol- 2- ylideneamino)- 3- oxopropyl]- 5,6,7- trimethoxy- 1- methyl- 1H- indole- 2- carboxamide
Smiles: COc1cc2cc(n(c2c(c1OC)OC)C)C(=O)NCCC(=O)/N=c/1\[nH]c2c([nH]1)cccc2

STK639461
Synonyms: 1- benzyl- 4- {[4- (thiophen- 2- ylsulfonyl)piperazin- 1- yl]carbonyl}pyrrolidin- 2- one
Smiles: O=C(C1CC(=O)N(C1)Cc1ccccc1)N1CCN(CC1)S(=O)(=O)c1cccs1

STK639463
Synonyms: 5- (2- methoxyethyl)- 3- phenyl- 4- (pyridin- 2- yl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COCCN1C(=O)c2c(C1c1ccccn1)c([nH]n2)c1ccccc1

STK639465
Synonyms: 4,6- dimethoxy- 1- methyl- N- (2- {[(2E)- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]amino}- 2- oxoethyl)- 1H- indole- 2- carboxamide
Smiles: COc1cc(OC)cc2c1cc(n2C)C(=O)NCC(=O)/N=c\1/scc([nH]1)C

STK639466
Synonyms: 2- chloro- 5- (4,4- dimethyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)- N- methyl- N- [2- (pyridin- 4- yl)ethyl]benzamide
Smiles: CN(C(=O)c1cc(ccc1Cl)N1C(=O)C(CS1(=O)=O)(C)C)CCc1ccncc1

STK639468
Synonyms: 2- chloro- 5- (1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)- N- phenylbenzamide
Smiles: O=C1CCS(=O)(=O)N1c1ccc(c(c1)C(=O)Nc1ccccc1)Cl

STK639469
Synonyms: N- [(4- methyl- 2- phenyl- 1,3- thiazol- 5- yl)carbonyl]- L- methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)c1sc(nc1C)c1ccccc1

STK639470
Synonyms: 2- (5- bromo- 1H- indol- 1- yl)- 1- [4- (4- methoxyphenyl)piperazin- 1- yl]ethanone
Smiles: COc1ccc(cc1)N1CCN(CC1)C(=O)Cn1ccc2c1ccc(c2)Br

STK857730
Synonyms: 1- {[4- chloro- 3- (1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)phenyl]carbonyl}piperidine- 4- carboxamide
Smiles: NC(=O)C1CCN(CC1)C(=O)c1ccc(c(c1)N1C(=O)CCS1(=O)=O)Cl

STK639473
Synonyms: N- [2- (dimethylamino)ethyl]- 6,7- dimethoxy- 1- phenyl- 1,4- dihydroindeno[1,2- c]pyrazole- 3- carboxamide
Smiles: COc1cc2c(cc1OC)Cc1c2n(nc1C(=O)NCCN(C)C)c1ccccc1

STK639474
Synonyms: N- (2- chloropyridin- 4- yl)- N'- [(2S)- 1- hydroxy- 3- phenylpropan- 2- yl]ethanediamide
Smiles: OC[C@@H](NC(=O)C(=O)Nc1ccnc(c1)Cl)Cc1ccccc1

STK639477
Synonyms: N- [4- (3- ethyl- 2- hydroxy- 6- oxo- 3,4,5,6- tetrahydropyridin- 3- yl)phenyl]- 2- oxo- 2- (4- phenylpiperazin- 1- yl)acetamide
Smiles: CCC1(CCC(=O)N=C1O)c1ccc(cc1)NC(=O)C(=O)N1CCN(CC1)c1ccccc1

STK639479
Synonyms: 6- (3,4- dimethoxyphenyl)- 2- phenyl- 2H- pyrazolo[3,4- b]pyridin- 3- ol
Smiles: COc1cc(ccc1OC)c1ccc2c(n1)nn(c2O)c1ccccc1

STK639484
Synonyms: 3- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl]- 6- [(E)- 2- phenylethenyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(Cc1[nH]nc(c1)c1nnc2n1nc(s2)/C=C/c1ccccc1)C

STK639487
Synonyms: 4- hydroxy- N- {3- [(thiophen- 2- ylcarbonyl)amino]propyl}quinazoline- 2- carboxamide
Smiles: O=C(c1nc(O)c2c(n1)cccc2)NCCCNC(=O)c1cccs1

STK639488
Synonyms: 1- cyclopropyl- 6,7- difluoro- 8- methoxy- N- [2- (5- methyl- 1H- indol- 3- yl)ethyl]- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: COc1c(F)c(F)cc2c1n(cc(c2=O)C(=O)NCCc1c[nH]c2c1cc(C)cc2)C1CC1

STK639493
Synonyms: 5- bromo- N- (2,3- dichlorophenyl)- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: Brc1ccc(c(c1)C(=O)Nc1cccc(c1Cl)Cl)n1cnnn1

STK639496
Synonyms: 1- (4- fluorophenyl)- N- [1- (pyridin- 3- ylcarbonyl)- 1,2,3,4- tetrahydroquinolin- 7- yl]methanesulfonamide
Smiles: Fc1ccc(cc1)CS(=O)(=O)Nc1ccc2c(c1)N(CCC2)C(=O)c1cccnc1

STK639500
Synonyms: N- {2- [(2,1,3- benzoxadiazol- 4- ylsulfonyl)amino]ethyl}- 1H- indole- 4- carboxamide
Smiles: O=C(c1cccc2c1cc[nH]2)NCCNS(=O)(=O)c1cccc2c1non2

STK639502
Synonyms: 6- ethyl- 7- hydroxy- 3- (1- methyl- 1H- benzimidazol- 2- yl)- 2- (4- nitrophenyl)- 4H- chromen- 4- one
Smiles: CCc1cc2c(cc1O)oc(c(c2=O)c1nc2c(n1C)cccc2)c1ccc(cc1)[N+](=O)[O-]

STK639504
Synonyms: ethyl[4- (1H- indol- 2- ylcarbonyl)piperazin- 1- yl](oxo)acetate
Smiles: CCOC(=O)C(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2

STK639510
Synonyms: N- {[2- (3- methoxyphenyl)- 1,3- thiazol- 4- yl]acetyl}- L- leucine
Smiles: COc1cccc(c1)c1scc(n1)CC(=O)N[C@H](C(=O)O)CC(C)C

STK639512
Synonyms: methyl4,5- dimethoxy- 2- {[(3- methoxy- 3- oxopropyl)carbamoyl]amino}benzoate
Smiles: COC(=O)CCNC(=O)Nc1cc(OC)c(cc1C(=O)OC)OC

STK639515
Synonyms: N- (4- fluorophenyl)- 6- [4- (4- fluorophenyl)piperazin- 1- yl]- 1- methyl- 1H- pyrazolo[3,4- d]pyrimidin- 4- amine
Smiles: Fc1ccc(cc1)Nc1nc(nc2c1cnn2C)N1CCN(CC1)c1ccc(cc1)F

STK639518
Synonyms: 2- chloro- 5- (1,1- dioxido- 1,2- thiazinan- 2- yl)- N- (2- methylpropyl)benzamide
Smiles: CC(CNC(=O)c1cc(ccc1Cl)N1CCCCS1(=O)=O)C

STK639520
Synonyms: N- [3- (2,3- dihydro- 1,4- benzodioxin- 6- ylamino)- 3- oxopropyl]- 2,3- dihydro- 1,4- benzodioxine- 2- carboxamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CCNC(=O)C1COc2c(O1)cccc2

STK639523
Synonyms: 3- [2- (3,4- dimethoxyphenyl)ethyl]- 6- (2- phenylethyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1cc(CCc2nnc3n2nc(s3)CCc2ccccc2)ccc1OC

STK857732
Synonyms: 8- methoxy- 3- [2- (4- methoxyphenyl)- 1,3- thiazol- 4- yl]- 2H- chromen- 2- one
Smiles: COc1ccc(cc1)c1scc(n1)c1cc2cccc(c2oc1=O)OC

STK857733
Synonyms: 2- (3,5- dihydroxy- 1,2,4- triazin- 6- yl)- N'- [(E)- (2- hydroxyphenyl)methylidene]acetohydrazide
Smiles: O=C(Cc1nnc(nc1O)O)N/N=C/c1ccccc1O

STK639525
Synonyms: N- (diphenylmethyl)- 4- hydroxyquinazoline- 2- carboxamide
Smiles: O=C(c1nc(O)c2c(n1)cccc2)NC(c1ccccc1)c1ccccc1

STK639526
Synonyms: [4- (tert- butoxycarbonyl)piperazin- 1- yl](7- methoxy- 1H- indol- 3- yl)aceticacid
Smiles: COc1cccc2c1[nH]cc2C(N1CCN(CC1)C(=O)OC(C)(C)C)C(=O)O

STK639527
Synonyms: 4- (furan- 2- yl)- 5- hydroxy- 8- methyl- 4,8- dihydropyrimido[4,5- d]pyrimidine- 2,7(1H,3H)- dione
Smiles: O=C1NC(c2ccco2)c2c(N1)n(C)c(=O)nc2O

STK639533
Synonyms: N- [(2Z)- 6- fluoro- 1,3- benzothiazol- 2(3H)- ylidene]- 3- (morpholin- 4- ylsulfonyl)benzamide
Smiles: Fc1ccc2c(c1)s/c(=N\C(=O)c1cccc(c1)S(=O)(=O)N1CCOCC1)/[nH]2

STK639535
Synonyms: 1- {4- [(3,4- dimethoxyphenyl)acetyl]piperazin- 1- yl}- 3- (1H- indol- 3- yl)propan- 1- one
Smiles: COc1ccc(cc1OC)CC(=O)N1CCN(CC1)C(=O)CCc1c[nH]c2c1cccc2

STK639536
Synonyms: (3aS,6aR)- 5- (3- chlorophenyl)- 3- (1,3- dimethyl- 1H- pyrazol- 4- yl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: Clc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)C(=NO2)c1cn(nc1C)C

STK639538
Synonyms: 1- (3,4- dihydroisoquinolin- 2(1H)- yl)- 2- {[(4- hydroxy- 6,7- dimethoxyquinazolin- 2- yl)methyl]sulfanyl}ethanone
Smiles: COc1cc2nc(CSCC(=O)N3CCc4c(C3)cccc4)nc(c2cc1OC)O

STK639542
Synonyms: {1- [(4- chlorophenyl)sulfonyl]piperidin- 3- yl}[4- (pyrimidin- 2- yl)piperazin- 1- yl]methanone
Smiles: Clc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)N1CCN(CC1)c1ncccn1

STK639543
Synonyms: propyl4- ({[2- (1H- tetrazol- 1- yl)phenyl]carbonyl}amino)benzoate
Smiles: CCCOC(=O)c1ccc(cc1)NC(=O)c1ccccc1n1cnnn1

STK639544
Synonyms: (5- methoxy- 1H- indol- 3- yl)(4- methylpiperidin- 1- yl)aceticacid
Smiles: COc1ccc2c(c1)c(c[nH]2)C(N1CCC(CC1)C)C(=O)O

STK639546
Synonyms: N- acetyl- 3,5- dinitrotyrosine
Smiles: CC(=O)NC(C(=O)O)Cc1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])O

STK639547
Synonyms: 3- (4- methylpiperazin- 1- yl)- 6- [4- methyl- 3- (pyrrolidin- 1- ylsulfonyl)phenyl]pyridazine
Smiles: CN1CCN(CC1)c1ccc(nn1)c1ccc(c(c1)S(=O)(=O)N1CCCC1)C

STK639548
Synonyms: N- {2- [(cyclopropylcarbonyl)amino]ethyl}- 1H- indole- 2- carboxamide
Smiles: O=C(C1CC1)NCCNC(=O)c1cc2c([nH]1)cccc2

STK639549
Synonyms: N- (1H- indol- 5- yl)- 2- (3- oxo- 2,3- dihydro- 4H- 1,4- benzoxazin- 4- yl)acetamide
Smiles: O=C(CN1C(=O)COc2c1cccc2)Nc1ccc2c(c1)cc[nH]2

STK639553
Synonyms: N- (2,3- dihydro- 1,4- benzodioxin- 2- ylmethyl)- N'- [2- (3,4- dimethoxyphenyl)ethyl]butanediamide
Smiles: COc1cc(CCNC(=O)CCC(=O)NCC2COc3c(O2)cccc3)ccc1OC

STK639554
Synonyms: (6- fluoro- 1H- indol- 3- yl)(thiomorpholin- 4- yl)aceticacid
Smiles: OC(=O)C(c1c[nH]c2c1ccc(c2)F)N1CCSCC1

STK639555
Synonyms: methyl4- [3- (furan- 2- yl)- 5- (2- methoxyethyl)- 6- oxo- 2,4,5,6- tetrahydropyrrolo[3,4- c]pyrazol- 4- yl]benzoate
Smiles: COCCN1C(=O)c2c(C1c1ccc(cc1)C(=O)OC)c([nH]n2)c1ccco1

STK639562
Synonyms: 6- [(4- chlorophenyl)(morpholin- 4- yl)methyl]- 1,3- benzodioxol- 5- ol
Smiles: Clc1ccc(cc1)C(c1cc2OCOc2cc1O)N1CCOCC1

STK639564
Synonyms: 6- chloro- N- (4- hydroxyphenyl)imidazo[1,2- a]pyridine- 2- carboxamide
Smiles: Oc1ccc(cc1)NC(=O)c1cn2c(n1)ccc(c2)Cl

STK639566
Synonyms: 3- (2- hydroxy- 4- oxo- 6,7- dihydro- 4H- cyclopenta[4,5]thieno[2,3- d]pyrimidin- 3(5H)- yl)propanoicacid
Smiles: OC(=O)CCn1c(O)nc2c(c1=O)c1CCCc1s2

STK639568
Synonyms: 1- phenyl- 3- [1- (pyridin- 3- ylcarbonyl)- 2,3- dihydro- 1H- indol- 5- yl]urea
Smiles: O=C(Nc1ccccc1)Nc1ccc2c(c1)CCN2C(=O)c1cccnc1

STK639570
Synonyms: N- [(1- ethylpyrrolidin- 2- yl)methyl]- N~3~- 7H- purin- 6- yl- beta- alaninamide
Smiles: CCN1CCCC1CNC(=O)CCNc1ncnc2c1[nH]cn2

STK857736
Synonyms: N- (6- chloroquinolin- 4- yl)- 4- (pyrrolidin- 1- ylsulfonyl)benzamide
Smiles: Clc1ccc2c(c1)c(ccn2)NC(=O)c1ccc(cc1)S(=O)(=O)N1CCCC1

STK639573
Synonyms: N- [1- oxo- 1- (1,3- thiazol- 2- ylamino)hexan- 2- yl]- 1- benzofuran- 2- carboxamide
Smiles: CCCCC(C(=O)Nc1nccs1)NC(=O)c1cc2c(o1)cccc2

STK639577
Synonyms: 2,4- dihydroxy- N'- (3- methylbutanoyl)quinoline- 3- carbohydrazide
Smiles: CC(CC(=O)NNC(=O)c1c(O)nc2c(c1O)cccc2)C

STK639579
Synonyms: N- [2- (piperidin- 1- yl)ethyl]- N'- [4- (1H- 1,2,4- triazol- 1- ylmethyl)phenyl]ethanediamide
Smiles: O=C(C(=O)NCCN1CCCCC1)Nc1ccc(cc1)Cn1ncnc1

STK639581
Synonyms: 2- chloro- N- (2- methoxyphenyl)- 5- (1H- tetrazol- 1- yl)benzamide
Smiles: COc1ccccc1NC(=O)c1cc(ccc1Cl)n1cnnn1

STK639582
Synonyms: N- {(2S)- 1- [(3- chloro- 4- methoxyphenyl)amino]- 1- oxopropan- 2- yl}- 4- methoxy- 1H- indole- 2- carboxamide
Smiles: COc1ccc(cc1Cl)NC(=O)[C@@H](NC(=O)c1cc2c([nH]1)cccc2OC)C

STK639583
Synonyms: N- [2- (1H- indol- 3- yl)ethyl]- 1- [3- (propan- 2- yl)[1,2,4]triazolo[4,3- b]pyridazin- 6- yl]piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ccc2n(n1)c(nn2)C(C)C)NCCc1c[nH]c2c1cccc2

STK639584
Synonyms: 5- oxo- N- {2- [(phenylcarbonyl)amino]ethyl}- 1- [3- (trifluoromethyl)phenyl]pyrrolidine- 3- carboxamide
Smiles: O=C(C1CC(=O)N(C1)c1cccc(c1)C(F)(F)F)NCCNC(=O)c1ccccc1

STK639586
Synonyms: 1- (2- methylpropyl)- 3- [2- oxo- 2- (piperidin- 1- yl)ethoxy]- 5,6,7,8- tetrahydroisoquinoline- 4- carbonitrile
Smiles: N#Cc1c(OCC(=O)N2CCCCC2)nc(c2c1CCCC2)CC(C)C

STK639587
Synonyms: N- [3- (acetylamino)phenyl]- 5- fluoro- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: CC(=O)Nc1cccc(c1)NC(=O)c1cc(F)ccc1n1cnnn1

STK639591
Synonyms: 6- chloro- N- cycloheptylimidazo[1,2- a]pyridine- 2- carboxamide
Smiles: Clc1ccc2n(c1)cc(n2)C(=O)NC1CCCCCC1

STK639592
Synonyms: 3- bromo- N- [(4- hydroxy- 1- phenyl- 1H- pyrazolo[3,4- d]pyrimidin- 6- yl)methyl]benzamide
Smiles: Brc1cccc(c1)C(=O)NCc1nc(O)c2c(n1)n(nc2)c1ccccc1

STK639594
Synonyms: Nalpha- (1- benzofuran- 2- ylcarbonyl)- N- 1,3- thiazol- 2- yl- L- phenylalaninamide
Smiles: O=C([C@@H](NC(=O)c1cc2c(o1)cccc2)Cc1ccccc1)Nc1nccs1

STK857737
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 5- (5- methyl- 1H- pyrazol- 3- yl)- 1,2,4- oxadiazole
Smiles: Cc1[nH]nc(c1)c1onc(n1)c1ccc2c(c1)OCO2

STK639595
Synonyms: [5- (benzyloxy)- 1H- indol- 3- yl][4- (pyridin- 4- ylmethyl)piperazin- 1- yl]aceticacid
Smiles: OC(=O)C(c1c[nH]c2c1cc(OCc1ccccc1)cc2)N1CCN(CC1)Cc1ccncc1

STK639599
Synonyms: 6- chloro- N- [2- (cyclopropylamino)- 2- oxoethyl]- 1,3,4,9- tetrahydro- 2H- beta- carboline- 2- carboxamide
Smiles: O=C(NC1CC1)CNC(=O)N1CCc2c(C1)[nH]c1c2cc(cc1)Cl

STK639600
Synonyms: 4- [(E)- {2- [(1,3- benzoxazol- 2- ylsulfanyl)acetyl]hydrazinylidene}methyl]- 2- methoxyphenyl(4- hydroxy- 2- oxo- 2,5- dihydro- 1,3- thiazol- 5- yl)acetate
Smiles: COc1cc(/C=N/NC(=O)CSc2nc3c(o2)cccc3)ccc1OC(=O)CC1SC(=O)N=C1O

STK639601
Synonyms: (2E)- 3- (4- chlorophenyl)- N- [(2E)- 3- cyano- 1- (2- methoxyethyl)- 10- methyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidin- 2- ylidene]prop- 2- enamide
Smiles: COCCn1/c(=N/C(=O)/C=C/c2ccc(cc2)Cl)/c(C#N)cc2c1nc1c(C)cccn1c2=O

STK857738
Synonyms: 4- hydroxy- N- (pyridin- 3- yl)quinoline- 3- carboxamide
Smiles: O=C(c1cnc2c(c1O)cccc2)Nc1cccnc1

STK639603
Synonyms: 3- (4- amino- 1- oxo- 1,3- dihydro- 2H- isoindol- 2- yl)piperidine- 2,6- dione
Smiles: O=C1CCC(C(=O)N1)N1Cc2c(C1=O)cccc2N

STK639604
Synonyms: N~3~- [(4- hydroxyphthalazin- 1- yl)acetyl]- N- [(2S)- 1- hydroxypropan- 2- yl]- beta- alaninamide
Smiles: OC[C@@H](NC(=O)CCNC(=O)Cc1nnc(c2c1cccc2)O)C

STK639605
Synonyms: N- {2- [(2,1,3- benzoxadiazol- 4- ylsulfonyl)amino]ethyl}- 1H- indole- 6- carboxamide
Smiles: O=C(c1ccc2c(c1)[nH]cc2)NCCNS(=O)(=O)c1cccc2c1non2

STK639606
Synonyms: N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- N'- {2- [(1H- indol- 2- ylcarbonyl)amino]ethyl}ethanediamide
Smiles: O=C(C(=O)NCCNC(=O)c1cc2c([nH]1)cccc2)Nc1ccc2c(c1)OCCO2

STK857739
Synonyms: 3- [2- methyl- 4- (thiophen- 2- yl)- 1,3- thiazol- 5- yl]- 1- (morpholin- 4- yl)propan- 1- one
Smiles: O=C(N1CCOCC1)CCc1sc(nc1c1cccs1)C

STK639612
Synonyms: 3- (2- chlorophenyl)- 6- (2- methoxyphenoxy)[1,2,4]triazolo[4,3- b]pyridazine
Smiles: COc1ccccc1Oc1ccc2n(n1)c(nn2)c1ccccc1Cl

STK639614
Synonyms: N- (2- methylpropyl)- 2- (1- phenylethyl)- 1,2,3,4- tetrahydropyrazino[1,2- a]benzimidazole- 8- carboxamide
Smiles: CC(CNC(=O)c1ccc2c(c1)nc1n2CCN(C1)C(c1ccccc1)C)C

STK639615
Synonyms: 2- chloro- 5- (4,4- dimethyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)- N- [3- (trifluoromethyl)phenyl]benzamide
Smiles: O=C1N(c2ccc(c(c2)C(=O)Nc2cccc(c2)C(F)(F)F)Cl)S(=O)(=O)CC1(C)C

STK639616
Synonyms: 2- {6- [(4- methoxyphenoxy)methyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 3- yl}quinoline
Smiles: COc1ccc(cc1)OCc1sc2n(n1)c(nn2)c1ccc2c(n1)cccc2

STK857741
Synonyms: 1- (4- chlorophenyl)- 4- (3- phenyl- 1,2,4- oxadiazol- 5- yl)pyrrolidin- 2- one
Smiles: Clc1ccc(cc1)N1CC(CC1=O)c1onc(n1)c1ccccc1

STK639618
Synonyms: N- (2,4- dichlorophenyl)- 2- (3,4- dihydroisoquinolin- 2(1H)- yl)- 4- hydroxy- 7- oxo- 5,6,7,8- tetrahydropyrido[2,3- d]pyrimidine- 5- carboxamide
Smiles: O=C1Nc2nc(nc(c2C(C1)C(=O)Nc1ccc(cc1Cl)Cl)O)N1CCc2c(C1)cccc2

STK639619
Synonyms: 1- [N- (7H- purin- 6- yl)- beta- alanyl]piperidine- 4- carboxamide
Smiles: NC(=O)C1CCN(CC1)C(=O)CCNc1ncnc2c1[nH]cn2

STK639622
Synonyms: 7,7- dimethyl- 3- (2- methylprop- 2- en- 1- yl)- 6,9- dihydro- 7H- pyrano[3',4':4,5]thieno[3,2- d]pyrimidin- 4(3H)- one
Smiles: CC(=C)Cn1cnc2c(c1=O)sc1c2COC(C1)(C)C

STK857743
Synonyms: 4- [(7- methoxy- 2- methyl- 4- oxo- 4H- chromen- 3- yl)oxy]- N- (pyridin- 3- ylmethyl)benzamide
Smiles: COc1ccc2c(c1)oc(c(c2=O)Oc1ccc(cc1)C(=O)NCc1cccnc1)C

STK639624
Synonyms: methyl2- ({[4- (4- methylquinolin- 2- yl)piperazin- 1- yl]carbonothioyl}amino)benzoate
Smiles: COC(=O)c1ccccc1NC(=S)N1CCN(CC1)c1cc(C)c2c(n1)cccc2

STK639625
Synonyms: (8- chloro- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)(pyridin- 4- yl)methanone
Smiles: Clc1ccc2c(c1)c1CN(CCc1[nH]2)C(=O)c1ccncc1

STK639627
Synonyms: 4- {[4- (cyclopropylcarbonyl)piperazin- 1- yl]carbonyl}- 1- [3- (trifluoromethyl)phenyl]pyrrolidin- 2- one
Smiles: O=C(C1CC(=O)N(C1)c1cccc(c1)C(F)(F)F)N1CCN(CC1)C(=O)C1CC1

STK639630
Synonyms: N- [3- (methylsulfanyl)- 1- ([1,2,4]triazolo[4,3- a]pyridin- 3- yl)propyl]- 2- phenoxyacetamide
Smiles: CSCCC(c1nnc2n1cccc2)NC(=O)COc1ccccc1

STK639631
Synonyms: 6- {[4- (2- fluorophenyl)piperazin- 1- yl]sulfonyl}quinoxaline- 2,3- diol
Smiles: Fc1ccccc1N1CCN(CC1)S(=O)(=O)c1ccc2c(c1)nc(c(n2)O)O

STK639634
Synonyms: N- [2- (5- chloro- 1H- indol- 3- yl)ethyl]- 4- [4- (methylsulfonyl)piperazin- 1- yl]- 4- oxobutanamide
Smiles: O=C(NCCc1c[nH]c2c1cc(Cl)cc2)CCC(=O)N1CCN(CC1)S(=O)(=O)C

STK639635
Synonyms: 2- (4- chlorophenoxy)- N- [2- methyl- 1- ([1,2,4]triazolo[4,3- a]pyridin- 3- yl)propyl]acetamide
Smiles: O=C(NC(c1nnc2n1cccc2)C(C)C)COc1ccc(cc1)Cl

STK857744
Synonyms: 6- methyl- 2- [(2E)- 2- (thiophen- 2- ylmethylidene)hydrazinyl]pyrimidin- 4- ol
Smiles: Cc1nc(N/N=C/c2cccs2)nc(c1)O

STK639640
Synonyms: ethyl4- {[3- (2- phenyl- 1H- indol- 1- yl)propanoyl]amino}piperidine- 1- carboxylate
Smiles: CCOC(=O)N1CCC(CC1)NC(=O)CCn1c(cc2c1cccc2)c1ccccc1

STK639642
Synonyms: trans- N- [4- (acetylamino)phenyl]- 4- ({[(4- fluorophenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide
Smiles: O=C([C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)F)Nc1ccc(cc1)NC(=O)C

STK639645
Synonyms: 2- chloro- N- [2- (3,4- dimethoxyphenyl)ethyl]- 5- (1H- tetrazol- 1- yl)benzamide
Smiles: COc1ccc(cc1OC)CCNC(=O)c1cc(ccc1Cl)n1cnnn1

STK639646
Synonyms: 6- chloro- N- (2- {[4- (morpholin- 4- ylmethyl)phenyl]amino}- 2- oxoethyl)- 1,3,4,9- tetrahydro- 2H- beta- carboline- 2- carboxamide
Smiles: O=C(Nc1ccc(cc1)CN1CCOCC1)CNC(=O)N1CCc2c(C1)[nH]c1c2cc(cc1)Cl

STK639651
Synonyms: 2- [6- (biphenyl- 4- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 3- yl]quinoline
Smiles: c1ccc(cc1)c1ccc(cc1)c1sc2n(n1)c(nn2)c1ccc2c(n1)cccc2

STK639656
Synonyms: tert- butyl6- (3- ethoxy- 4- hydroxyphenyl)- 2- hydroxy- 4- methyl- 1,6- dihydropyrimidine- 5- carboxylate
Smiles: CCOc1cc(ccc1O)C1NC(=NC(=C1C(=O)OC(C)(C)C)C)O

STK857745
Synonyms: 5- [(2E)- 2- (1H- indol- 3- ylmethylidene)hydrazinyl]- 1,2,4- triazin- 3- ol
Smiles: Oc1nncc(n1)N/N=C/c1c[nH]c2c1cccc2

STK639663
Synonyms: 3- (3,4- dimethoxyphenyl)- N- [2- (morpholin- 4- yl)ethyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: COc1cc(ccc1OC)c1noc(n1)C(=O)NCCN1CCOCC1

STK639665
Synonyms: 2- [4- (1H- indol- 2- ylcarbonyl)piperazin- 1- yl]- 2- oxo- N- (pyridin- 4- ylmethyl)acetamide
Smiles: O=C(C(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2)NCc1ccncc1

STK639671
Synonyms: 3- {[3- (tetrahydrofuran- 2- yl)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]methyl}benzoicacid
Smiles: OC(=O)c1cccc(c1)Cn1c(=S)[nH]nc1C1CCCO1

STK639672
Synonyms: 2,4- dihydroxy- N- (2- methoxyphenyl)- 6- methylpyrimidine- 5- sulfonamide
Smiles: COc1ccccc1NS(=O)(=O)c1c(C)nc(nc1O)O

STK639682
Synonyms: 5,6,7- trimethoxy- 1- methyl- N- [(2S)- 3- methyl- 1- oxo- 1- (1,3- thiazol- 2- ylamino)butan- 2- yl]- 1H- indole- 2- carboxamide
Smiles: COc1cc2cc(n(c2c(c1OC)OC)C)C(=O)N[C@H](C(=O)Nc1nccs1)C(C)C

STK639683
Synonyms: methyl{[8- (4- chlorophenyl)- 2,3,4,8- tetrahydropyrazolo[4,3- e]pyrimido[1,2- c]pyrimidin- 6- yl]sulfanyl}acetate
Smiles: COC(=O)CSc1nc2n(ncc2c2=NCCCn12)c1ccc(cc1)Cl

STK639684
Synonyms: (4,7- dimethoxy- 1H- indol- 2- yl)[4- ([1,2,4]triazolo[4,3- a]pyridin- 3- yl)piperidin- 1- yl]methanone
Smiles: COc1ccc(c2c1[nH]c(c2)C(=O)N1CCC(CC1)c1nnc2n1cccc2)OC

STK639685
Synonyms: 5- [(2- chlorobenzyl)amino]- 2- (4- nitrophenyl)- 1,3- oxazole- 4- carbonitrile
Smiles: N#Cc1nc(oc1NCc1ccccc1Cl)c1ccc(cc1)[N+](=O)[O-]

STK639686
Synonyms: 2- ethyl- 1- [3- (3- methoxyphenyl)- 5- (quinoxalin- 6- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]butan- 1- one
Smiles: CCC(C(=O)N1N=C(CC1c1ccc2c(c1)nccn2)c1cccc(c1)OC)CC

STK639687
Synonyms: 2- [6- (3- fluorophenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 3- yl]quinoline
Smiles: Fc1cccc(c1)c1sc2n(n1)c(nn2)c1ccc2c(n1)cccc2

STK639688
Synonyms: 1- ({1- [(5- oxo- 1- phenylpyrrolidin- 3- yl)carbonyl]piperidin- 4- yl}carbonyl)piperidine- 4- carboxamide
Smiles: NC(=O)C1CCN(CC1)C(=O)C1CCN(CC1)C(=O)C1CC(=O)N(C1)c1ccccc1

STK639693
Synonyms: 3- (1H- benzimidazol- 2- yl)- 6,8- dibromoquinoline- 2,4- diol
Smiles: Brc1cc(Br)c2c(c1)c(O)c(c(n2)O)c1nc2c([nH]1)cccc2

STK639694
Synonyms: [4- (4- fluorophenyl)piperazin- 1- yl][3- (1H- indol- 4- yl)- 1,2,4- oxadiazol- 5- yl]methanone
Smiles: Fc1ccc(cc1)N1CCN(CC1)C(=O)c1onc(n1)c1cccc2c1cc[nH]2

STK639695
Synonyms: 2- (2,6- dimethylphenoxy)- N- [(2Z)- 5- methoxy[1,3]thiazolo[4,5- f]quinolin- 2(1H)- ylidene]acetamide
Smiles: COc1cc2s/c(=N\C(=O)COc3c(C)cccc3C)/[nH]c2c2c1nccc2

STK639698
Synonyms: N- benzyl- 3- (4- fluorophenyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: Fc1ccc(cc1)c1noc(n1)C(=O)NCc1ccccc1

STK639701
Synonyms: N- (4- {[(2Z)- 3- [(3- sulfamoylphenyl)amino]quinoxalin- 2(1H)- ylidene]sulfamoyl}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1cccc(c1)S(=O)(=O)N

STK639702
Synonyms: 2- [6- (4- chlorobenzyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 3- yl]quinoline
Smiles: Clc1ccc(cc1)Cc1nn2c(s1)nnc2c1ccc2c(n1)cccc2

STK639704
Synonyms: 2- (3,5- dihydroxy- 1,2,4- triazin- 6- yl)- N'- {(E)- [4- (dimethylamino)phenyl]methylidene}acetohydrazide
Smiles: O=C(Cc1nnc(nc1O)O)N/N=C/c1ccc(cc1)N(C)C

STK639706
Synonyms: 3- {[3- (pyridin- 4- yl)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]methyl}benzoicacid
Smiles: OC(=O)c1cccc(c1)Cn1c(=S)[nH]nc1c1ccncc1

STK639707
Synonyms: 3- cyclohexyl- N- [2- hydroxy- 5- oxo- 1- (3- phenylpropyl)- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]propanamide
Smiles: O=C(NC1(N=C(N(C1=O)CCCc1ccccc1)O)C(F)(F)F)CCC1CCCCC1

STK639709
Synonyms: (4E)- 1- [3- (dimethylamino)propyl]- 4- [hydroxy(1H- indol- 3- yl)methylidene]- 5- phenylpyrrolidine- 2,3- dione
Smiles: CN(CCCN1C(c2ccccc2)/C(=C(/c2c[nH]c3c2cccc3)\O)/C(=O)C1=O)C

STK639712
Synonyms: N- (diphenylacetyl)- L- tyrosine
Smiles: Oc1ccc(cc1)C[C@@H](C(=O)O)NC(=O)C(c1ccccc1)c1ccccc1

STK639714
Synonyms: 1- (1,1- dioxidotetrahydrothiophen- 3- yl)piperazine
Smiles: O=S1(=O)CCC(C1)N1CCNCC1

STK639727
Synonyms: 4- {2- [(4aS,7aR)- 6,6- dioxido- 3- oxo- 4- [4- (propan- 2- yl)phenyl]hexahydrothieno[3,4- b]pyrazin- 1(2H)- yl]ethyl}benzenesulfonamide
Smiles: CC(c1ccc(cc1)N1C(=O)CN([C@@H]2[C@H]1CS(=O)(=O)C2)CCc1ccc(cc1)S(=O)(=O)N)C

STK639730
Synonyms: methylN- [(6- fluoro- 1H- indol- 1- yl)acetyl]- L- alaninate
Smiles: COC(=O)[C@@H](NC(=O)Cn1ccc2c1cc(F)cc2)C

STK639734
Synonyms: [4- (1,2- benzothiazol- 3- yl)piperazin- 1- yl][3- (pyridin- 2- yl)- 1,2,4- oxadiazol- 5- yl]methanone
Smiles: O=C(c1onc(n1)c1ccccn1)N1CCN(CC1)c1nsc2c1cccc2

STK639735
Synonyms: 7- (4- hydroxy- 3- methoxyphenyl)- 2- methyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine- 5- carboxylicacid
Smiles: COc1cc(ccc1O)C1C=C(N=c2n1nc([nH]2)C)C(=O)O

STK857747
Synonyms: 6- [4- (3- chlorophenyl)piperazin- 1- yl]- 1- methyl- 4- (morpholin- 4- yl)- 1H- pyrazolo[3,4- d]pyrimidine
Smiles: Clc1cccc(c1)N1CCN(CC1)c1nc(N2CCOCC2)c2c(n1)n(C)nc2

STK639738
Synonyms: N- [4- (propan- 2- yl)phenyl]- N~3~- 7H- purin- 6- yl- beta- alaninamide
Smiles: O=C(Nc1ccc(cc1)C(C)C)CCNc1ncnc2c1[nH]cn2

STK639739
Synonyms: 2,3- dihydro- 1H- indol- 1- yl[2- (trifluoromethyl)- 1H- benzimidazol- 6- yl]methanone
Smiles: O=C(N1CCc2c1cccc2)c1ccc2c(c1)[nH]c(n2)C(F)(F)F

STK857748
Synonyms: propyl(3,5- dihydroxy- 1,2,4- triazin- 6- yl)acetate
Smiles: CCCOC(=O)Cc1nnc(nc1O)O

STK639741
Synonyms: [4- (2,1,3- benzoxadiazol- 4- ylsulfonyl)piperazin- 1- yl](1H- indol- 6- yl)methanone
Smiles: O=C(c1ccc2c(c1)[nH]cc2)N1CCN(CC1)S(=O)(=O)c1cccc2c1non2

STK857749
Synonyms: N- (1,3- benzodioxol- 5- yl)- 1- methyl- 1H- pyrazolo[3,4- d]pyrimidin- 4- amine
Smiles: Cn1ncc2c1ncnc2Nc1ccc2c(c1)OCO2

STK639742
Synonyms: N- [(2Z)- 5- ethyl- 1,3,4- thiadiazol- 2(3H)- ylidene]- 3- (morpholin- 4- ylsulfonyl)benzamide
Smiles: CCc1n[nH]/c(=N/C(=O)c2cccc(c2)S(=O)(=O)N2CCOCC2)/s1

STK639743
Synonyms: 9- (2- fluorophenyl)- 6,7,9,10- tetrahydro- 5H- [1,2,5]oxadiazolo[3,4- b][1,4]benzodiazepin- 8- ol
Smiles: OC1=C2C(=Nc3c(NC2c2ccccc2F)non3)CCC1

STK639747
Synonyms: 6- fluoro- 4- oxo- N- (1,3- thiazol- 2- yl)- 1,4- dihydroquinoline- 3- carboxamide
Smiles: Fc1ccc2c(c1)c(=O)c(c[nH]2)C(=O)Nc1nccs1

STK639748
Synonyms: 2- (4- chlorophenyl)- N- (1,3- dihydro- 2H- benzimidazol- 2- ylidene)- 4- methyl- 1,3- thiazole- 5- carboxamide
Smiles: O=C(c1sc(nc1C)c1ccc(cc1)Cl)/N=c/1\[nH]c2c([nH]1)cccc2

STK639750
Synonyms: ethyl(2Z)- 2- {[(3- phenyl- 5,6- dihydro- 1,4- oxathiin- 2- yl)carbonyl]imino}- 2,3- dihydro- 1,3- benzothiazole- 6- carboxylate
Smiles: CCOC(=O)c1ccc2c(c1)s/c(=N\C(=O)C1=C(SCCO1)c1ccccc1)/[nH]2

STK639751
Synonyms: ethyl[1- (3- chloro- 4- fluorophenyl)- 2- hydroxy- 5- oxo- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]carbamate
Smiles: CCOC(=O)NC1(N=C(N(C1=O)c1ccc(c(c1)Cl)F)O)C(F)(F)F

STK639754
Synonyms: 4- [3- (3- chlorophenyl)- 1,2,4- oxadiazol- 5- yl]- 1- phenylpyrrolidin- 2- one
Smiles: Clc1cccc(c1)c1noc(n1)C1CN(C(=O)C1)c1ccccc1

STK639756
Synonyms: N- [4- (1- benzofuran- 2- ylcarbonyl)phenyl]cyclopropanecarboxamide
Smiles: O=C(C1CC1)Nc1ccc(cc1)C(=O)c1cc2c(o1)cccc2

STK857752
Synonyms: 3- (4- chlorophenyl)- 5- [5- (furan- 2- yl)- 1H- pyrazol- 3- yl]- 1,2,4- oxadiazole
Smiles: Clc1ccc(cc1)c1noc(n1)c1n[nH]c(c1)c1ccco1

STK639759
Synonyms: N- {3- [4- (4- chlorophenyl)- 4- hydroxypiperidin- 1- yl]- 3- oxopropyl}- 1,3,4,9- tetrahydro- 2H- beta- carboline- 2- carboxamide
Smiles: Clc1ccc(cc1)C1(O)CCN(CC1)C(=O)CCNC(=O)N1CCc2c(C1)[nH]c1c2cccc1

STK639761
Synonyms: 7- (4- hydroxyphenyl)- 2- (methylsulfanyl)- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine- 5- carboxylicacid
Smiles: CSc1[nH]c2=NC(=CC(n2n1)c1ccc(cc1)O)C(=O)O

STK639766
Synonyms: N- [(2E)- 4- (2,3- dihydro- 1,4- benzodioxin- 2- yl)- 1,3- thiazol- 2(3H)- ylidene]- 4- methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)/N=c\1/scc([nH]1)C1COc2c(O1)cccc2

STK639768
Synonyms: 2- [6- (1- phenoxyethyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 3- yl]quinoline
Smiles: CC(c1sc2n(n1)c(nn2)c1ccc2c(n1)cccc2)Oc1ccccc1

STK639769
Synonyms: 6- (3,4- dimethoxyphenyl)- 2- (4- phenylpiperazin- 1- yl)pyrimidin- 4- ol
Smiles: COc1ccc(cc1OC)c1cc(O)nc(n1)N1CCN(CC1)c1ccccc1

STK639774
Synonyms: 1- phenyl- 3- [1- (pyridin- 3- ylcarbonyl)- 2,3- dihydro- 1H- indol- 6- yl]urea
Smiles: O=C(Nc1ccccc1)Nc1ccc2c(c1)N(CC2)C(=O)c1cccnc1

STK639777
Synonyms: 3- (2- methoxyphenyl)- 6- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1ccccc1c1nnc2n1nc(s2)c1n[nH]c(c1)CC(C)C

STK639782
Synonyms: N- (1,1- dioxido- 2,3- dihydrothiophen- 3- yl)- 3- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)propanamide
Smiles: O=C(NC1C=CS(=O)(=O)C1)CCn1c(O)nc2c(c1=O)cccc2

STK639783
Synonyms: ethyl(2E)- 2- [(3,5- dihydroxy- 1,2,4- triazin- 6- yl)sulfanyl]- 3- hydroxybut- 2- enoate
Smiles: CCOC(=O)/C(=C(\O)/C)/Sc1nnc(nc1O)O

STK639784
Synonyms: 3- phenylisoquinoline- 1,4- diol
Smiles: Oc1nc(c2ccccc2)c(c2c1cccc2)O

STK639791
Synonyms: (4E)- 5- (furan- 2- yl)- 4- [furan- 2- yl(hydroxy)methylidene]- 1- [5- (propan- 2- yl)- 1,3,4- thiadiazol- 2- yl]pyrrolidine- 2,3- dione
Smiles: O=C1C(=O)/C(=C(\c2ccco2)/O)/C(N1c1nnc(s1)C(C)C)c1ccco1

STK639795
Synonyms: 2- (4- methoxyphenyl)- 4,5- dimethyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: COc1ccc(cc1)n1[nH]c(c(c1=O)C)C

STK857753
Synonyms: 1- [(4- hydroxyquinolin- 3- yl)carbonyl]piperidine- 4- carboxamide
Smiles: NC(=O)C1CCN(CC1)C(=O)c1cnc2c(c1O)cccc2

STK639799
Synonyms: 4- chloro- 3- (1,1- dioxido- 1,2- thiazinan- 2- yl)- N- phenylbenzamide
Smiles: O=C(c1ccc(c(c1)N1CCCCS1(=O)=O)Cl)Nc1ccccc1

STK639800
Synonyms: 4,5- dimethoxy- N- (4- {[(2E)- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]amino}- 4- oxobutyl)- 1H- indole- 2- carboxamide
Smiles: COc1c(OC)ccc2c1cc([nH]2)C(=O)NCCCC(=O)/N=c\1/scc([nH]1)C

STK639801
Synonyms: 8- [3- (2,3- difluorophenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl]tetrazolo[1,5- a]pyridine
Smiles: Fc1c(F)cccc1c1nnc2n1nc(s2)c1cccn2c1nnn2

STK639804
Synonyms: N- (1,3- dihydro- 2H- benzimidazol- 2- ylidene)- 3- (1- oxo- 1,3- dihydro- 2H- isoindol- 2- yl)propanamide
Smiles: O=C(/N=c/1\[nH]c2c([nH]1)cccc2)CCN1Cc2c(C1=O)cccc2

STK639806
Synonyms: 2- (quinolin- 8- yloxy)pyridine- 3- carboxylicacid
Smiles: OC(=O)c1cccnc1Oc1cccc2c1nccc2

STK639807
Synonyms: 1- [4- (2,1,3- benzothiadiazol- 4- ylsulfonyl)piperazin- 1- yl]- 2- methoxyethanone
Smiles: COCC(=O)N1CCN(CC1)S(=O)(=O)c1cccc2c1nsn2

STK639810
Synonyms: 1- ethyl- 7- methyl- N- [2- (morpholin- 4- yl)ethyl]- 4- oxo- 1,4- dihydro- 1,8- naphthyridine- 3- carboxamide
Smiles: CCn1cc(C(=O)NCCN2CCOCC2)c(=O)c2c1nc(C)cc2

STK639811
Synonyms: 10a- [(E)- 2- (4- methoxyphenyl)ethenyl]- 10,10- dimethyl- 3,4,10,10a- tetrahydropyrimido[1,2- a]indol- 2- ol
Smiles: COc1ccc(cc1)/C=C/C12N=C(O)CCN1c1c(C2(C)C)cccc1

STK639813
Synonyms: N~3~- {[(4- hydroxy- 1- phenyl- 1H- pyrazolo[3,4- d]pyrimidin- 6- yl)methyl]carbamoyl}- N- propan- 2- yl- beta- alaninamide
Smiles: CC(NC(=O)CCNC(=O)NCc1nc(O)c2c(n1)n(nc2)c1ccccc1)C

STK639814
Synonyms: (4- methoxy- 1H- indol- 2- yl)[4- ([1,2,4]triazolo[4,3- a]pyridin- 3- yl)piperidin- 1- yl]methanone
Smiles: COc1cccc2c1cc([nH]2)C(=O)N1CCC(CC1)c1nnc2n1cccc2

STK639816
Synonyms: N- (6- methyl- 2H- pyrazolo[3,4- b]pyridin- 3- yl)- N'- (pyridin- 3- ylmethyl)ethanediamide
Smiles: Cc1ccc2c(n1)n[nH]c2NC(=O)C(=O)NCc1cccnc1

STK639817
Synonyms: N- {2- [(2,1,3- benzothiadiazol- 4- ylsulfonyl)amino]ethyl}- 1H- indole- 4- carboxamide
Smiles: O=C(c1cccc2c1cc[nH]2)NCCNS(=O)(=O)c1cccc2c1nsn2

STK639818
Synonyms: N- [1- (pyridin- 3- ylcarbonyl)- 2,3- dihydro- 1H- indol- 6- yl]cyclohexanecarboxamide
Smiles: O=C(C1CCCCC1)Nc1ccc2c(c1)N(CC2)C(=O)c1cccnc1

STK639819
Synonyms: [3- (3- methoxyphenyl)- 5- (quinoxalin- 6- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl](thiophen- 2- yl)methanone
Smiles: COc1cccc(c1)C1=NN(C(C1)c1ccc2c(c1)nccn2)C(=O)c1cccs1

STK639821
Synonyms: 3- [2- oxo- 2- (pyrrolidin- 1- yl)ethoxy]- 1- phenyl- 6,7- dihydro- 5H- cyclopenta[c]pyridine- 4- carbonitrile
Smiles: N#Cc1c(OCC(=O)N2CCCC2)nc(c2c1CCC2)c1ccccc1

STK639823
Synonyms: methyl(2Z)- 4- amino- 4- oxo- 3- [(4- sulfamoylphenyl)amino]but- 2- enoate
Smiles: COC(=O)/C=C(/C(=O)N)\Nc1ccc(cc1)S(=O)(=O)N

STK639825
Synonyms: (4- benzylpiperidin- 1- yl)(2- methyl- 1H- indol- 3- yl)aceticacid
Smiles: OC(=O)C(c1c(C)[nH]c2c1cccc2)N1CCC(CC1)Cc1ccccc1

STK639829
Synonyms: (3S,4R)- N- (furan- 2- ylmethyl)- 4- [(2- methoxy- 5- methylphenyl)sulfonyl]tetrahydrothiophen- 3- amine1,1- dioxide
Smiles: COc1ccc(cc1S(=O)(=O)[C@H]1CS(=O)(=O)C[C@@H]1NCc1ccco1)C

STK639831
Synonyms: 2- methyl- 4- oxo- N- (2- phenylethyl)- 1,4- dihydroquinoline- 6- carboxamide
Smiles: O=C(c1ccc2c(c1)c(=O)cc([nH]2)C)NCCc1ccccc1

STK639832
Synonyms: 5- methoxy- N- {(2S)- 1- [4- (4- methoxyphenyl)piperazin- 1- yl]- 1- oxopropan- 2- yl}- 1- methyl- 1H- indole- 2- carboxamide
Smiles: COc1ccc(cc1)N1CCN(CC1)C(=O)[C@@H](NC(=O)c1cc2c(n1C)ccc(c2)OC)C

STK639833
Synonyms: (3E)- 3- (2- bromobenzylidene)- 6- methyl- 3,6- dihydropyrazine- 2,5- diol
Smiles: OC1=N/C(=C/c2ccccc2Br)/C(=NC1C)O

STK639834
Synonyms: 7- imino- 2- (methoxymethyl)- 3- (4- methoxyphenyl)- 4,7- dihydropyrazolo[1,5- a]pyrimidine- 6- carbonitrile
Smiles: COCc1nn2c(c1c1ccc(cc1)OC)[nH]cc(c2=N)C#N

STK639840
Synonyms: 5- fluoro- 2- (1H- tetrazol- 1- yl)- N- [3- (trifluoromethyl)phenyl]benzamide
Smiles: Fc1ccc(c(c1)C(=O)Nc1cccc(c1)C(F)(F)F)n1cnnn1

STK639841
Synonyms: 2- {[5- cyano- 8- (furan- 2- yl)- 3,3- dimethyl- 3,4- dihydro- 1H- pyrano[3,4- c]pyridin- 6- yl]oxy}- N- (tetrahydrofuran- 2- ylmethyl)acetamide
Smiles: N#Cc1c(OCC(=O)NCC2CCCO2)nc(c2c1CC(C)(C)OC2)c1ccco1

STK639843
Synonyms: N- [4- (1H- 1,2,4- triazol- 1- ylmethyl)phenyl]- 1H- benzimidazole- 6- carboxamide
Smiles: O=C(c1ccc2c(c1)[nH]cn2)Nc1ccc(cc1)Cn1cncn1

STK639849
Synonyms: N- (3,5- dichlorophenyl)- 4- fluoro- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: Fc1ccc(c(c1)n1cnnn1)C(=O)Nc1cc(Cl)cc(c1)Cl

STK639850
Synonyms: 2- [(3,5- dihydroxy- 1,2,4- triazin- 6- yl)amino]- N'- [(E)- pyridin- 3- ylmethylidene]propanehydrazide(non- preferredname)
Smiles: O=C(C(Nc1nnc(nc1O)O)C)N/N=C/c1cccnc1

STK639852
Synonyms: N- {(2S)- 1- [(furan- 2- ylmethyl)amino]- 4- methyl- 1- oxopentan- 2- yl}- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: CC(C[C@@H](C(=O)NCc1ccco1)NC(=O)c1ccc2c(c1)sc(n2)n1cccc1)C

STK639856
Synonyms: methylN- {[2- (1H- tetrazol- 1- yl)phenyl]carbonyl}- L- isoleucinate
Smiles: CC[C@@H]([C@@H](C(=O)OC)NC(=O)c1ccccc1n1cnnn1)C

STK639858
Synonyms: N- (3- chloro- 4- methoxyphenyl)- 1- methyl- 1H- pyrazolo[3,4- d]pyrimidin- 4- amine
Smiles: COc1ccc(cc1Cl)Nc1ncnc2c1cnn2C

STK639860
Synonyms: 2- [(4- hydroxy- 6- methylpyrimidin- 2- yl)sulfanyl]- N- [(2E)- 5- (methylsulfanyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]acetamide
Smiles: CSc1n[nH]/c(=N\C(=O)CSc2nc(C)cc(n2)O)/s1

STK639861
Synonyms: 1- [(3,3- diphenylpropyl)(methyl)amino]- 2- methylpropan- 2- ylmethyl2,6- dimethyl- 4- (3- nitrophenyl)- 1,4- dihydropyridine- 3,5- dicarboxylate
Smiles: COC(=O)C1=C(C)NC(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)OC(CN(CCC(c1ccccc1)c1ccccc1)C)(C)C)C

STK639863
Synonyms: methyl2- hydroxy- 6- [3- (4- methoxyphenyl)- 1- phenyl- 1H- pyrazol- 4- yl]- 4- methyl- 1,6- dihydropyrimidine- 5- carboxylate
Smiles: COc1ccc(cc1)c1nn(cc1C1NC(=NC(=C1C(=O)OC)C)O)c1ccccc1

STK639865
Synonyms: 2- {(2E)- 2- [(methylsulfonyl)imino]- 2,3- dihydro- 1,3- thiazol- 4- yl}- N- (2- oxo- 2H- chromen- 6- yl)acetamide
Smiles: O=C(Cc1cs/c(=N/S(=O)(=O)C)/[nH]1)Nc1ccc2c(c1)ccc(=O)o2

STK639867
Synonyms: 9- cyclopentyl- 3- phenyl- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: O=c1c(coc2c1ccc1c2CN(CO1)C1CCCC1)c1ccccc1

STK639868
Synonyms: 3- (4- methoxyphenyl)- 9- (2,2,6,6- tetramethylpiperidin- 4- yl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1)c1coc2c(c1=O)ccc1c2CN(CO1)C1CC(C)(C)NC(C1)(C)C

STK639869
Synonyms: 2- benzyl- 10,10- dimethyl- 6- (2- oxo- 2- phenylethyl)- 6,8,10,11- tetrahydro- 5H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 5- one
Smiles: O=C(c1ccccc1)Cn1c2sc3c(c2c2n(c1=O)nc(n2)Cc1ccccc1)CC(OC3)(C)C

STK639870
Synonyms: (2E)- 2- (acetylimino)- N- (1,1- dioxido- 2,3- dihydrothiophen- 3- yl)- 2,3- dihydro- 1,3- benzothiazole- 6- carboxamide
Smiles: CC(=O)/N=c/1\[nH]c2c(s1)cc(cc2)C(=O)NC1C=CS(=O)(=O)C1

STK639874
Synonyms: (5- methoxy- 1H- indol- 3- yl){4- [2- (morpholin- 4- yl)- 2- oxoethyl]piperazin- 1- yl}aceticacid
Smiles: COc1ccc2c(c1)c(c[nH]2)C(C(=O)O)N1CCN(CC1)CC(=O)N1CCOCC1

STK857754
Synonyms: N- (3,4- dimethoxybenzyl)- 3- [2- methyl- 4- (thiophen- 2- yl)- 1,3- thiazol- 5- yl]propanamide
Smiles: COc1cc(CNC(=O)CCc2sc(nc2c2cccs2)C)ccc1OC

STK639876
Synonyms: 2- {6- [(2- methoxyphenoxy)methyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 3- yl}quinoline
Smiles: COc1ccccc1OCc1sc2n(n1)c(nn2)c1ccc2c(n1)cccc2

STK639877
Synonyms: N- (2,3- dihydro- 1H- inden- 2- yl)- 2- [(2- hydroxy- 4,5- dihydro- 3H- 1- benzazepin- 3- yl)sulfanyl]acetamide
Smiles: O=C(NC1Cc2c(C1)cccc2)CSC1CCc2c(N=C1O)cccc2

STK639880
Synonyms: 2- {2- oxo- 2- [4- ([1,2,4]triazolo[4,3- a]pyridin- 3- yl)piperidin- 1- yl]ethyl}- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C(N1CCC(CC1)c1nnc2n1cccc2)CN1C(=O)c2c(C1=O)cccc2

STK639881
Synonyms: ethyl4- {[5- fluoro- 2- (1H- tetrazol- 1- yl)phenyl]carbonyl}piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)c1cc(F)ccc1n1cnnn1

STK639882
Synonyms: N- [(2E)- 6- {[4- (pyridin- 2- yl)piperazin- 1- yl]carbonyl}- 1,3- benzothiazol- 2(3H)- ylidene]acetamide
Smiles: CC(=O)/N=c/1\[nH]c2c(s1)cc(cc2)C(=O)N1CCN(CC1)c1ccccn1

STK639884
Synonyms: (2Z)- 5- methyl- 2- [(methylsulfonyl)imino]- 2,3- dihydro- 1,3- thiazole- 4- carboxylicacid
Smiles: OC(=O)c1[nH]/c(=N/S(=O)(=O)C)/sc1C

STK639886
Synonyms: N- (1,1- dioxido- 2,3- dihydrothiophen- 3- yl)- 2- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)acetamide
Smiles: O=C(Cn1nnc2c(c1=O)cccc2)NC1C=CS(=O)(=O)C1

STK639887
Synonyms: 6- (3,4- dimethoxyphenyl)- 2- hydroxypyridine- 3- carbonitrile
Smiles: COc1ccc(cc1OC)c1ccc(c(n1)O)C#N

STK639888
Synonyms: 3- (3,4,6- trimethyl- 1- phenyl- 1H- pyrazolo[3,4- b]pyridin- 5- yl)propanoicacid
Smiles: OC(=O)CCc1c(C)nc2c(c1C)c(C)nn2c1ccccc1

STK639891
Synonyms: 1- methyl- 5- oxo- 2- phenyl- N- (pyridin- 2- yl)pyrrolidine- 3- carboxamide
Smiles: CN1C(=O)CC(C1c1ccccc1)C(=O)Nc1ccccn1

STK639896
Synonyms: [4- (2- cyanoethyl)piperazin- 1- yl](5- methoxy- 1H- indol- 3- yl)aceticacid
Smiles: COc1ccc2c(c1)c(c[nH]2)C(C(=O)O)N1CCN(CC1)CCC#N

STK639899
Synonyms: N- [2- chloro- 5- (trifluoromethyl)phenyl]- 4- fluoro- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: Fc1ccc(c(c1)n1cnnn1)C(=O)Nc1cc(ccc1Cl)C(F)(F)F

STK639900
Synonyms: 5- ethyl- 8- oxo- N- (pyridin- 3- yl)- 5,8- dihydro[1,3]dioxolo[4,5- g]quinoline- 7- carboxamide
Smiles: CCn1cc(C(=O)Nc2cccnc2)c(=O)c2c1cc1OCOc1c2

STK639902
Synonyms: (7E)- 7- (3,4- dimethoxybenzylidene)- 9- methyl- 3- [3- (morpholin- 4- yl)propyl]- 3,4- dihydro- 2H- furo[3,2- g][1,3]benzoxazin- 6(7H)- one
Smiles: COc1cc(ccc1OC)/C=C\1/Oc2c(C1=O)cc1c(c2C)OCN(C1)CCCN1CCOCC1

STK639905
Synonyms: (2E)- 2- (4- hydroxyquinazolin- 2- yl)- 3- {1- methyl- 5- [3- (trifluoromethyl)phenyl]- 1H- pyrrol- 2- yl}prop- 2- enenitrile
Smiles: N#C/C(=C\c1ccc(n1C)c1cccc(c1)C(F)(F)F)/c1nc(O)c2c(n1)cccc2

STK639906
Synonyms: 4,5- dimethoxy- N- (1- {[(2E)- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]amino}- 1- oxopropan- 2- yl)- 1H- indole- 2- carboxamide
Smiles: COc1c(OC)ccc2c1cc([nH]2)C(=O)NC(C(=O)/N=c\1/scc([nH]1)C)C

STK639908
Synonyms: 4- [2- (6- hydroxy- 4- methyl- 3- oxo- 2- phenyl- 2,3- dihydro- 5H- pyrazolo[4,3- c]pyridin- 5- yl)ethyl]benzenesulfonamide
Smiles: Oc1cc2nn(c(=O)c2c(n1CCc1ccc(cc1)S(=O)(=O)N)C)c1ccccc1

STK639910
Synonyms: 2- (6- bromo- 1H- indol- 1- yl)- 1- [4- (3- methoxyphenyl)piperazin- 1- yl]ethanone
Smiles: COc1cccc(c1)N1CCN(CC1)C(=O)Cn1ccc2c1cc(Br)cc2

STK639913
Synonyms: N- [1- (3,4- dimethoxybenzyl)- 3- methyl- 1H- pyrazol- 5- yl]- 3- fluorobenzamide
Smiles: COc1cc(ccc1OC)Cn1nc(cc1NC(=O)c1cccc(c1)F)C

STK639914
Synonyms: 4- amino- N- (4- chlorophenyl)- 7- hydroxy- 2- (piperidin- 1- yl)- 5,6- dihydropyrido[2,3- d]pyrimidine- 5- carboxamide
Smiles: OC1=Nc2nc(nc(c2C(C1)C(=O)Nc1ccc(cc1)Cl)N)N1CCCCC1

STK639917
Synonyms: ethyl6- [5- (2,5- dichlorophenyl)furan- 2- yl]- 2- hydroxy- 4- methyl- 1,6- dihydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)C1=C(C)N=C(NC1c1ccc(o1)c1cc(Cl)ccc1Cl)O

STK639918
Synonyms: 2- (5- methyl- 8- oxo- 1,3,4,8- tetrahydropyrimido[4',5':4,5]furo[2,3- c]isoquinolin- 9(2H)- yl)acetamide
Smiles: NC(=O)Cn1cnc2c(c1=O)oc1c2c2CCCCc2c(n1)C

STK639919
Synonyms: 5- bromo- N- (2- methoxyethyl)- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: COCCNC(=O)c1cc(Br)ccc1n1cnnn1

STK639920
Synonyms: ethyl4- [N- (1- benzofuran- 2- ylcarbonyl)- L- alanyl]piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)[C@@H](NC(=O)c1cc2c(o1)cccc2)C

STK639921
Synonyms: 6- chloro- N- [2- (cyclohex- 1- en- 1- yl)ethyl]imidazo[1,2- a]pyridine- 2- carboxamide
Smiles: Clc1ccc2n(c1)cc(n2)C(=O)NCCC1=CCCCC1

STK639922
Synonyms: (8- chloro- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)(4,7- dimethoxy- 1H- indol- 2- yl)methanone
Smiles: COc1ccc(c2c1[nH]c(c2)C(=O)N1CCc2c(C1)c1cc(Cl)ccc1[nH]2)OC

STK639930
Synonyms: N- [2- (4- hydroxyphenyl)ethyl]- 3- (1H- indol- 3- ylmethyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: Oc1ccc(cc1)CCNC(=O)c1onc(n1)Cc1c[nH]c2c1cccc2

STK639933
Synonyms: 3- (4- bromobenzyl)- 7,7- dimethyl- 6,9- dihydro- 7H- pyrano[3',4':4,5]thieno[3,2- d]pyrimidin- 4(3H)- one
Smiles: Brc1ccc(cc1)Cn1cnc2c(c1=O)sc1c2COC(C1)(C)C

STK639934
Synonyms: N- [3- (2,3- dihydro- 1,4- benzodioxin- 6- ylamino)- 3- oxopropyl]- 4,7- dimethoxy- 1H- indole- 2- carboxamide
Smiles: COc1ccc(c2c1[nH]c(c2)C(=O)NCCC(=O)Nc1ccc2c(c1)OCCO2)OC

STK639935
Synonyms: N- {(2E)- 3- cyano- 5- oxo- 1- [3- (propan- 2- yloxy)propyl]- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidin- 2- ylidene}- 3,4- dimethoxybenzamide
Smiles: N#Cc1cc2c(n(/c/1=N/C(=O)c1ccc(c(c1)OC)OC)CCCOC(C)C)nc1n(c2=O)cccc1

STK639937
Synonyms: (2Z)- 2- (acetylimino)- N- [2- (1H- indol- 3- yl)ethyl]- 2,3- dihydro- 1,3- benzothiazole- 6- carboxamide
Smiles: CC(=O)/N=c\1/[nH]c2c(s1)cc(cc2)C(=O)NCCc1c[nH]c2c1cccc2

STK639938
Synonyms: 3- methyl- 1- (2- methylprop- 2- en- 1- yl)- 5- (2- methylpropyl)thieno[2,3- d]pyrimidine- 2,4(1H,3H)- dione
Smiles: CC(Cc1csc2c1c(=O)n(c(=O)n2CC(=C)C)C)C

STK639939
Synonyms: N- [4- chloro- 3- (trifluoromethyl)phenyl]- 4- hydroxy- 7- oxo- 2- (piperidin- 1- yl)- 5,6,7,8- tetrahydropyrido[2,3- d]pyrimidine- 5- carboxamide
Smiles: O=C1Nc2nc(nc(c2C(C1)C(=O)Nc1ccc(c(c1)C(F)(F)F)Cl)O)N1CCCCC1

STK639941
Synonyms: N- {3- [(furan- 2- ylmethyl)amino]- 3- oxopropyl}- 4,7- dimethoxy- 1H- indole- 2- carboxamide
Smiles: COc1ccc(c2c1[nH]c(c2)C(=O)NCCC(=O)NCc1ccco1)OC

STK639946
Synonyms: 2- methoxy- N- methyl- 5- (4- methyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)- N- [2- (pyridin- 4- yl)ethyl]benzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)N(CCc1ccncc1)C)N1C(=O)C(CS1(=O)=O)C

STK639947
Synonyms: 7- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 2- (methylsulfanyl)- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine- 5- carboxylicacid
Smiles: CSc1nn2c(=NC(=CC2c2ccc3c(c2)OCCO3)C(=O)O)[nH]1

STK639949
Synonyms: 3- (7- methoxy- 2- oxo- 4- phenyl- 2H- chromen- 6- yl)- N- (pyridin- 2- ylmethyl)propanamide
Smiles: COc1cc2oc(=O)cc(c2cc1CCC(=O)NCc1ccccn1)c1ccccc1

STK639951
Synonyms: 3,4- dihydroisoquinolin- 2(1H)- yl[2- (1H- tetrazol- 1- yl)phenyl]methanone
Smiles: O=C(c1ccccc1n1cnnn1)N1CCc2c(C1)cccc2

STK639952
Synonyms: 3- (1H- indol- 4- ylmethyl)- 2- (2- methylpropyl)- 3,4- dihydro- 2H- 1,2- benzothiazin- 4- ol1,1- dioxide
Smiles: CC(CN1C(Cc2cccc3c2cc[nH]3)C(O)c2c(S1(=O)=O)cccc2)C

STK639955
Synonyms: 1- ethyl- 7- methyl- 3- {[4- (methylsulfonyl)piperazin- 1- yl]carbonyl}- 1,8- naphthyridin- 4(1H)- one
Smiles: CCn1cc(C(=O)N2CCN(CC2)S(=O)(=O)C)c(=O)c2c1nc(C)cc2

STK639956
Synonyms: 6- hydroxy- 8- [(2- hydroxyethyl)sulfanyl]- 7- [2- hydroxy- 3- (naphthalen- 1- yloxy)propyl]- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: OCCSc1nc2c(n1CC(COc1cccc3c1cccc3)O)c(O)nc(=O)n2C

STK639957
Synonyms: N- [(2Z)- 5- methoxy[1,3]thiazolo[4,5- f]quinolin- 2(1H)- ylidene]- 3- nitrobenzamide
Smiles: COc1cc2s/c(=N\C(=O)c3cccc(c3)[N+](=O)[O-])/[nH]c2c2c1nccc2

STK639959
Synonyms: 4- hydroxy- 1,6,7- trimethyl- 8- [3- (4- methylpiperazin- 1- yl)propyl]- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: CN1CCN(CC1)CCCn1c2nc3c(n2c(c1C)C)c(O)nc(=O)n3C

STK639961
Synonyms: 3- {(5E)- 5- [(6- chloro[1,3]dioxolo[4,5- g]quinolin- 7- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}propanoicacid
Smiles: OC(=O)CCN1C(=O)/C(=C\c2cc3cc4OCOc4cc3nc2Cl)/SC1=S

STK639962
Synonyms: 3- (6- fluoro- 1H- indol- 1- yl)- N- [2- (5- fluoro- 1H- indol- 3- yl)ethyl]propanamide
Smiles: O=C(CCn1ccc2c1cc(F)cc2)NCCc1c[nH]c2c1cc(F)cc2

STK639971
Synonyms: ethyl[(4- cyano- 1- methyl- 5,6,7,8- tetrahydroisoquinolin- 3- yl)oxy]acetate
Smiles: CCOC(=O)COc1nc(C)c2c(c1C#N)CCCC2

STK639972
Synonyms: N- [2- (4- fluorophenyl)- 4- oxo- 4H- chromen- 6- yl]- 3- (3- methoxy- 1,2- oxazol- 5- yl)propanamide
Smiles: COc1noc(c1)CCC(=O)Nc1ccc2c(c1)c(=O)cc(o2)c1ccc(cc1)F

STK639974
Synonyms: 2- [(4S)- 1- (1,3- benzodioxol- 5- ylmethyl)- 2,5- dioxoimidazolidin- 4- yl]- N- (5- methyl- 1,3- thiazol- 2- yl)acetamide
Smiles: O=C(C[C@@H]1NC(=O)N(C1=O)Cc1ccc2c(c1)OCO2)Nc1ncc(s1)C

STK639978
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 2- [2- (2- fluorophenyl)- 1,3- thiazol- 5- yl]acetamide
Smiles: COc1cc(CCNC(=O)Cc2cnc(s2)c2ccccc2F)ccc1OC

STK639979
Synonyms: N,N- diethyl- N'- (6- phenylpyridazin- 3- yl)ethane- 1,2- diamine
Smiles: CCN(CCNc1ccc(nn1)c1ccccc1)CC

STK639983
Synonyms: tert- butyl2- hydroxy- 4- methyl- 6- (thiophen- 2- yl)- 1,6- dihydropyrimidine- 5- carboxylate
Smiles: OC1=NC(=C(C(N1)c1cccs1)C(=O)OC(C)(C)C)C

STK639987
Synonyms: 9- cyclohexyl- 3- (4- methoxyphenyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1)c1coc2c(c1=O)ccc1c2CN(CO1)C1CCCCC1

STK639989
Synonyms: [4- (ethoxycarbonyl)piperazin- 1- yl](1H- indol- 3- yl)aceticacid
Smiles: CCOC(=O)N1CCN(CC1)C(c1c[nH]c2c1cccc2)C(=O)O

STK639992
Synonyms: 1- (3,5- dimethoxyphenyl)- 3- (4- hydroxy- 5,6- dimethylpyrimidin- 2- yl)guanidine
Smiles: COc1cc(NC(=N)Nc2nc(C)c(c(n2)O)C)cc(c1)OC

STK639993
Synonyms: N- (2- chlorobenzyl)- 3- (pyridin- 4- yl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)c1ccncc1)NCc1ccccc1Cl

STK639995
Synonyms: N- (2- {[2- (morpholin- 4- yl)ethyl]amino}- 2- oxoethyl)- 1,3,4,9- tetrahydro- 2H- beta- carboline- 2- carboxamide
Smiles: O=C(CNC(=O)N1CCc2c(C1)[nH]c1c2cccc1)NCCN1CCOCC1

STK639996
Synonyms: N- [1- (pyridin- 3- ylcarbonyl)- 2,3- dihydro- 1H- indol- 5- yl]methanesulfonamide
Smiles: O=C(N1CCc2c1ccc(c2)NS(=O)(=O)C)c1cccnc1

STK640000
Synonyms: 3- ({6- [(4- fluorophenoxy)methyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 3- yl}methyl)- 1H- indole
Smiles: Fc1ccc(cc1)OCc1nn2c(s1)nnc2Cc1c[nH]c2c1cccc2

STK640001
Synonyms: 3- cyclohexyl- N- {1- [2- (4- fluorophenyl)ethyl]- 2- hydroxy- 5- oxo- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl}propanamide
Smiles: O=C(NC1(N=C(N(C1=O)CCc1ccc(cc1)F)O)C(F)(F)F)CCC1CCCCC1

STK640002
Synonyms: 3- (3- chloro- 1,2- oxazol- 5- yl)- N- [2- (4- chlorophenyl)- 4- oxo- 4H- chromen- 6- yl]propanamide
Smiles: O=C(Nc1ccc2c(c1)c(=O)cc(o2)c1ccc(cc1)Cl)CCc1onc(c1)Cl

STK640003
Synonyms: ethyl[(4- cyano- 1- phenyl- 6,7- dihydro- 5H- cyclopenta[c]pyridin- 3- yl)oxy]acetate
Smiles: CCOC(=O)COc1nc(c2ccccc2)c2c(c1C#N)CCC2

STK640004
Synonyms: 3- [(2E)- 2- (2- bromobenzylidene)hydrazinyl]- 6- methyl- 1,2,4- triazin- 5- ol
Smiles: Brc1ccccc1/C=N/Nc1nnc(c(n1)O)C

STK640010
Synonyms: 3- (3- hydroxy- 6- phenylimidazo[1,2- b][1,2,4]triazin- 2- yl)propanoicacid
Smiles: OC(=O)CCc1nn2cc(nc2nc1O)c1ccccc1

STK640011
Synonyms: N- [3- (cyclopropylamino)- 3- oxopropyl]- 5- oxo- 1- phenylpyrrolidine- 3- carboxamide
Smiles: O=C(NC1CC1)CCNC(=O)C1CC(=O)N(C1)c1ccccc1

STK640014
Synonyms: 2- [3- (4- bromophenyl)- 1,2,4- oxadiazol- 5- yl]pyrazine
Smiles: Brc1ccc(cc1)c1noc(n1)c1cnccn1

STK640016
Synonyms: 6- [5- (4- methoxyphenyl)- 1,2- oxazol- 3- yl]- 3- phenyl[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1ccc(cc1)c1onc(c1)c1sc2n(n1)c(nn2)c1ccccc1

STK640017
Synonyms: N- (3,4- dimethoxybenzyl)- 2,2- dimethyltetrahydro- 2H- pyran- 4- amine
Smiles: COc1cc(CNC2CCOC(C2)(C)C)ccc1OC

STK857761
Synonyms: 3- [(3,5- dihydroxy- 1,2,4- triazin- 6- yl)amino]- N'- [(E)- (2,4- dimethoxyphenyl)methylidene]propanehydrazide(non- preferredname)
Smiles: COc1cc(OC)ccc1/C=N/NC(=O)CCNc1nnc(nc1O)O

STK857762
Synonyms: N- [3- (morpholin- 4- yl)propyl]- 2- [5- (pyridin- 4- yl)- 4H- 1,2,4- triazol- 3- yl]acetamide
Smiles: O=C(Cc1nnc([nH]1)c1ccncc1)NCCCN1CCOCC1

STK640019
Synonyms: {[4- cyano- 1- (furan- 2- yl)- 6,7- dihydro- 5H- cyclopenta[c]pyridin- 3- yl]oxy}aceticacid
Smiles: N#Cc1c(OCC(=O)O)nc(c2c1CCC2)c1ccco1

STK640022
Synonyms: 6- chloro- N- [2- (2,3- dihydro- 1,4- benzodioxin- 6- ylamino)- 2- oxoethyl]- 1,3,4,9- tetrahydro- 2H- beta- carboline- 2- carboxamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CNC(=O)N1CCc2c(C1)[nH]c1c2cc(cc1)Cl

STK640025
Synonyms: N- [(2E)- 5- ethyl- 1,3,4- thiadiazol- 2(3H)- ylidene]- 6- fluoro- 4- hydroxyquinoline- 3- carboxamide
Smiles: CCc1n[nH]/c(=N\C(=O)c2cnc3c(c2O)cc(cc3)F)/s1

STK640026
Synonyms: N- [2- (3,4- dimethoxyphenyl)- 4- oxo- 4H- chromen- 6- yl]- 3- (3- methoxy- 1,2- oxazol- 5- yl)propanamide
Smiles: COc1noc(c1)CCC(=O)Nc1ccc2c(c1)c(=O)cc(o2)c1ccc(c(c1)OC)OC

STK640028
Synonyms: 2- [6- (1- phenylpropyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 3- yl]quinoline
Smiles: CCC(c1sc2n(n1)c(nn2)c1ccc2c(n1)cccc2)c1ccccc1

STK640030
Synonyms: N- (3- acetylphenyl)- 3- [2- methyl- 4- (thiophen- 2- yl)- 1,3- thiazol- 5- yl]propanamide
Smiles: O=C(Nc1cccc(c1)C(=O)C)CCc1sc(nc1c1cccs1)C

STK640032
Synonyms: [4- (4- chlorophenyl)- 4- hydroxypiperidin- 1- yl]{1- [(4- methylphenyl)sulfonyl]piperidin- 4- yl}methanone
Smiles: Cc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1CCC(CC1)(O)c1ccc(cc1)Cl

STK640035
Synonyms: 3- [8- (benzylamino)- 6- hydroxy- 3- methyl- 2- oxo- 2,3- dihydro- 7H- purin- 7- yl]propanoicacid
Smiles: OC(=O)CCn1c(NCc2ccccc2)nc2c1c(O)nc(=O)n2C

STK640036
Synonyms: N- [(2S)- 1- hydroxy- 3- phenylpropan- 2- yl]- 3- [4- (trifluoromethyl)phenyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: OC[C@@H](NC(=O)c1onc(n1)c1ccc(cc1)C(F)(F)F)Cc1ccccc1

STK640038
Synonyms: N- (6- methyl- 7- oxo- 7H- [1,3]thiazolo[3,2- b][1,2,4]triazin- 3- yl)- 2- [(4- methylpyrimidin- 2- yl)sulfanyl]acetamide
Smiles: O=C(Nc1csc2n1nc(C)c(=O)n2)CSc1nccc(n1)C

STK640043
Synonyms: N- [2- (2- fluorophenyl)- 4- oxo- 4H- chromen- 6- yl]- 3- (3- methoxy- 1,2- oxazol- 5- yl)propanamide
Smiles: COc1noc(c1)CCC(=O)Nc1ccc2c(c1)c(=O)cc(o2)c1ccccc1F

STK640045
Synonyms: ethyl4- {N- [(5- methoxy- 1- methyl- 1H- indol- 2- yl)carbonyl]- L- alanyl}piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)[C@@H](NC(=O)c1cc2c(n1C)ccc(c2)OC)C

STK640046
Synonyms: 5- phenyl- 2- {[2- (pyrrolidin- 1- yl)ethyl]sulfanyl}thieno[2,3- d]pyrimidin- 4- amine
Smiles: Nc1nc(SCCN2CCCC2)nc2c1c(cs2)c1ccccc1

STK640048
Synonyms: N~3~- [(4- hydroxyphthalazin- 1- yl)acetyl]- N- 1,3- thiazol- 2- yl- beta- alaninamide
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NCCC(=O)Nc1nccs1

STK640049
Synonyms: 2- {[4- ethyl- 5- (pyridin- 4- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [(2E)- 1,3,4- thiadiazol- 2(3H)- ylidene]acetamide
Smiles: CCn1c(SCC(=O)/N=c\2/scn[nH]2)nnc1c1ccncc1

STK640050
Synonyms: N- (3- chlorophenyl)- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: Clc1cccc(c1)NC(=O)c1ccccc1n1cnnn1

STK640052
Synonyms: (4aR,7aS)- 1- (3- chloro- 4- methoxyphenyl)- 4- (2- methoxybenzyl)hexahydrothieno[3,4- b]pyrazin- 2(1H)- one6,6- dioxide
Smiles: COc1ccc(cc1Cl)N1C(=O)CN([C@@H]2[C@H]1CS(=O)(=O)C2)Cc1ccccc1OC

STK640056
Synonyms: N- (2- hydroxy- 2- phenylethyl)- 3- (1H- indol- 5- yl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)c1ccc2c(c1)cc[nH]2)NCC(c1ccccc1)O

STK640057
Synonyms: 3- {[5- (4- methoxyphenyl)- 1H- pyrazol- 4- yl]methyl}- 2- methyl- 3,4- dihydro- 2H- 1,2- benzothiazin- 4- ol1,1- dioxide
Smiles: COc1ccc(cc1)c1[nH]ncc1CC1C(O)c2ccccc2S(=O)(=O)N1C

STK640058
Synonyms: (3aS,6aR)- 5- benzyl- 3- (1,3- dimethyl- 1H- pyrazol- 4- yl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: O=C1N(Cc2ccccc2)C(=O)[C@H]2[C@@H]1C(=NO2)c1cn(nc1C)C

STK640064
Synonyms: (5E)- 5- (furan- 2- ylmethylidene)- 4- hydroxy- 1,3- thiazole- 2(5H)- thione
Smiles: S=C1N=C(/C(=C\c2ccco2)/S1)O

STK857766
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 5- [5- (thiophen- 2- yl)- 1H- pyrazol- 3- yl]- 1,2,4- oxadiazole
Smiles: c1csc(c1)c1[nH]nc(c1)c1onc(n1)c1ccc2c(c1)OCO2

STK640075
Synonyms: ethyl3- (4- nitrophenyl)- 1,2- oxazole- 5- carboxylate
Smiles: CCOC(=O)c1onc(c1)c1ccc(cc1)[N+](=O)[O-]

STK640076
Synonyms: N- {2- [(thiophen- 2- ylsulfonyl)amino]ethyl}- 2,1,3- benzothiadiazole- 4- sulfonamide
Smiles: O=S(=O)(c1cccc2c1nsn2)NCCNS(=O)(=O)c1cccs1

STK640078
Synonyms: 6- (4- fluorophenoxy)- 3- (2- methoxyphenyl)[1,2,4]triazolo[4,3- b]pyridazine
Smiles: COc1ccccc1c1nnc2n1nc(cc2)Oc1ccc(cc1)F

STK640081
Synonyms: 4- chloro- 2- (1H- tetrazol- 1- yl)- N- [3- (trifluoromethyl)phenyl]benzamide
Smiles: Clc1ccc(c(c1)n1cnnn1)C(=O)Nc1cccc(c1)C(F)(F)F

STK640089
Synonyms: N- [2- (furan- 2- yl)ethyl]- 2- [(2- hydroxy- 4,5- dihydro- 3H- 1- benzazepin- 3- yl)sulfanyl]acetamide
Smiles: O=C(CSC1CCc2c(N=C1O)cccc2)NCCc1ccco1

STK857767
Synonyms: 2- {3- [(4- benzylpiperazin- 1- yl)carbonyl]- 4- chlorophenyl}- 1,2- thiazolidin- 3- one1,1- dioxide
Smiles: O=C1CCS(=O)(=O)N1c1ccc(c(c1)C(=O)N1CCN(CC1)Cc1ccccc1)Cl

STK640091
Synonyms: 1H- imidazol- 1- yl(5,6,7- trimethoxy- 1- methyl- 1H- indol- 2- yl)methanone
Smiles: COc1cc2cc(n(c2c(c1OC)OC)C)C(=O)n1cncc1

STK857768
Synonyms: N- [3- methyl- 2- (phenylcarbonyl)- 1- benzofuran- 5- yl]cyclopropanecarboxamide
Smiles: O=C(C1CC1)Nc1ccc2c(c1)c(C)c(o2)C(=O)c1ccccc1

STK640092
Synonyms: N- (1,3- dihydro- 2H- benzimidazol- 2- ylidene)- 4- methyl- 2- (3,4,5- trimethoxyphenyl)- 1,3- thiazole- 5- carboxamide
Smiles: COc1cc(cc(c1OC)OC)c1nc(c(s1)C(=O)/N=c/1\[nH]c2c([nH]1)cccc2)C

STK640093
Synonyms: ethyl4- {[2- chloro- 5- (4,4- dimethyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)phenyl]carbonyl}piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)c1cc(ccc1Cl)N1C(=O)C(CS1(=O)=O)(C)C

STK640094
Synonyms: N- [(2E)- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]- 2- (1- oxo- 1,3- dihydro- 2H- isoindol- 2- yl)propanamide
Smiles: Cc1cs/c(=N/C(=O)C(N2Cc3c(C2=O)cccc3)C)/[nH]1

STK640100
Synonyms: 7- (2,3- dihydroxypropyl)- 6- hydroxy- 3- methyl- 8- [(2- phenylethyl)amino]- 3,7- dihydro- 2H- purin- 2- one
Smiles: OCC(Cn1c(NCCc2ccccc2)nc2c1c(O)nc(=O)n2C)O

STK640102
Synonyms: N- (2- fluorophenyl)- 1- [N- (phenylcarbonyl)glycyl]piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)C(=O)CNC(=O)c1ccccc1)Nc1ccccc1F

STK640105
Synonyms: 5- {2- [4- (2- fluorophenyl)piperazin- 1- yl]- 2- oxoethyl}- 1,3- dimethyl- 5,7- dihydro- 1H- pyrrolo[2,3- d]pyrimidine- 2,4,6(3H)- trione
Smiles: O=C(N1CCN(CC1)c1ccccc1F)CC1C(=O)Nc2c1c(=O)n(c(=O)n2C)C

STK640106
Synonyms: 3- (2- phenyl- 1H- indol- 1- yl)- N- (1,3- thiazol- 2- yl)propanamide
Smiles: O=C(Nc1nccs1)CCn1c(cc2c1cccc2)c1ccccc1

STK640108
Synonyms: 1- (8- fluoro- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)- 3- (1H- indol- 3- yl)- 2- methylpropan- 1- one
Smiles: Fc1ccc2c(c1)c1CN(CCc1[nH]2)C(=O)C(Cc1c[nH]c2c1cccc2)C

STK640112
Synonyms: N- [(2S)- 1- hydroxypropan- 2- yl]- 2- ({2- oxo- 3- [2- (trifluoromethoxy)phenyl]- 2H- chromen- 7- yl}oxy)acetamide
Smiles: OC[C@@H](NC(=O)COc1ccc2c(c1)oc(=O)c(c2)c1ccccc1OC(F)(F)F)C

STK640113
Synonyms: 2- (8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yloxy)acetamide
Smiles: NC(=O)COc1nn2c(n1)c1c(nc2)sc2c1CCCC2

STK640114
Synonyms: 9- (pyridin- 3- yl)- 6,7,9,10- tetrahydro- 5H- [1,2,5]oxadiazolo[3,4- b][1,4]benzodiazepin- 8- ol
Smiles: OC1=C2C(=Nc3c(NC2c2cccnc2)non3)CCC1

STK640116
Synonyms: 5- [(2E)- 2- {4- [(4- chlorobenzyl)oxy]- 3- methoxybenzylidene}hydrazinyl]- 1,2,4- triazin- 3- ol
Smiles: COc1cc(/C=N/Nc2cnnc(n2)O)ccc1OCc1ccc(cc1)Cl

STK640117
Synonyms: 6- chloro- N- {2- oxo- 2- [(pyridin- 3- ylmethyl)amino]ethyl}- 1,3,4,9- tetrahydro- 2H- beta- carboline- 2- carboxamide
Smiles: O=C(NCc1cccnc1)CNC(=O)N1CCc2c(C1)[nH]c1c2cc(cc1)Cl

STK640118
Synonyms: 3- cyclopropyl- 6- (2,3- difluorophenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Fc1cccc(c1F)c1nn2c(s1)nnc2C1CC1

STK640119
Synonyms: N- [4- (3- ethyl- 2- hydroxy- 6- oxo- 3,4,5,6- tetrahydropyridin- 3- yl)phenyl]- N'- (pyridin- 4- ylmethyl)ethanediamide
Smiles: CCC1(CCC(=O)N=C1O)c1ccc(cc1)NC(=O)C(=O)NCc1ccncc1

STK640120
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 3- phenyl- 5,6- dihydro- 1,4- oxathiine- 2- carboxamide
Smiles: O=C(C1=C(SCCO1)c1ccccc1)NC1CCS(=O)(=O)C1

STK640122
Synonyms: (7Z)- 3- (4- fluorophenyl)- 7- (furan- 2- ylmethylidene)- 3,4- dihydro- 2H- imidazo[2,1- b][1,3,5]thiadiazin- 6(7H)- one
Smiles: Fc1ccc(cc1)N1CSC2=N/C(=C\c3ccco3)/C(=O)N2C1

STK640125
Synonyms: N- (1- benzyl- 1H- pyrazol- 5- yl)- 5- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 1,2- oxazole- 3- carboxamide
Smiles: O=C(c1noc(c1)c1ccc2c(c1)OCCO2)Nc1ccnn1Cc1ccccc1

STK640128
Synonyms: 5- [2- (5- chloro- 1H- indol- 3- yl)ethyl]- 2- (4- fluorophenyl)- 6- hydroxy- 4- methyl- 2,5- dihydro- 3H- pyrazolo[4,3- c]pyridin- 3- one
Smiles: Fc1ccc(cc1)n1nc2c(c1=O)c(C)n(c(c2)O)CCc1c[nH]c2c1cc(Cl)cc2

STK640130
Synonyms: 2- [2- (2- fluorophenyl)- 1,3- thiazol- 5- yl]- N- (pyridin- 4- ylmethyl)acetamide
Smiles: O=C(Cc1cnc(s1)c1ccccc1F)NCc1ccncc1

STK640134
Synonyms: N- (3- methoxyphenyl)- Nalpha- (pyridin- 3- ylcarbonyl)- L- phenylalaninamide
Smiles: COc1cccc(c1)NC(=O)[C@@H](NC(=O)c1cccnc1)Cc1ccccc1

STK857770
Synonyms: 2- [(3,5- dihydroxy- 1,2,4- triazin- 6- yl)amino]- N'- [(E)- phenylmethylidene]propanehydrazide(non- preferredname)
Smiles: O=C(C(Nc1nnc(nc1O)O)C)N/N=C/c1ccccc1

STK640135
Synonyms: N- [2- (3,5- dimethyl- 1H- pyrazol- 1- yl)ethyl]- 3- (pyridin- 3- yl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: Cc1nn(c(c1)C)CCNC(=O)c1onc(n1)c1cccnc1

STK640137
Synonyms: 9- (3- bromophenyl)- 6,7,9,10- tetrahydro- 5H- [1,2,5]oxadiazolo[3,4- b][1,4]benzodiazepin- 8- ol
Smiles: Brc1cccc(c1)C1Nc2nonc2N=C2C1=C(O)CCC2

STK640138
Synonyms: 6- methyl- 4- oxo- N- [1- (thiophen- 2- ylmethyl)- 1H- pyrazol- 5- yl]- 4H- chromene- 2- carboxamide
Smiles: Cc1ccc2c(c1)c(=O)cc(o2)C(=O)Nc1ccnn1Cc1cccs1

STK640140
Synonyms: 2- [4- (4- fluorophenyl)- 1H- pyrazol- 5- yl]- 5- (propan- 2- yloxy)phenol
Smiles: CC(Oc1ccc(c(c1)O)c1[nH]ncc1c1ccc(cc1)F)C

STK640143
Synonyms: 3- (1,1- dioxido- 1,2- thiazinan- 2- yl)- 4- methoxyaniline
Smiles: COc1ccc(cc1N1CCCCS1(=O)=O)N

STK640144
Synonyms: 2- [(8- ethyl- 1- oxa- 4,8- diazaspiro[4.5]dec- 4- yl)carbonyl]- 5,7- dimethyl- 4H- chromen- 4- one
Smiles: CCN1CCC2(CC1)OCCN2C(=O)c1cc(=O)c2c(o1)cc(cc2C)C

STK857772
Synonyms: 4- [3- (2,4- dimethoxyphenyl)- 1,2,4- oxadiazol- 5- yl]- 1- (4- fluorophenyl)pyrrolidin- 2- one
Smiles: COc1cc(OC)ccc1c1noc(n1)C1CC(=O)N(C1)c1ccc(cc1)F

STK640147
Synonyms: 4- fluoro- N- [(2E)- 6- [(4- methylpiperazin- 1- yl)carbonyl]- 1,3- benzothiazol- 2(3H)- ylidene]benzenesulfonamide
Smiles: CN1CCN(CC1)C(=O)c1ccc2c(c1)s/c(=N/S(=O)(=O)c1ccc(cc1)F)/[nH]2

STK640150
Synonyms: N- [(4- hydroxy- 1- phenyl- 1H- pyrazolo[3,4- d]pyrimidin- 6- yl)methyl]- 3- methylbutanamide
Smiles: CC(CC(=O)NCc1nc(O)c2c(n1)n(nc2)c1ccccc1)C

STK640151
Synonyms: 1- {[4- (acetylamino)phenyl]sulfonyl}- N- [2- (4- fluorophenyl)ethyl]piperidine- 3- carboxamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)NCCc1ccc(cc1)F

STK640154
Synonyms: (5,6- dimethoxy- 1- methyl- 1H- indol- 2- yl)(8- fluoro- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)methanone
Smiles: COc1cc2c(cc1OC)cc(n2C)C(=O)N1CCc2c(C1)c1cc(F)ccc1[nH]2

STK640155
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- N- (furan- 2- ylmethyl)- 3- phenyl- 5,6- dihydro- 1,4- oxathiine- 2- carboxamide
Smiles: O=C(C1=C(SCCO1)c1ccccc1)N(C1CCS(=O)(=O)C1)Cc1ccco1

STK640160
Synonyms: 5- (1,1- dioxido- 1,2- thiazinan- 2- yl)- 2- methoxy- N- [4- (4- methylpiperazin- 1- yl)phenyl]benzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)C)N1CCCCS1(=O)=O

STK640161
Synonyms: 6- (benzylsulfanyl)- 1,2,4- triazine- 3,5- diol
Smiles: Oc1nnc(c(n1)O)SCc1ccccc1

STK640163
Synonyms: (4aR,7aS)- 1- (3- chloro- 4- methoxyphenyl)- 4- [2- (2- methoxyphenyl)ethyl]hexahydrothieno[3,4- b]pyrazin- 2(1H)- one6,6- dioxide
Smiles: COc1ccc(cc1Cl)N1C(=O)CN([C@@H]2[C@H]1CS(=O)(=O)C2)CCc1ccccc1OC

STK640166
Synonyms: N~2~- [(4- hydroxyphthalazin- 1- yl)acetyl]- N- (2- methoxybenzyl)alaninamide
Smiles: COc1ccccc1CNC(=O)C(NC(=O)Cc1nnc(c2c1cccc2)O)C

STK640167
Synonyms: (7E)- 7- (4- fluorobenzylidene)- 9- methyl- 3- [2- (morpholin- 4- yl)ethyl]- 3,4- dihydro- 2H- furo[3,2- g][1,3]benzoxazin- 6(7H)- one
Smiles: Fc1ccc(cc1)/C=C\1/Oc2c(C1=O)cc1c(c2C)OCN(C1)CCN1CCOCC1

STK640169
Synonyms: 2- {(1Z)- N- [N'- (4,6- dimethylquinazolin- 2- yl)carbamimidoyl]ethanimidoyl}benzoicacid
Smiles: Cc1ccc2c(c1)c(C)nc(n2)/N=C(/N=C(\c1ccccc1C(=O)O)/C)\N

STK640173
Synonyms: 5- [4- (1H- indol- 2- ylcarbonyl)piperazin- 1- yl]- 5- oxo- N- (pyridin- 2- ylmethyl)pentanamide
Smiles: O=C(NCc1ccccn1)CCCC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2

STK640174
Synonyms: piperazin- 1- yl(4,5,6,7- tetrahydro- 2H- indazol- 3- yl)methanone
Smiles: O=C(c1[nH]nc2c1CCCC2)N1CCNCC1

STK640178
Synonyms: 4- {(E)- [2- (5- hydroxy- 1,2,4- triazin- 3- yl)hydrazinylidene]methyl}benzoicacid
Smiles: Oc1cnnc(n1)N/N=C/c1ccc(cc1)C(=O)O

STK640179
Synonyms: 5- bromo- 2- (1H- tetrazol- 1- yl)- N- [2- (thiophen- 2- yl)ethyl]benzamide
Smiles: Brc1ccc(c(c1)C(=O)NCCc1cccs1)n1cnnn1

STK640183
Synonyms: 1- (4- {[4- (7H- purin- 6- yl)piperazin- 1- yl]sulfonyl}phenyl)pyrrolidin- 2- one
Smiles: O=C1CCCN1c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ncnc2c1[nH]cn2

STK640184
Synonyms: methylN- {[4- (1H- tetrazol- 1- yl)phenyl]carbonyl}- L- alaninate
Smiles: COC(=O)[C@@H](NC(=O)c1ccc(cc1)n1cnnn1)C

STK640187
Synonyms: 4- (2,6- dichlorophenyl)- 2,6- dihydro- 4H- pyrazolo[3,4- e][1,4]thiazepin- 7- ol
Smiles: OC1=Nc2n[nH]cc2C(SC1)c1c(Cl)cccc1Cl

STK640189
Synonyms: 3- (pyridin- 2- ylmethyl)- 2- (pyridin- 3- ylmethyl)- 3,4- dihydro- 2H- 1,2- benzothiazin- 4- ol1,1- dioxide
Smiles: OC1C(Cc2ccccn2)N(Cc2cccnc2)S(=O)(=O)c2c1cccc2

STK640192
Synonyms: N- (2- chlorophenyl)- 4- hydroxy- 7- oxo- 2- (piperidin- 1- yl)- 5,6,7,8- tetrahydropyrido[2,3- d]pyrimidine- 5- carboxamide
Smiles: O=C1Nc2nc(nc(c2C(C1)C(=O)Nc1ccccc1Cl)O)N1CCCCC1

STK640200
Synonyms: ethyl4- [({2- [4- (trifluoromethoxy)phenyl]- 1,3- thiazol- 5- yl}acetyl)amino]piperidine- 1- carboxylate
Smiles: CCOC(=O)N1CCC(CC1)NC(=O)Cc1cnc(s1)c1ccc(cc1)OC(F)(F)F

STK640203
Synonyms: 1- (diphenylmethyl)- N- (pyridin- 2- ylmethyl)azetidine- 3- carboxamide
Smiles: O=C(C1CN(C1)C(c1ccccc1)c1ccccc1)NCc1ccccn1

STK640204
Synonyms: (4- methylpiperazin- 1- yl)[3- (pyridin- 4- yl)- 1,2,4- oxadiazol- 5- yl]methanone
Smiles: CN1CCN(CC1)C(=O)c1onc(n1)c1ccncc1

STK640206
Synonyms: N- [(2Z)- 5- (methylsulfanyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 2- {[3- (methylsulfanyl)- 1,2,4- thiadiazol- 5- yl]sulfanyl}acetamide
Smiles: CSc1nsc(n1)SCC(=O)/N=c\1/[nH]nc(s1)SC

STK640207
Synonyms: 3- {[2- (dimethylamino)ethyl]sulfanyl}- 7,9- dimethyl- 5- phenylpyrimido[5,4- e][1,2,4]triazolo[4,3- c]pyrimidine- 8,10(7H,9H)- dione
Smiles: CN(CCSc1nnc2n1c(nc1c2c(=O)n(c(=O)n1C)C)c1ccccc1)C

STK640208
Synonyms: N- (2- {[2- (1- benzylpiperidin- 4- yl)ethyl]amino}- 2- oxoethyl)- 1,3,4,9- tetrahydro- 2H- beta- carboline- 2- carboxamide
Smiles: O=C(CNC(=O)N1CCc2c(C1)[nH]c1c2cccc1)NCCC1CCN(CC1)Cc1ccccc1

STK640209
Synonyms: 2- {[4- ethyl- 5- (pyridin- 4- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [(2E)- 5- methyl- 1,3,4- thiadiazol- 2(3H)- ylidene]acetamide
Smiles: CCn1c(SCC(=O)/N=c/2\[nH]nc(s2)C)nnc1c1ccncc1

STK640213
Synonyms: 7- benzyl- 3- [2- (dimethylamino)ethyl]- 9- methylthieno[2,3- d:4,5- d']dipyrimidin- 4(3H)- one
Smiles: CN(CCn1cnc2c(c1=O)sc1c2c(C)nc(n1)Cc1ccccc1)C

STK640217
Synonyms: 4- chloro- N- [(2Z)- 4- hydroxy- 3- (3- methylpiperidin- 1- yl)- 1- oxonaphthalen- 2(1H)- ylidene]benzenesulfonamide
Smiles: CC1CCCN(C1)C1=C(O)c2c(C(=O)/C/1=N\S(=O)(=O)c1ccc(cc1)Cl)cccc2

STK640218
Synonyms: 5- {[2- (dimethylamino)ethyl]amino}- 9- methyl- 7,8,9,10- tetrahydro[1,2,4]triazolo[3,4- a][2,7]naphthyridine- 6- carbonitrile
Smiles: N#Cc1c(NCCN(C)C)n2cnnc2c2c1CCN(C2)C

STK640221
Synonyms: N- benzyl- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: O=C(c1ccccc1n1cnnn1)NCc1ccccc1

STK640222
Synonyms: 5- (2,3- difluorophenyl)- 4- (quinolin- 5- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1c(F)cccc1c1n[nH]c(=S)n1c1cccc2c1cccn2

STK640226
Synonyms: 2- methyl- 1,2,3,4- tetrahydropyrazino[1,2- a]benzimidazole- 8- carboxamide
Smiles: CN1CCn2c(C1)nc1c2ccc(c1)C(=O)N

STK640229
Synonyms: 6- [(4- benzylpiperidin- 1- yl)sulfonyl]quinoxaline- 2,3- diol
Smiles: Oc1nc2ccc(cc2nc1O)S(=O)(=O)N1CCC(CC1)Cc1ccccc1

STK640231
Synonyms: (2- methyl- 1H- indol- 3- yl){4- [2- (pyridin- 2- yl)ethyl]piperazin- 1- yl}aceticacid
Smiles: OC(=O)C(c1c(C)[nH]c2c1cccc2)N1CCN(CC1)CCc1ccccn1

STL036677
Synonyms: 1- (1,3- benzodioxol- 5- yl)- 4- [3- (thiophen- 2- yl)- 1,2,4- oxadiazol- 5- yl]pyrrolidin- 2- one
Smiles: O=C1CC(CN1c1ccc2c(c1)OCO2)c1onc(n1)c1cccs1

STK640233
Synonyms: N- [3- (acetylamino)phenyl]- 4- [4- (methylsulfonyl)piperazin- 1- yl]- 4- oxobutanamide
Smiles: O=C(Nc1cccc(c1)NC(=O)C)CCC(=O)N1CCN(CC1)S(=O)(=O)C

STK640235
Synonyms: N- (3- acetylphenyl)- 5- bromo- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: Brc1ccc(c(c1)C(=O)Nc1cccc(c1)C(=O)C)n1cnnn1

STK640238
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 6- (4- bromophenyl)pyridazin- 3- amine
Smiles: Brc1ccc(cc1)c1ccc(nn1)NCc1ccc2c(c1)OCO2

STK640239
Synonyms: N- (4- chlorobenzyl)- 1- (3- methyl[1,2,4]triazolo[4,3- b]pyridazin- 6- yl)piperidine- 4- carboxamide
Smiles: Clc1ccc(cc1)CNC(=O)C1CCN(CC1)c1ccc2n(n1)c(C)nn2

STK640240
Synonyms: 2- (4- acetylpiperazin- 1- yl)- N- (4- cyano- 1H- pyrazol- 3- yl)- 2- oxoacetamide
Smiles: N#Cc1c[nH]nc1NC(=O)C(=O)N1CCN(CC1)C(=O)C

STK640244
Synonyms: 6- (2,6- dichloropyridin- 3- yl)- 3- ethyl[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CCc1nnc2n1nc(s2)c1ccc(nc1Cl)Cl

STK640247
Synonyms: N- methyl- 3- (pyridin- 2- yl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: CNC(=O)c1onc(n1)c1ccccn1

STK640248
Synonyms: N- {(2S)- 4- methyl- 1- oxo- 1- [(pyridin- 4- ylmethyl)amino]pentan- 2- yl}- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: CC(C[C@@H](C(=O)NCc1ccncc1)NC(=O)c1ccc2c(c1)sc(n2)n1cccc1)C

STK857777
Synonyms: 1- methyl- 4,6- di(morpholin- 4- yl)- 1H- pyrazolo[3,4- d]pyrimidine
Smiles: Cn1ncc2c1nc(nc2N1CCOCC1)N1CCOCC1

STK640254
Synonyms: 3- (4- fluorophenyl)- 9- (2- methoxyethyl)- 2- methyl- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COCCN1COc2c(C1)c1oc(C)c(c(=O)c1cc2)c1ccc(cc1)F

STK857778
Synonyms: 1- ethyl- 6- methoxy- 4- oxo- N- (1,3- thiazol- 2- yl)- 1,4- dihydroquinoline- 3- carboxamide
Smiles: COc1ccc2c(c1)c(=O)c(cn2CC)C(=O)Nc1nccs1

STK640258
Synonyms: N- {[2- (3- methoxyphenyl)- 1,3- thiazol- 4- yl]acetyl}- L- valine
Smiles: COc1cccc(c1)c1scc(n1)CC(=O)N[C@H](C(=O)O)C(C)C

STK640260
Synonyms: N- [2- (4- chlorophenyl)- 2- (morpholin- 4- yl)ethyl]- 3- phenyl- 5,6- dihydro- 1,4- oxathiine- 2- carboxamide
Smiles: Clc1ccc(cc1)C(N1CCOCC1)CNC(=O)C1=C(SCCO1)c1ccccc1

STK640261
Synonyms: 8- {2- [4- (4- fluorobenzyl)piperazin- 1- yl]ethyl}- 4- hydroxy- 1,6,7- trimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Fc1ccc(cc1)CN1CCN(CC1)CCn1c2nc3c(n2c(c1C)C)c(O)nc(=O)n3C

STK640263
Synonyms: (6- fluoro- 1H- indol- 3- yl)[4- (pyrimidin- 2- yl)- 1,4- diazepan- 1- yl]aceticacid
Smiles: Fc1ccc2c(c1)[nH]cc2C(N1CCCN(CC1)c1ncccn1)C(=O)O

STK640265
Synonyms: methyl4- ({[2- (1H- pyrrol- 1- yl)- 1,3- benzothiazol- 6- yl]carbonyl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)c1ccc2c(c1)sc(n2)n1cccc1

STK640266
Synonyms: 4- (1,1- dioxido- 1,2- thiazinan- 2- yl)- 2,6- dimethyl- N- (2- phenylethyl)benzenesulfonamide
Smiles: Cc1cc(cc(c1S(=O)(=O)NCCc1ccccc1)C)N1CCCCS1(=O)=O

STK640268
Synonyms: N- methyl- 3- (pyridin- 3- yl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: CNC(=O)c1onc(n1)c1cccnc1

STK640271
Synonyms: 8- (benzylamino)- 7- (2,3- dihydroxypropyl)- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: OCC(Cn1c(NCc2ccccc2)nc2c1c(O)nc(=O)n2C)O

STK640272
Synonyms: [2- (4- chlorophenyl)- 4- methyl- 1,3- thiazol- 5- yl](6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1sc(nc1C)c1ccc(cc1)Cl

STK640273
Synonyms: [4- (diphenylmethyl)piperazin- 1- yl](6- fluoro- 1H- indol- 3- yl)aceticacid
Smiles: OC(=O)C(c1c[nH]c2c1ccc(c2)F)N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK640276
Synonyms: 6- amino- 4- hydroxy- 1- (2- methoxyethyl)pyrimidin- 2(1H)- one
Smiles: COCCn1c(N)cc(nc1=O)O

STK640279
Synonyms: ethyl3- (1H- indol- 6- yl)- 1,2,4- oxadiazole- 5- carboxylate
Smiles: CCOC(=O)c1onc(n1)c1ccc2c(c1)[nH]cc2

STK640280
Synonyms: N- ethyl- 2- {[8- (3- methylphenyl)- 2,3,4,8- tetrahydropyrazolo[4,3- e]pyrimido[1,2- c]pyrimidin- 6- yl]sulfanyl}acetamide
Smiles: CCNC(=O)CSc1nc2c(c3=NCCCn13)cnn2c1cccc(c1)C

STK640282
Synonyms: N- (4- {[3- (4- bromophenyl)[1,2,4]triazolo[4,3- b]pyridazin- 6- yl]oxy}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)Oc1ccc2n(n1)c(nn2)c1ccc(cc1)Br

STK640287
Synonyms: [1- (2- chlorophenyl)- 6,7- dimethoxy- 1,4- dihydroindeno[1,2- c]pyrazol- 3- yl](pyrrolidin- 1- yl)methanone
Smiles: COc1cc2c(cc1OC)Cc1c2n(nc1C(=O)N1CCCC1)c1ccccc1Cl

STK857780
Synonyms: N- [4- (acetylamino)phenyl]- 5- amino- 1- (4- chlorophenyl)- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: CC(=O)Nc1ccc(cc1)NC(=O)c1nnn(c1N)c1ccc(cc1)Cl

STK640288
Synonyms: 3- (7- methoxy- 4- methyl- 2- oxo- 2H- chromen- 6- yl)- N- (pyridin- 3- yl)propanamide
Smiles: COc1cc2oc(=O)cc(c2cc1CCC(=O)Nc1cccnc1)C

STK640291
Synonyms: N- (4- cyano- 1H- pyrazol- 3- yl)- 2- (morpholin- 4- yl)- 2- oxoacetamide
Smiles: N#Cc1c[nH]nc1NC(=O)C(=O)N1CCOCC1

STK640293
Synonyms: 6- [2- (3,4- dimethoxyphenyl)ethyl]- 3- (pyridin- 4- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1cc(CCc2nn3c(s2)nnc3c2ccncc2)ccc1OC

STK640294
Synonyms: (4- {2- [(2- methoxyethyl)amino]- 2- oxoethyl}piperazin- 1- yl)(5- methoxy- 1H- indol- 3- yl)aceticacid
Smiles: COCCNC(=O)CN1CCN(CC1)C(c1c[nH]c2c1cc(OC)cc2)C(=O)O

STK640296
Synonyms: 2- [3- (2- methoxyphenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl]- 1H- indole
Smiles: COc1ccccc1c1nnc2n1nc(s2)c1cc2c([nH]1)cccc2

STK640298
Synonyms: N- [(2Z)- 3- (2,6- dimethylmorpholin- 4- yl)- 4- hydroxy- 1- oxonaphthalen- 2(1H)- ylidene]thiophene- 2- sulfonamide
Smiles: CC1OC(C)CN(C1)C1=C(O)c2c(C(=O)/C/1=N\S(=O)(=O)c1cccs1)cccc2

STK640303
Synonyms: 2,2- dimethyl- 1- {4- [(1- methyl- 1H- indol- 2- yl)carbonyl]piperazin- 1- yl}propan- 1- one
Smiles: O=C(c1cc2c(n1C)cccc2)N1CCN(CC1)C(=O)C(C)(C)C

STK640306
Synonyms: 3- {[3- (2,5- difluorophenyl)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]methyl}benzoicacid
Smiles: Fc1ccc(c(c1)c1n[nH]c(=S)n1Cc1cccc(c1)C(=O)O)F

STK640307
Synonyms: 1- ethyl- 7- methyl- N- [4- (morpholin- 4- ylmethyl)phenyl]- 4- oxo- 1,4- dihydro- 1,8- naphthyridine- 3- carboxamide
Smiles: CCn1cc(C(=O)Nc2ccc(cc2)CN2CCOCC2)c(=O)c2c1nc(C)cc2

STK640308
Synonyms: 2- ({1- [(3,4- dimethyl- 2- thioxo- 2,3- dihydro- 1,3- thiazol- 5- yl)carbonyl]- 1H- diaziren- 3- yl}sulfanyl)acetamide
Smiles: Cc1c(sc(=S)n1C)C(=O)N1N=C1SCC(=O)N

STK640309
Synonyms: N- (2- phenylethyl)- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: O=C(c1ccccc1n1cnnn1)NCCc1ccccc1

STK640310
Synonyms: 3- methyl- 4- (thiophen- 2- yl)- 4,6,7,8- tetrahydro[1,2]oxazolo[5,4- b]quinolin- 5- ol
Smiles: OC1=C2C(=Nc3c(C2c2cccs2)c(C)no3)CCC1

STK640311
Synonyms: (7Z)- N- nitro- 5a,6,8a,9- tetrahydro- 5H- imidazo[4,5- e]tetrazolo[1,5- b][1,2,4]triazin- 7(8H)- imine
Smiles: [O-][N+](=O)/N=C/1\NC2C(N1)Nc1n(N2)nnn1

STK640313
Synonyms: 3- (4- chlorophenyl)- 2- methyl- 9- [3- (propan- 2- yloxy)propyl]- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: CC(OCCCN1COc2c(C1)c1oc(C)c(c(=O)c1cc2)c1ccc(cc1)Cl)C

STK857782
Synonyms: 1- (3- methylphenyl)- 4- [4- (4- nitrophenyl)piperazin- 1- yl]- 1H- pyrazolo[3,4- d]pyrimidine
Smiles: Cc1cccc(c1)n1ncc2c1ncnc2N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

STK640316
Synonyms: 1- {[6- (2,6- dichloropyridin- 3- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 3- yl]methyl}- 1H- benzimidazole
Smiles: Clc1ccc(c(n1)Cl)c1nn2c(s1)nnc2Cn1cnc2c1cccc2

STK640317
Synonyms: N'- {(E)- [4- (diethylamino)phenyl]methylidene}- 2- (3,5- dihydroxy- 1,2,4- triazin- 6- yl)acetohydrazide
Smiles: CCN(c1ccc(cc1)/C=N/NC(=O)Cc1nnc(nc1O)O)CC

STK640322
Synonyms: N- (1,3- dihydro- 2H- benzimidazol- 2- ylidene)- 1H- benzimidazole- 6- carboxamide
Smiles: O=C(c1ccc2c(c1)[nH]cn2)/N=c/1\[nH]c2c([nH]1)cccc2

STK640323
Synonyms: N- (1H- indol- 5- yl)- 1- [N- (phenylcarbonyl)glycyl]piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)C(=O)CNC(=O)c1ccccc1)Nc1ccc2c(c1)cc[nH]2

STK640325
Synonyms: 1- (1- ethyl- 1H- indol- 3- yl)- 2- [(4- hydroxypyrimidin- 2- yl)sulfanyl]ethanone
Smiles: CCn1cc(c2c1cccc2)C(=O)CSc1nccc(n1)O

STK640330
Synonyms: 2- (4- methylpiperazin- 1- yl)- 3- (prop- 2- en- 1- yl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: C=CCn1c(nc2c(c1=O)c1CCCCc1s2)N1CCN(CC1)[CH]

STK640331
Synonyms: N- ethyl- 4- [4- oxo- 3- (propan- 2- yl)- 3,4,5,6,7,8- hexahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl]piperazine- 1- carbothioamide
Smiles: CCNC(=S)N1CCN(CC1)c1nc2sc3c(c2c(=O)n1C(C)C)CCCC3

STK640332
Synonyms: 2- (azepan- 1- yl)- N- (8- methoxy- 2- methylquinolin- 4- yl)acetamide
Smiles: COc1cccc2c1nc(C)cc2NC(=O)CN1CCCCCC1

STK640335
Synonyms: 5,7,8- trifluoro- N- (4- methoxyphenyl)- 4- (2- phenylethyl)- 3,4- dihydro- 2H- 1,4- benzothiazine- 6- carboxamide1,1- dioxide
Smiles: COc1ccc(cc1)NC(=O)c1c(F)c2N(CCc3ccccc3)CCS(=O)(=O)c2c(c1F)F

STK640338
Synonyms: 3- {(2E)- 2- [(2E)- 2- methyl- 3- phenylprop- 2- en- 1- ylidene]hydrazinyl}- 1,2,4- triazin- 5- ol
Smiles: C/C(=C\c1ccccc1)/C=N/Nc1nncc(n1)O

STK640341
Synonyms: N~3~- [(4- hydroxyphthalazin- 1- yl)acetyl]- N- (pyridin- 2- ylmethyl)- beta- alaninamide
Smiles: O=C(NCc1ccccn1)CCNC(=O)Cc1nnc(c2c1cccc2)O

STK640342
Synonyms: 2- chloro- N- (2- phenylethyl)- 5- (1H- tetrazol- 1- yl)benzamide
Smiles: O=C(c1cc(ccc1Cl)n1cnnn1)NCCc1ccccc1

STK640350
Synonyms: 2,4- dihydroxy- N- (2- methoxyphenyl)quinoline- 3- carboxamide
Smiles: COc1ccccc1NC(=O)c1c(O)nc2c(c1O)cccc2

STK640353
Synonyms: 4- chloro- 7- (piperazin- 1- ylsulfonyl)- 2,1,3- benzoxadiazole
Smiles: Clc1ccc(c2c1non2)S(=O)(=O)N1CCNCC1

STK640355
Synonyms: 2- (5- methoxy- 1H- indol- 1- yl)- N- [3- (trifluoromethoxy)phenyl]acetamide
Smiles: COc1ccc2c(c1)ccn2CC(=O)Nc1cccc(c1)OC(F)(F)F

STK640356
Synonyms: 4- fluoro- N- (4- sulfamoylphenyl)- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: Fc1ccc(c(c1)n1cnnn1)C(=O)Nc1ccc(cc1)S(=O)(=O)N

STK640359
Synonyms: N- [(2E)- 4,7- dimethylquinazolin- 2(1H)- ylidene]- 5- [2- (morpholin- 4- yl)ethyl]- 1,4,5,6- tetrahydro- 1,3,5- triazin- 2- amine
Smiles: Cc1ccc2c(c1)[nH]/c(=N\C1=NCN(CN1)CCN1CCOCC1)/nc2C

STK640360
Synonyms: 9- (2,3- difluorophenyl)- 6,7,9,10- tetrahydro- 5H- [1,2,5]oxadiazolo[3,4- b][1,4]benzodiazepin- 8- ol
Smiles: OC1=C2C(=Nc3c(NC2c2cccc(c2F)F)non3)CCC1

STK857785
Synonyms: N- benzyl- 1- methyl- 4- (morpholin- 4- yl)- 1H- pyrazolo[3,4- d]pyrimidin- 6- amine
Smiles: Cn1ncc2c1nc(NCc1ccccc1)nc2N1CCOCC1

STK857786
Synonyms: N- (1,3- benzodioxol- 5- yl)- 2- chloro- 5- (1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)benzamide
Smiles: Clc1ccc(cc1C(=O)Nc1ccc2c(c1)OCO2)N1C(=O)CCS1(=O)=O

STK640364
Synonyms: 3- (2- hydroxy- 5- methylphenyl)- 1- (morpholin- 4- yl)- 3- phenylpropan- 1- one
Smiles: Cc1ccc(c(c1)C(c1ccccc1)CC(=O)N1CCOCC1)O

STK640367
Synonyms: 7- [2- (morpholin- 4- yl)- 2- oxoethoxy]- 2,3- dihydropyrrolo[2,1- b]quinazolin- 9(1H)- one
Smiles: O=C(N1CCOCC1)COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK640369
Synonyms: N- (cyanomethyl)- 3- (5- methoxy- 1H- indol- 1- yl)propanamide
Smiles: N#CCNC(=O)CCn1ccc2c1ccc(c2)OC

STK857787
Synonyms: 4- hydroxy- N'- (1- methyl- 1H- pyrazolo[3,4- d]pyrimidin- 4- yl)benzohydrazide
Smiles: Oc1ccc(cc1)C(=O)NNc1ncnc2c1cnn2C

STK640371
Synonyms: ethyl2- ({[2- chloro- 4- (1,1- dioxido- 1,2- thiazinan- 2- yl)phenyl]carbonyl}amino)benzoate
Smiles: CCOC(=O)c1ccccc1NC(=O)c1ccc(cc1Cl)N1CCCCS1(=O)=O

STK640372
Synonyms: 2- (3- methoxyphenyl)- 4- methyl- N- (pyridin- 4- ylmethyl)- 1,3- thiazole- 5- carboxamide
Smiles: COc1cccc(c1)c1nc(c(s1)C(=O)NCc1ccncc1)C

STK640374
Synonyms: N- {2- [(2E)- 1,3- benzothiazol- 2(3H)- ylideneamino]- 2- oxoethyl}- 5- methoxy- 1- methyl- 1H- indole- 2- carboxamide
Smiles: COc1ccc2c(c1)cc(n2C)C(=O)NCC(=O)/N=c\1/sc2c([nH]1)cccc2

STK640375
Synonyms: 2,4- dihydroxy- N- (1,3- thiazol- 2- yl)quinoline- 3- carboxamide
Smiles: O=C(c1c(O)nc2c(c1O)cccc2)Nc1nccs1

STK640376
Synonyms: 2- (5- methoxy- 1H- indol- 1- yl)- N- (quinolin- 5- yl)acetamide
Smiles: COc1ccc2c(c1)ccn2CC(=O)Nc1cccc2c1cccn2

STK640377
Synonyms: 5- (4,5- dihydro- 1H- [1,4]diazepino[1,2- a]benzimidazol- 2(3H)- yl)- 2- methoxyaniline
Smiles: COc1ccc(cc1N)N1CCCn2c(C1)nc1c2cccc1

STK640381
Synonyms: (5- bromofuran- 2- yl)(8- ethyl- 1- oxa- 4,8- diazaspiro[4.5]dec- 4- yl)methanone
Smiles: CCN1CCC2(CC1)OCCN2C(=O)c1ccc(o1)Br

STK857788
Synonyms: 5- [5- (2,4- dimethoxyphenyl)- 1H- pyrazol- 3- yl]- 3- phenyl- 1,2,4- oxadiazole
Smiles: COc1cc(OC)ccc1c1[nH]nc(c1)c1onc(n1)c1ccccc1

STK640384
Synonyms: (4aR,7aS)- 4- (2- methoxybenzyl)- 1- (4- methoxyphenyl)hexahydrothieno[3,4- b]pyrazin- 2(1H)- one6,6- dioxide
Smiles: COc1ccc(cc1)N1C(=O)CN([C@@H]2[C@H]1CS(=O)(=O)C2)Cc1ccccc1OC

STK640385
Synonyms: 1- benzofuran- 2- yl[4- ([1,2,4]triazolo[4,3- a]pyridin- 3- yl)piperidin- 1- yl]methanone
Smiles: O=C(c1cc2c(o1)cccc2)N1CCC(CC1)c1nnc2n1cccc2

STK640386
Synonyms: N- (3- hydroxyphenyl)- 5- oxo- 1- [3- (trifluoromethyl)phenyl]pyrrolidine- 3- carboxamide
Smiles: O=C(C1CC(=O)N(C1)c1cccc(c1)C(F)(F)F)Nc1cccc(c1)O

STK640387
Synonyms: N- (1- benzylpiperidin- 4- yl)- 3- [(2- hydroxy- 4,5- dihydro- 3H- 1- benzazepin- 3- yl)sulfanyl]propanamide
Smiles: O=C(NC1CCN(CC1)Cc1ccccc1)CCSC1CCc2c(N=C1O)cccc2

STK640388
Synonyms: 3- (4- chlorophenyl)- 2- ethyl- 5- methyl- N- (pyridin- 2- ylmethyl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: CCc1nn2c(c1c1ccc(cc1)Cl)nc(cc2NCc1ccccn1)C

STK640391
Synonyms: N- (2- fluorophenyl)- 1- [3- (propan- 2- yl)[1,2,4]triazolo[4,3- b]pyridazin- 6- yl]piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ccc2n(n1)c(nn2)C(C)C)Nc1ccccc1F

STK857790
Synonyms: 4- methyl- N- (pyridin- 2- ylmethyl)- 2- (1H- pyrrol- 1- yl)- 1,3- thiazole- 5- carboxamide
Smiles: O=C(c1sc(nc1C)n1cccc1)NCc1ccccn1

STK640392
Synonyms: 5- (3- bromophenyl)- N- (pyridin- 4- ylmethyl)- 1,3,4- oxadiazole- 2- carboxamide
Smiles: Brc1cccc(c1)c1nnc(o1)C(=O)NCc1ccncc1

STK640395
Synonyms: N- (2,6- dimethylphenyl)- 5- (1,1- dioxido- 1,2- thiazinan- 2- yl)- 2- methoxybenzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)Nc1c(C)cccc1C)N1CCCCS1(=O)=O

STK640396
Synonyms: N- [2- ({[4- (2- oxopyrrolidin- 1- yl)phenyl]sulfonyl}amino)ethyl]- 1H- indole- 2- carboxamide
Smiles: O=C1CCCN1c1ccc(cc1)S(=O)(=O)NCCNC(=O)c1cc2c([nH]1)cccc2

STK640401
Synonyms: 5- bromo- N- (5- chloro- 2- methoxyphenyl)- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: COc1ccc(cc1NC(=O)c1cc(Br)ccc1n1cnnn1)Cl

STK640404
Synonyms: 4- (cyclopentyloxy)- N- [1- (methylsulfonyl)- 2,3- dihydro- 1H- indol- 6- yl]benzenesulfonamide
Smiles: CS(=O)(=O)N1CCc2c1cc(cc2)NS(=O)(=O)c1ccc(cc1)OC1CCCC1

STK640409
Synonyms: 6,8- dimethyl- 4- {[4- (pyridin- 2- yl)piperazin- 1- yl]methyl}- 2H- chromen- 2- one
Smiles: Cc1cc(C)c2c(c1)c(CN1CCN(CC1)c1ccccn1)cc(=O)o2

STK640410
Synonyms: 4- (4- fluorophenyl)- 2,6- dihydro- 4H- pyrazolo[3,4- e][1,4]thiazepin- 7- ol
Smiles: Fc1ccc(cc1)C1SCC(=Nc2c1c[nH]n2)O

STK640412
Synonyms: N- [2- (2,3- dihydro- 1H- inden- 2- ylamino)- 2- oxoethyl]- 1,3,4,9- tetrahydro- 2H- beta- carboline- 2- carboxamide
Smiles: O=C(NC1Cc2c(C1)cccc2)CNC(=O)N1CCc2c(C1)[nH]c1c2cccc1

STK640416
Synonyms: N- [2- (dimethylamino)ethyl]- N'- [4- (3- ethyl- 2- hydroxy- 6- oxo- 3,4,5,6- tetrahydropyridin- 3- yl)phenyl]ethanediamide
Smiles: CCC1(CCC(=O)N=C1O)c1ccc(cc1)NC(=O)C(=O)NCCN(C)C

STK640417
Synonyms: (7Z)- 7- (2- methoxybenzylidene)- 9- methyl- 3- (pyridin- 4- ylmethyl)- 3,4- dihydro- 2H- furo[3,2- g][1,3]benzoxazin- 6(7H)- one
Smiles: COc1ccccc1/C=C/1\Oc2c(C1=O)cc1c(c2C)OCN(C1)Cc1ccncc1

STK640421
Synonyms: N- (3,4- difluorophenyl)- 2- hydroxy- 4- methyl- 6- (3,4,5- trimethoxyphenyl)- 1,6- dihydropyrimidine- 5- carboxamide
Smiles: COc1cc(cc(c1OC)OC)C1NC(=NC(=C1C(=O)Nc1ccc(c(c1)F)F)C)O

STK640424
Synonyms: 4- [(4- methyl- 2- phenyl- 1,3- thiazol- 5- yl)carbonyl]piperazin- 2- one
Smiles: O=C1NCCN(C1)C(=O)c1sc(nc1C)c1ccccc1

STK640426
Synonyms: 2- [(4- methylpyrimidin- 2- yl)sulfanyl]- N- [(2Z)- 5- (trifluoromethyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]acetamide
Smiles: O=C(/N=c\1/[nH]nc(s1)C(F)(F)F)CSc1nccc(n1)C

STK640427
Synonyms: (2E)- N- (1,3- benzodioxol- 5- ylmethyl)- 2- [(methylsulfonyl)imino]- 2,3- dihydro- 1,3- benzothiazole- 6- carboxamide
Smiles: O=C(c1ccc2c(c1)s/c(=N/S(=O)(=O)C)/[nH]2)NCc1ccc2c(c1)OCO2

STK640428
Synonyms: N- [(4- hydroxy- 1- phenyl- 1H- pyrazolo[3,4- d]pyrimidin- 6- yl)methyl]pentanamide
Smiles: CCCCC(=O)NCc1nc(O)c2c(n1)n(nc2)c1ccccc1

STK640429
Synonyms: N- [2- (pyrrolidin- 1- ylcarbonyl)phenyl]- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: O=C(c1ccccc1NC(=O)c1ccccc1n1cnnn1)N1CCCC1

STK640432
Synonyms: 3- {[3- (3,5- difluorobenzyl)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]methyl}benzoicacid
Smiles: Fc1cc(cc(c1)F)Cc1n[nH]c(=S)n1Cc1cccc(c1)C(=O)O

STK640433
Synonyms: 2- hydroxy- N- (3- methylpyridin- 2- yl)quinoline- 4- carboxamide
Smiles: Oc1nc2ccccc2c(c1)C(=O)Nc1ncccc1C

STK640435
Synonyms: [4- (1,3- benzoxazol- 2- yl)piperidin- 1- yl](5- methyl- 1H- indol- 3- yl)aceticacid
Smiles: Cc1ccc2c(c1)c(c[nH]2)C(N1CCC(CC1)c1nc2c(o1)cccc2)C(=O)O

STK640437
Synonyms: 3- chloro- 4- methoxy- N- [1- (pyridin- 3- ylcarbonyl)- 1,2,3,4- tetrahydroquinolin- 6- yl]benzenesulfonamide
Smiles: COc1ccc(cc1Cl)S(=O)(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccnc1

STK640440
Synonyms: N- (4- phenylbutan- 2- yl)- 3- (pyridin- 3- yl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: CC(NC(=O)c1onc(n1)c1cccnc1)CCc1ccccc1

STK640443
Synonyms: 2- {4- methoxy- 3- [(4- methylpiperazin- 1- yl)sulfonyl]phenyl}- 1,2- thiazinane1,1- dioxide
Smiles: COc1ccc(cc1S(=O)(=O)N1CCN(CC1)C)N1CCCCS1(=O)=O

STK640445
Synonyms: 2- [(4- amino- 6- hydroxypyrimidin- 2- yl)sulfanyl]- N- [(2Z)- 5- methyl- 1,3,4- thiadiazol- 2(3H)- ylidene]acetamide
Smiles: Nc1nc(SCC(=O)/N=c\2/[nH]nc(s2)C)nc(c1)O

STK640446
Synonyms: N- (4- {[(2Z)- 3- {[2- (difluoromethoxy)phenyl]amino}quinoxalin- 2(1H)- ylidene]sulfamoyl}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1ccccc1OC(F)F

STK640454
Synonyms: N- [1- (pyridin- 3- ylcarbonyl)- 2,3- dihydro- 1H- indol- 5- yl]cyclopropanecarboxamide
Smiles: O=C(C1CC1)Nc1ccc2c(c1)CCN2C(=O)c1cccnc1

STK640456
Synonyms: 6- benzyl- 5- (4- fluorophenyl)- 1,3- dimethyl- 1H- pyrrolo[3,4- d]pyrimidine- 2,4(3H,6H)- dione
Smiles: Fc1ccc(cc1)c1n(Cc2ccccc2)cc2c1c(=O)n(c(=O)n2C)C

STK640458
Synonyms: [4- (2,1,3- benzothiadiazol- 4- ylsulfonyl)piperazin- 1- yl](2,3- dihydro- 1,4- benzodioxin- 2- yl)methanone
Smiles: O=C(C1COc2c(O1)cccc2)N1CCN(CC1)S(=O)(=O)c1cccc2c1nsn2

STK640461
Synonyms: 3- (4- chlorophenyl)- 8- (furan- 2- yl)- 6- oxo- 3,4- dihydro- 2H,6H- pyrimido[2,1- b][1,3,5]thiadiazine- 7- carbonitrile
Smiles: N#Cc1c(nc2n(c1=O)CN(CS2)c1ccc(cc1)Cl)c1ccco1

STK857793
Synonyms: N- [(2,3- dihydro- 1,4- benzodioxin- 2- ylmethyl)carbamothioyl]benzamide
Smiles: S=C(NC(=O)c1ccccc1)NCC1COc2c(O1)cccc2

STK640462
Synonyms: 2,4- dimethyl- N- [4- (1H- 1,2,4- triazol- 1- ylmethyl)phenyl]- 1,3- thiazole- 5- carboxamide
Smiles: Cc1nc(c(s1)C(=O)Nc1ccc(cc1)Cn1cncn1)C

STK640464
Synonyms: 2- (4- chloro- 3- {[4- (pyridin- 2- yl)piperazin- 1- yl]carbonyl}phenyl)- 1,2- thiazolidin- 3- one1,1- dioxide
Smiles: O=C1CCS(=O)(=O)N1c1ccc(c(c1)C(=O)N1CCN(CC1)c1ccccn1)Cl

STK640465
Synonyms: (2E)- 2- (acetylimino)- N- [(2Z)- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]- 2,3- dihydro- 1,3- benzothiazole- 6- carboxamide
Smiles: CC(=O)/N=c/1\[nH]c2c(s1)cc(cc2)C(=O)/N=c/1\scc([nH]1)C

STK640467
Synonyms: [4- (4- fluorophenyl)piperazin- 1- yl](2- methyl- 1H- indol- 3- yl)aceticacid
Smiles: OC(=O)C(c1c(C)[nH]c2c1cccc2)N1CCN(CC1)c1ccc(cc1)F

STK640470
Synonyms: N- {1- [2- (3,4- dimethoxyphenyl)ethyl]- 2- hydroxy- 5- oxo- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl}- 3- methylbutanamide
Smiles: COc1cc(CCN2C(=NC(C2=O)(NC(=O)CC(C)C)C(F)(F)F)O)ccc1OC

STK640473
Synonyms: N- {[3- (thiophen- 2- yl)- 1,2,4- oxadiazol- 5- yl]methyl}methanesulfonamide
Smiles: CS(=O)(=O)NCc1onc(n1)c1cccs1

STK640476
Synonyms: tert- butyl[(4- {[(2E)- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]carbamoyl}cyclohexyl)methyl]carbamate
Smiles: O=C(OC(C)(C)C)NCC1CCC(CC1)C(=O)/N=c\1/scc([nH]1)C

STK640479
Synonyms: 3- methyl- 4- [4- (propan- 2- yl)phenyl]- 1- (pyrimidin- 2- yl)- 4,5- dihydro- 1H- pyrazolo[3,4- b]pyridin- 6- ol
Smiles: OC1=Nc2c(C(C1)c1ccc(cc1)C(C)C)c(nn2c1ncccn1)C

STK640480
Synonyms: 4- fluoro- N- [2- (piperidin- 1- ylcarbonyl)phenyl]- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: Fc1ccc(c(c1)n1cnnn1)C(=O)Nc1ccccc1C(=O)N1CCCCC1

STK640482
Synonyms: 6- (benzylamino)- 2- hydroxy- 3- methylpyrimidin- 4(3H)- one
Smiles: Oc1nc(NCc2ccccc2)cc(=O)n1C

STK640485
Synonyms: N- [3- (dimethylamino)propyl]- 3- (2- hydroxy- 5- methylphenyl)- 3- phenylpropanamide
Smiles: CN(CCCNC(=O)CC(c1cc(C)ccc1O)c1ccccc1)C

STK640489
Synonyms: N- cyclopropyl- 5- fluoro- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: Fc1ccc(c(c1)C(=O)NC1CC1)n1cnnn1

STK640490
Synonyms: (3R,4S)- 1- (4- fluorophenyl)- 3- [(3S)- 3- (4- fluorophenyl)- 3- hydroxypropyl]- 4- (4- hydroxyphenyl)azetidin- 2- one
Smiles: Oc1ccc(cc1)[C@@H]1[C@@H](CC[C@@H](c2ccc(cc2)F)O)C(=O)N1c1ccc(cc1)F

STK640491
Synonyms: 5- (pyridin- 4- yl)- 4- [4- (trifluoromethoxy)phenyl]- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1c1ccc(cc1)OC(F)(F)F)c1ccncc1

STK640492
Synonyms: tert- butyl[(2R)- 3- (3a,7a- dihydro- 1H- indol- 3- yl)- 1- oxo- 1- {(2E)- 2- [(4- oxo- 4H- chromen- 3- yl)methylidene]hydrazinyl}propan- 2- yl]carbamate(non- preferredname)
Smiles: O=C(OC(C)(C)C)N[C@@H](C(=O)N/N=C/c1coc2c(c1=O)cccc2)CC1=CNC2C1C=CC=C2

STK640493
Synonyms: N- {[2- (3- methoxyphenyl)- 1,3- thiazol- 4- yl]acetyl}- L- isoleucine
Smiles: CC[C@H]([C@@H](C(=O)O)NC(=O)Cc1csc(n1)c1cccc(c1)OC)C

STK640496
Synonyms: 3- (2- methoxyphenyl)- 9- propyl- 2- (trifluoromethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: CCCN1COc2c(C1)c1oc(c(c(=O)c1cc2)c1ccccc1OC)C(F)(F)F

STK857796
Synonyms: 1- methyl- 4- (morpholin- 4- yl)- 6- (pyrrolidin- 1- yl)- 1H- pyrazolo[3,4- d]pyrimidine
Smiles: Cn1ncc2c1nc(nc2N1CCOCC1)N1CCCC1

STK640497
Synonyms: 2- {[(4- hydroxy- 6,7- dimethoxyquinazolin- 2- yl)methyl]sulfanyl}- N- (2- hydroxy- 2- phenylethyl)acetamide
Smiles: COc1cc2nc(CSCC(=O)NCC(c3ccccc3)O)nc(c2cc1OC)O

STK640499
Synonyms: N- (2,4- dihydroxypyrimidin- 5- yl)- N'- (1- phenylethyl)ethanediamide
Smiles: Oc1ncc(c(n1)O)NC(=O)C(=O)NC(c1ccccc1)C

STK640500
Synonyms: N- {2- [(1H- indol- 3- ylcarbonyl)amino]ethyl}- 1H- indole- 2- carboxamide
Smiles: O=C(c1[nH]c2c(c1)cccc2)NCCNC(=O)c1c[nH]c2c1cccc2

STK640501
Synonyms: 3- (2,3- difluorophenyl)- 6- methyl[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Cc1nn2c(s1)nnc2c1cccc(c1F)F

STK640502
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 3- {4- methyl- 7- [(2- methylprop- 2- en- 1- yl)oxy]- 2- oxo- 2H- chromen- 6- yl}propanamide
Smiles: CC(=C)COc1cc2oc(=O)cc(c2cc1CCC(=O)NC1CCS(=O)(=O)C1)C

STK640503
Synonyms: 4- [2,4- dioxo- 3- (prop- 2- en- 1- yl)imidazolidin- 1- yl]- 3- [(4- fluorobenzyl)oxy]- N,N- dimethylbenzenesulfonamide
Smiles: C=CCN1C(=O)CN(C1=O)c1ccc(cc1OCc1ccc(cc1)F)S(=O)(=O)N(C)C

STK640504
Synonyms: 2- (4- {[4- (furan- 2- ylcarbonyl)piperazin- 1- yl]sulfonyl}- 3- methylphenyl)- 4- methyl- 1,2- thiazolidin- 3- one1,1- dioxide
Smiles: O=C1C(C)CS(=O)(=O)N1c1ccc(c(c1)C)S(=O)(=O)N1CCN(CC1)C(=O)c1ccco1

STK640509
Synonyms: methyl2- benzyl- 5- hydroxy- 4- methylthieno[2,3- d]pyrimidine- 6- carboxylate
Smiles: COC(=O)c1sc2c(c1O)c(C)nc(n2)Cc1ccccc1

STK640511
Synonyms: N- [4- (2- chloro- 1,1,2- trifluoroethoxy)phenyl]- 2- [2- (morpholin- 4- yl)- 4- oxo- 4,5- dihydro- 1,3- thiazol- 5- yl]acetamide
Smiles: FC(C(Oc1ccc(cc1)NC(=O)CC1SC(=NC1=O)N1CCOCC1)(F)F)Cl

STK640514
Synonyms: 2,4- dihydroxy- 6- methyl- N- phenylpyrimidine- 5- sulfonamide
Smiles: Oc1nc(C)c(c(n1)O)S(=O)(=O)Nc1ccccc1

STK640516
Synonyms: 2- (4- fluorophenyl)- 6- hydroxy- 5- (2- methoxyethyl)- 4- methyl- 2,5- dihydro- 3H- pyrazolo[4,3- c]pyridin- 3- one
Smiles: COCCn1c(O)cc2c(c1C)c(=O)n(n2)c1ccc(cc1)F

STK640517
Synonyms: 3- (4- methoxyphenyl)- 9- (pyridin- 4- ylmethyl)- 9,10- dihydro- 2H,8H- chromeno[8,7- e][1,3]oxazin- 2- one
Smiles: COc1ccc(cc1)c1cc2ccc3c(c2oc1=O)CN(CO3)Cc1ccncc1

STK640520
Synonyms: 9- (1,1- dioxidotetrahydrothiophen- 3- yl)- 3- (4- methoxyphenyl)- 2- (trifluoromethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1)c1c(=O)c2ccc3c(c2oc1C(F)(F)F)CN(CO3)C1CCS(=O)(=O)C1

STK640521
Synonyms: 4- fluoro- N- (2- methylpropyl)- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: CC(CNC(=O)c1ccc(cc1n1cnnn1)F)C

STK640526
Synonyms: N- (2,4- dihydroxypyrimidin- 5- yl)- N'- (2,2,6,6- tetramethylpiperidin- 4- yl)ethanediamide
Smiles: Oc1ncc(c(n1)O)NC(=O)C(=O)NC1CC(C)(C)NC(C1)(C)C

STK640530
Synonyms: N- (2- methoxybenzyl)- 3- (pyridin- 3- yl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: COc1ccccc1CNC(=O)c1onc(n1)c1cccnc1

STK640531
Synonyms: N- [2- (3,5- dimethyl- 1H- pyrazol- 1- yl)ethyl]- 3- [4- (propan- 2- yloxy)phenyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: CC(Oc1ccc(cc1)c1noc(n1)C(=O)NCCn1nc(cc1C)C)C

STK640532
Synonyms: N- benzyl- 2- [(2- hydroxy- 4,5- dihydro- 3H- 1- benzazepin- 3- yl)sulfanyl]- N- methylacetamide
Smiles: O=C(N(Cc1ccccc1)C)CSC1CCc2c(N=C1O)cccc2

STK640533
Synonyms: 5- bromo- N- [(4- hydroxy- 1- phenyl- 1H- pyrazolo[3,4- d]pyrimidin- 6- yl)methyl]furan- 2- carboxamide
Smiles: Brc1ccc(o1)C(=O)NCc1nc(O)c2c(n1)n(nc2)c1ccccc1

STK640534
Synonyms: 5- [2- (5- fluoro- 1H- indol- 3- yl)ethyl]- 6- hydroxy- 4- methyl- 2- phenyl- 2,5- dihydro- 3H- pyrazolo[4,3- c]pyridin- 3- one
Smiles: Fc1ccc2c(c1)c(c[nH]2)CCn1c(O)cc2c(c1C)c(=O)n(n2)c1ccccc1

STK640539
Synonyms: 3- (2- methoxyphenyl)- 6- (phenylsulfanyl)[1,2,4]triazolo[4,3- b]pyridazine
Smiles: COc1ccccc1c1nnc2n1nc(cc2)Sc1ccccc1

STK640540
Synonyms: 2- benzyl- N- (propan- 2- yl)- 1,2,3,4- tetrahydropyrazino[1,2- a]benzimidazole- 8- carboxamide
Smiles: CC(NC(=O)c1ccc2c(c1)nc1n2CCN(C1)Cc1ccccc1)C

STK640541
Synonyms: 3- methyl- 2- oxo- N- [1- (pyridin- 3- ylcarbonyl)- 2,3- dihydro- 1H- indol- 5- yl]- 2,3- dihydro- 1,3- benzoxazole- 6- sulfonamide
Smiles: O=C(N1CCc2c1ccc(c2)NS(=O)(=O)c1ccc2c(c1)oc(=O)n2C)c1cccnc1

STK640543
Synonyms: 2- {[5- (1,1- dioxido- 1,2- thiazinan- 2- yl)- 2- methoxyphenyl]sulfonyl}- 6,7- dimethoxy- 1,2,3,4- tetrahydroisoquinoline
Smiles: COc1ccc(cc1S(=O)(=O)N1CCc2c(C1)cc(c(c2)OC)OC)N1CCCCS1(=O)=O

STK640544
Synonyms: 2'- (2- methoxyethyl)- 1'- oxo- N- (pyridin- 2- yl)- 1',4'- dihydro- 2'H- spiro[cyclohexane- 1,3'- isoquinoline]- 4'- carboxamide
Smiles: COCCN1C(=O)c2ccccc2C(C21CCCCC2)C(=O)Nc1ccccn1

STK640546
Synonyms: 2- (2,1,3- benzothiadiazol- 4- yloxy)- 1- (1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)ethanone
Smiles: O=C(N1CCc2c(C1)c1ccccc1[nH]2)COc1cccc2c1nsn2

STK640547
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 4- chloro- 3- (1,1- dioxido- 1,2- thiazinan- 2- yl)benzamide
Smiles: O=C(c1ccc(c(c1)N1CCCCS1(=O)=O)Cl)NCc1ccc2c(c1)OCO2

STK640549
Synonyms: N- [(2S)- 1- (4- acetylpiperazin- 1- yl)- 1- oxo- 3- phenylpropan- 2- yl]pyridine- 3- carboxamide
Smiles: O=C([C@@H](NC(=O)c1cccnc1)Cc1ccccc1)N1CCN(CC1)C(=O)C

STK640551
Synonyms: 1- (3,4- dihydroquinolin- 1(2H)- yl)- 2- [2- (2- fluorophenyl)- 1,3- thiazol- 5- yl]ethanone
Smiles: Fc1ccccc1c1ncc(s1)CC(=O)N1CCCc2c1cccc2

STK640552
Synonyms: 7- methoxy- 4- methyl- 6- {3- oxo- 3- [4- (pyridin- 2- yl)piperazin- 1- yl]propyl}- 2H- chromen- 2- one
Smiles: COc1cc2oc(=O)cc(c2cc1CCC(=O)N1CCN(CC1)c1ccccn1)C

STK640553
Synonyms: 2,3- dihydro- 1,4- benzodioxin- 2- yl(4- {[2- (trifluoromethyl)- 1H- benzimidazol- 6- yl]carbonyl}piperazin- 1- yl)methanone
Smiles: O=C(C1COc2c(O1)cccc2)N1CCN(CC1)C(=O)c1ccc2c(c1)[nH]c(n2)C(F)(F)F

STK640557
Synonyms: 2- ({2- [(6- methyl- 7- oxo- 7H- [1,3]thiazolo[3,2- b][1,2,4]triazin- 3- yl)amino]- 2- oxoethyl}sulfanyl)- N- phenylacetamide
Smiles: O=C(Nc1csc2n1nc(C)c(=O)n2)CSCC(=O)Nc1ccccc1

STK640558
Synonyms: 2- (thiomorpholin- 4- yl)- N- (3,4,5- trimethoxyphenyl)- 1,3- thiazole- 4- carboxamide
Smiles: COc1cc(NC(=O)c2csc(n2)N2CCSCC2)cc(c1OC)OC

STK640561
Synonyms: tert- butyl2- hydroxy- 4- methyl- 6- (naphthalen- 1- yl)- 1,6- dihydropyrimidine- 5- carboxylate
Smiles: OC1=NC(=C(C(N1)c1cccc2c1cccc2)C(=O)OC(C)(C)C)C

STK640562
Synonyms: N- (1,1- dioxido- 2,3- dihydrothiophen- 3- yl)- 2- {2- [4- (trifluoromethoxy)phenyl]- 1,3- thiazol- 5- yl}acetamide
Smiles: O=C(Cc1cnc(s1)c1ccc(cc1)OC(F)(F)F)NC1C=CS(=O)(=O)C1

STK640563
Synonyms: 3- (7- hydroxy- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 6- yl)- N- [(2E)- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]propanamide
Smiles: O=C(/N=c\1/scc([nH]1)C)CCc1c(C)nc2n(c1O)ncn2

STK640564
Synonyms: 3- (4- fluorophenyl)- 9- propyl- 2- (trifluoromethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: CCCN1COc2c(C1)c1oc(c(c(=O)c1cc2)c1ccc(cc1)F)C(F)(F)F

STK640565
Synonyms: N- (2- methoxybenzyl)- 2- (5- methoxy- 1H- indol- 1- yl)acetamide
Smiles: COc1ccc2c(c1)ccn2CC(=O)NCc1ccccc1OC

STK640566
Synonyms: 5- methoxy- N- [(2S)- 1- {[2- (4- methoxyphenyl)ethyl]amino}- 1- oxopropan- 2- yl]- 1- methyl- 1H- indole- 2- carboxamide
Smiles: COc1ccc(cc1)CCNC(=O)[C@@H](NC(=O)c1cc2c(n1C)ccc(c2)OC)C

STK640578
Synonyms: N- methyl- N- [(2R)- 1- phenylpropan- 2- yl]prop- 2- yn- 1- amine
Smiles: C[C@@H](N(CC#C)C)Cc1ccccc1

STK640581
Synonyms: 1- {5- [4- (1H- indol- 2- ylcarbonyl)piperazin- 1- yl]- 5- oxopentanoyl}piperidine- 4- carboxamide
Smiles: NC(=O)C1CCN(CC1)C(=O)CCCC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2

STK640584
Synonyms: 5- (5- bromopyridin- 3- yl)- 4- (2- chlorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Brc1cncc(c1)c1n[nH]c(=S)n1c1ccccc1Cl

STK640586
Synonyms: 3- {[3- (2,3- difluorophenyl)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]methyl}benzoicacid
Smiles: OC(=O)c1cccc(c1)Cn1c(=S)[nH]nc1c1cccc(c1F)F

STK857799
Synonyms: N- {[3- (2- chlorophenyl)- 1,2,4- oxadiazol- 5- yl]methyl}- N- methylmethanesulfonamide
Smiles: Clc1ccccc1c1noc(n1)CN(S(=O)(=O)C)C

STK640591
Synonyms: [4- (diphenylmethyl)piperazin- 1- yl](2- methyl- 1H- indol- 3- yl)aceticacid
Smiles: OC(=O)C(c1c(C)[nH]c2c1cccc2)N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK640594
Synonyms: 1- (4- fluorophenyl)- 1H- pyrazolo[3,4- d]pyrimidine- 4- thiol
Smiles: Fc1ccc(cc1)n1ncc2c1ncnc2S

STK640595
Synonyms: 1- hydroxy- 9,9- dimethyl- 4- (2- phenylethyl)- 9,10- dihydropyrimido[4,5- c]isoquinoline- 3,7(4H,8H)- dione
Smiles: O=C1CC(C)(C)Cc2c1cnc1c2c(O)nc(=O)n1CCc1ccccc1

STK640598
Synonyms: 1- (6- bromo- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)- 2,2- dimethylpropan- 1- one
Smiles: O=C(C(C)(C)C)N1CCc2c(C1)c1cccc(c1[nH]2)Br

STK640601
Synonyms: N- (diphenylmethyl)- 3- (pyridin- 3- yl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)c1cccnc1)NC(c1ccccc1)c1ccccc1

STK640603
Synonyms: 4- {[1- (furan- 2- ylmethyl)- 2,5- dioxo- 2,5- dihydro- 1H- pyrrol- 3- yl]amino}benzoicacid
Smiles: O=C1C=C(C(=O)N1Cc1ccco1)Nc1ccc(cc1)C(=O)O

STK640604
Synonyms: 5- (3,4- dimethoxyphenyl)- 2- (2- methoxyphenyl)- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: COc1cc(ccc1OC)c1[nH]n(c(=O)c1)c1ccccc1OC

STK857800
Synonyms: N- (2- bromophenyl)- 3- methyl- 4- nitro- 1H- pyrazol- 5- amine
Smiles: Brc1ccccc1Nc1[nH]nc(c1[N+](=O)[O-])C

STK640607
Synonyms: methyl(2E)- 3- {[4- (dimethylamino)phenyl]amino}- 4- [(2- hydroxyethyl)amino]- 4- oxobut- 2- enoate
Smiles: OCCNC(=O)/C(=C\C(=O)OC)/Nc1ccc(cc1)N(C)C

STK640608
Synonyms: 3- (4- fluorophenyl)- 6- [(2- hydroxy- 4,5- dihydro- 3H- 1- benzazepin- 3- yl)oxy]- 2- methylquinazolin- 4(3H)- one
Smiles: Fc1ccc(cc1)n1c(C)nc2c(c1=O)cc(cc2)OC1CCc2c(N=C1O)cccc2

STK640610
Synonyms: 2- [(4- amino- 5- phenylthieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N- phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nc(N)c2c(n1)scc2c1ccccc1

STK640611
Synonyms: N- [2- hydroxy- 1- (2- methylphenyl)- 5- oxo- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]- 2- phenylacetamide
Smiles: O=C(NC1(N=C(N(C1=O)c1ccccc1C)O)C(F)(F)F)Cc1ccccc1

STK640613
Synonyms: N- [2- (pyridin- 2- yl)ethyl]- 2,1,3- benzoxadiazole- 5- sulfonamide3- oxide
Smiles: [O-][n+]1onc2c1cc(cc2)S(=O)(=O)NCCc1ccccn1

STK640614
Synonyms: 2- (5- methoxy- 4,8,8- trimethyl- 2- oxo- 9,10- dihydro- 2H,8H- pyrano[2,3- f]chromen- 3- yl)- N- methyl- N- [2- (4- methylpiperazin- 1- yl)- 2- oxoethyl]acetamide
Smiles: COc1cc2OC(C)(C)CCc2c2c1c(C)c(CC(=O)N(CC(=O)N1CCN(CC1)C)C)c(=O)o2

STK640616
Synonyms: methyl4- {[9- (2- methoxyethyl)- 4- oxo- 2- (trifluoromethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 3- yl]oxy}benzoate
Smiles: COCCN1COc2c(C1)c1oc(c(c(=O)c1cc2)Oc1ccc(cc1)C(=O)OC)C(F)(F)F

STK640618
Synonyms: methyl4- {[3- (6- fluoro- 1H- indol- 1- yl)propanoyl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CCn1ccc2c1cc(F)cc2

STK857801
Synonyms: N- benzyl- 2- [(2Z)- 2- {[(4- methoxyphenyl)sulfonyl]imino}- 2,3- dihydro- 1,3- thiazol- 4- yl]acetamide
Smiles: COc1ccc(cc1)S(=O)(=O)/N=c/1\scc([nH]1)CC(=O)NCc1ccccc1

STK640620
Synonyms: 2- (5- methoxy- 1H- indol- 1- yl)- 1- {4- [2- (pyridin- 4- yl)ethyl]piperazin- 1- yl}ethanone
Smiles: COc1ccc2c(c1)ccn2CC(=O)N1CCN(CC1)CCc1ccncc1

STK640622
Synonyms: ethyl(2Z)- 2- {[(2E)- 3- (4- chlorophenyl)prop- 2- enoyl]imino}- 1- (3- methoxypropyl)- 10- methyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxylate
Smiles: COCCCn1/c(=N\C(=O)/C=C/c2ccc(cc2)Cl)/c(cc2c1nc1c(C)cccn1c2=O)C(=O)OCC

STK640625
Synonyms: N- [4- (4,5- dihydro- 1H- [1,4]diazepino[1,2- a]benzimidazol- 2(3H)- yl)phenyl]- 2- methylpropanamide
Smiles: O=C(C(C)C)Nc1ccc(cc1)N1CCCn2c(C1)nc1c2cccc1

STK857802
Synonyms: N- (3- chlorophenyl)- 3- [2- methyl- 4- (thiophen- 2- yl)- 1,3- thiazol- 5- yl]propanamide
Smiles: O=C(Nc1cccc(c1)Cl)CCc1sc(nc1c1cccs1)C

STK640627
Synonyms: 4- fluoro- 2- (1H- tetrazol- 1- yl)- N- [3- (trifluoromethyl)phenyl]benzamide
Smiles: Fc1ccc(c(c1)n1cnnn1)C(=O)Nc1cccc(c1)C(F)(F)F

STK640630
Synonyms: 1- [2- (3,4- dimethoxyphenyl)ethyl]- 3- {[2- (3,4- dimethoxyphenyl)ethyl]amino}- 1H- pyrrole- 2,5- dione
Smiles: COc1ccc(cc1OC)CCNC1=CC(=O)N(C1=O)CCc1ccc(c(c1)OC)OC

STK640636
Synonyms: N- [2- (4- fluorophenyl)- 4- oxo- 4H- chromen- 6- yl]- 2,6- dimethoxybenzamide
Smiles: COc1cccc(c1C(=O)Nc1ccc2c(c1)c(=O)cc(o2)c1ccc(cc1)F)OC

STK640637
Synonyms: 1- methyl- 5- oxo- 2- phenyl- N- [2- (4- sulfamoylphenyl)ethyl]pyrrolidine- 3- carboxamide
Smiles: CN1C(=O)CC(C1c1ccccc1)C(=O)NCCc1ccc(cc1)S(=O)(=O)N

STK640639
Synonyms: 2- ({3- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl}methyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: CC(Cc1[nH]nc(c1)c1nnc2n1nc(s2)CN1C(=O)c2c(C1=O)cccc2)C

STK640641
Synonyms: methyl2- ({[4- (1,1- dioxido- 1,2- thiazinan- 2- yl)- 2,6- dimethylphenyl]sulfonyl}amino)benzoate
Smiles: COC(=O)c1ccccc1NS(=O)(=O)c1c(C)cc(cc1C)N1CCCCS1(=O)=O

STK640642
Synonyms: 1- [(4- hydroxyphthalazin- 1- yl)acetyl]- N- (pyridin- 2- ylmethyl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)C(=O)Cc1nnc(c2c1cccc2)O)NCc1ccccn1

STK640643
Synonyms: (2- methyl- 1H- indol- 3- yl)(piperidin- 1- yl)aceticacid
Smiles: OC(=O)C(c1c(C)[nH]c2c1cccc2)N1CCCCC1

STK640648
Synonyms: (2- phenylmorpholin- 4- yl)[2- (trifluoromethyl)- 1,3- benzothiazol- 6- yl]methanone
Smiles: O=C(c1ccc2c(c1)sc(n2)C(F)(F)F)N1CCOC(C1)c1ccccc1

STK640651
Synonyms: 2- ({[5- (1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)- 2- ethoxyphenyl]sulfonyl}amino)benzamide
Smiles: CCOc1ccc(cc1S(=O)(=O)Nc1ccccc1C(=O)N)N1C(=O)CCS1(=O)=O

STK640652
Synonyms: 4- (2- chlorophenyl)- 2,6- dihydro- 4H- pyrazolo[3,4- e][1,4]thiazepin- 7- ol
Smiles: OC1=Nc2n[nH]cc2C(SC1)c1ccccc1Cl

STK640654
Synonyms: N- (3- acetylphenyl)- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: CC(=O)c1cccc(c1)NC(=O)c1ccccc1n1cnnn1

STK640655
Synonyms: N- [2- (4- hydroxyphenyl)ethyl]- 4- methyl- 2- (1H- pyrrol- 1- yl)- 1,3- thiazole- 5- carboxamide
Smiles: Oc1ccc(cc1)CCNC(=O)c1sc(nc1C)n1cccc1

STK640656
Synonyms: (2Z)- 2- {[hydroxy(2- phenylethyl)phosphoryl]methyl}- 3- (1,2,3,4- tetrahydroquinolin- 8- yl)prop- 2- enoicacid
Smiles: OC(=O)/C(=C/c1cccc2c1NCCC2)/CP(=O)(CCc1ccccc1)O

STK640659
Synonyms: [5- (benzyloxy)- 1H- indol- 3- yl](4- {2- [(2- methoxyethyl)amino]- 2- oxoethyl}piperazin- 1- yl)aceticacid
Smiles: COCCNC(=O)CN1CCN(CC1)C(c1c[nH]c2c1cc(OCc1ccccc1)cc2)C(=O)O

STK640661
Synonyms: 3- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 6- ethyl- 2- methyl- 7- [(pentafluorobenzyl)oxy]- 4H- chromen- 4- one
Smiles: CCc1cc2c(cc1OCc1c(F)c(F)c(c(c1F)F)F)oc(c(c2=O)c1ccc2c(c1)OCCO2)C

STK640662
Synonyms: 2- chloro- 5- (1,1- dioxido- 1,2- thiazinan- 2- yl)- N- (tetrahydrofuran- 2- ylmethyl)benzamide
Smiles: O=C(c1cc(ccc1Cl)N1CCCCS1(=O)=O)NCC1CCCO1

STK640664
Synonyms: N- (6- methylpyridin- 2- yl)- 2- (trifluoromethyl)- 1,3- benzothiazole- 6- carboxamide
Smiles: Cc1cccc(n1)NC(=O)c1ccc2c(c1)sc(n2)C(F)(F)F

STK640670
Synonyms: 2- [(1'- acetyl- 4- oxo- 3,4- dihydrospiro[chromene- 2,4'- piperidin]- 7- yl)oxy]- N- [(2E)- 1,3- benzothiazol- 2(3H)- ylidene]acetamide
Smiles: O=C(/N=c\1/sc2c([nH]1)cccc2)COc1ccc2c(c1)OC1(CC2=O)CCN(CC1)C(=O)C

STK640671
Synonyms: N- [4- (1- benzofuran- 2- ylcarbonyl)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)C(=O)c1cc2c(o1)cccc2

STK640672
Synonyms: 6- [(E)- 2- (4- methoxyphenyl)ethenyl]- 3- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1ccc(cc1)/C=C/c1nn2c(s1)nnc2c1n[nH]c(c1)CC(C)C

STK640676
Synonyms: 2- {[3- (4- chlorophenyl)- 4- oxo- 4H- chromen- 7- yl]oxy}- N- [(2Z)- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]acetamide
Smiles: Clc1ccc(cc1)c1coc2c(c1=O)ccc(c2)OCC(=O)/N=c/1\scc([nH]1)C

STK640679
Synonyms: 3- (1H- indol- 3- ylmethyl)- 2- (prop- 2- en- 1- yl)- 3,4- dihydro- 2H- 1,2- benzothiazin- 4- ol1,1- dioxide
Smiles: C=CCN1C(Cc2c[nH]c3c2cccc3)C(O)c2c(S1(=O)=O)cccc2

STK640681
Synonyms: [5- (benzyloxy)- 1H- indol- 3- yl][4- (2,4- dimethylphenyl)piperazin- 1- yl]aceticacid
Smiles: OC(=O)C(c1c[nH]c2c1cc(OCc1ccccc1)cc2)N1CCN(CC1)c1ccc(cc1C)C

STK640682
Synonyms: ethyl(2Z)- 2- [(1,3- benzodioxol- 5- ylcarbonyl)imino]- 10- methyl- 5- oxo- 1- (propan- 2- yl)- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxylate
Smiles: CCOC(=O)c1cc2c(n(/c/1=N\C(=O)c1ccc3c(c1)OCO3)C(C)C)nc1n(c2=O)cccc1C

STK640684
Synonyms: 4- (2- fluorophenyl)- 6- hydroxy- 2- [(2- oxo- 2- phenylethyl)sulfanyl]- 4,5- dihydropyridine- 3- carbonitrile
Smiles: N#CC1=C(SCC(=O)c2ccccc2)N=C(CC1c1ccccc1F)O

STK640687
Synonyms: N- [3- (dimethylamino)propyl]- 3- (1H- indol- 5- yl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: CN(CCCNC(=O)c1onc(n1)c1ccc2c(c1)cc[nH]2)C

STK640691
Synonyms: 2- (4- nitrophenyl)- 2- (propan- 2- yloxy)- 2,3- dihydro- 1,4- benzodioxine
Smiles: CC(OC1(COc2c(O1)cccc2)c1ccc(cc1)[N+](=O)[O-])C

STK640692
Synonyms: N- cyclopentyl- 3- (1H- indol- 3- ylmethyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)Cc1c[nH]c2c1cccc2)NC1CCCC1

STK640696
Synonyms: 3,3'- (2- hydroxypropane- 1,3- diyl)bis(2- hydroxy- 5,5- dimethyl- 3,5- dihydro- 4H- imidazol- 4- one)
Smiles: OC(CN1C(=NC(C1=O)(C)C)O)CN1C(=NC(C1=O)(C)C)O

STK640698
Synonyms: 4- (2,4- difluorophenyl)- 3- methyl- 1- (pyrimidin- 2- yl)- 4,5- dihydro- 1H- pyrazolo[3,4- b]pyridin- 6- ol
Smiles: Fc1ccc(c(c1)F)C1CC(=Nc2c1c(C)nn2c1ncccn1)O

STK640699
Synonyms: N- (4- acetylphenyl)- 4- amino- 7- hydroxy- 2- (morpholin- 4- yl)- 5,6- dihydropyrido[2,3- d]pyrimidine- 5- carboxamide
Smiles: OC1=Nc2nc(nc(c2C(C1)C(=O)Nc1ccc(cc1)C(=O)C)N)N1CCOCC1

STK640703
Synonyms: 2- (5- methoxy- 1H- indol- 1- yl)- N- [2- (morpholin- 4- yl)ethyl]acetamide
Smiles: COc1ccc2c(c1)ccn2CC(=O)NCCN1CCOCC1

STK640705
Synonyms: 2- (6- bromo- 1H- indol- 1- yl)- N- (1,1- dioxidotetrahydrothiophen- 3- yl)acetamide
Smiles: O=C(Cn1ccc2c1cc(Br)cc2)NC1CCS(=O)(=O)C1

STK640706
Synonyms: 2- [(4S)- 1- (1,3- benzodioxol- 5- ylmethyl)- 2,5- dioxoimidazolidin- 4- yl]- N- (4- methyl- 1,3- thiazol- 2- yl)acetamide
Smiles: O=C(C[C@@H]1NC(=O)N(C1=O)Cc1ccc2c(c1)OCO2)Nc1scc(n1)C

STK640708
Synonyms: N- (4- hydroxyphenyl)- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: Oc1ccc(cc1)NC(=O)c1ccccc1n1cnnn1

STK857804
Synonyms: 4- {5- [5- (propan- 2- yl)- 1H- pyrazol- 3- yl]- 1,2,4- oxadiazol- 3- yl}pyridine
Smiles: CC(c1[nH]nc(c1)c1onc(n1)c1ccncc1)C

STK640715
Synonyms: 2- methylpropyl[(3,5- dihydroxy- 1,2,4- triazin- 6- yl)sulfanyl]acetate
Smiles: CC(COC(=O)CSc1nnc(nc1O)O)C

STK640716
Synonyms: 3- {[3- (1,3- benzodioxol- 5- yl)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]methyl}benzoicacid
Smiles: OC(=O)c1cccc(c1)Cn1c(=S)[nH]nc1c1ccc2c(c1)OCO2

STK640719
Synonyms: N- acetyl- N- {3- [(4- methoxyphenyl)sulfonyl]- 4,5- dimethyl- 1- propyl- 1H- pyrrol- 2- yl}acetamide
Smiles: CCCn1c(C)c(c(c1N(C(=O)C)C(=O)C)S(=O)(=O)c1ccc(cc1)OC)C

STK640723
Synonyms: 6- (3- methylbutyl)- 2- (piperidin- 1- yl)pyrimidin- 4- ol
Smiles: CC(CCc1cc(O)nc(n1)N1CCCCC1)C

STK640724
Synonyms: 4- (2- methoxyphenyl)- 3- methyl- 1- (pyrimidin- 2- yl)- 4,5- dihydro- 1H- pyrazolo[3,4- b]pyridin- 6- ol
Smiles: COc1ccccc1C1CC(=Nc2c1c(C)nn2c1ncccn1)O

STK640725
Synonyms: 6,6- dimethyl- 9- (quinolin- 8- yl)- 6,7,9,10- tetrahydro- 5H- [1,2,5]oxadiazolo[3,4- b][1,4]benzodiazepin- 8- ol
Smiles: OC1=C2C(=Nc3c(NC2c2cccc4c2nccc4)non3)CC(C1)(C)C

STK640726
Synonyms: (8- methyl- 1- oxa- 4,8- diazaspiro[4.5]dec- 4- yl)[4- (prop- 2- en- 1- yloxy)phenyl]methanone
Smiles: C=CCOc1ccc(cc1)C(=O)N1CCOC21CCN(CC2)C

STK640727
Synonyms: N- (2- hydroxy- 2- phenylethyl)- 4- ({[(4- methoxyphenyl)sulfonyl]amino}methyl)benzamide
Smiles: COc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)C(=O)NCC(c1ccccc1)O

STK640729
Synonyms: 3- (7- methoxy- 4- methyl- 2- oxo- 2H- chromen- 6- yl)- N- (pyridin- 4- ylmethyl)propanamide
Smiles: COc1cc2oc(=O)cc(c2cc1CCC(=O)NCc1ccncc1)C

STK640732
Synonyms: 1- ethyl- 2- methyl- N- [(2E)- 5- methyl- 1,3,4- thiadiazol- 2(3H)- ylidene]- 4- oxo- 1,4- dihydroquinoline- 6- carboxamide
Smiles: CCn1c(C)cc(=O)c2c1ccc(c2)C(=O)/N=c/1\[nH]nc(s1)C

STK640737
Synonyms: 2- [(2- hydroxy- 4,5- dihydro- 3H- 1- benzazepin- 3- yl)sulfanyl]- N- (thiophen- 2- ylmethyl)acetamide
Smiles: O=C(CSC1CCc2c(N=C1O)cccc2)NCc1cccs1

STK640742
Synonyms: 2- chloro- N- (3- chlorophenyl)- 5- (1,1- dioxido- 1,2- thiazinan- 2- yl)benzamide
Smiles: Clc1cccc(c1)NC(=O)c1cc(ccc1Cl)N1CCCCS1(=O)=O

STK640747
Synonyms: N- [4- (acetylamino)phenyl]- 2- {2- [4- (trifluoromethoxy)phenyl]- 1,3- thiazol- 5- yl}acetamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)Cc1cnc(s1)c1ccc(cc1)OC(F)(F)F

STK640749
Synonyms: 8- {3- [(1,3- benzodioxol- 5- yloxy)methyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl}quinoline
Smiles: C1Oc2c(O1)ccc(c2)OCc1nnc2n1nc(s2)c1cccc2c1nccc2

STK640750
Synonyms: 4- {4- [(2,4- dimethoxyphenyl)carbamoyl]- 2- oxopyrrolidin- 1- yl}benzoicacid
Smiles: COc1ccc(c(c1)OC)NC(=O)C1CN(C(=O)C1)c1ccc(cc1)C(=O)O

STK640752
Synonyms: 5- (2- hydroxyethyl)- 6- methyl- 2- (4- methylpiperazin- 1- yl)pyrimidin- 4- ol
Smiles: OCCc1c(C)nc(nc1O)N1CCN(CC1)C

STK640753
Synonyms: N- [2- (4- hydroxyphenyl)ethyl]- 2- {2- [4- (trifluoromethoxy)phenyl]- 1,3- thiazol- 5- yl}acetamide
Smiles: O=C(Cc1cnc(s1)c1ccc(cc1)OC(F)(F)F)NCCc1ccc(cc1)O

STK640754
Synonyms: N- [(2Z)- 4- hydroxy- 3- (morpholin- 4- yl)- 1- oxonaphthalen- 2(1H)- ylidene]thiophene- 2- sulfonamide
Smiles: OC1=C(N2CCOCC2)/C(=N/S(=O)(=O)c2cccs2)/C(=O)c2c1cccc2

STK640755
Synonyms: N- (furan- 2- ylmethyl)- 3- (pyridin- 2- yl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)c1ccccn1)NCc1ccco1

STK640756
Synonyms: 2- (6,7- dimethoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- {[1- (4- methylpiperazin- 1- yl)cyclohexyl]methyl}acetamide
Smiles: COc1cc2c(cc1OC)oc(=O)c(c2C)CC(=O)NCC1(CCCCC1)N1CCN(CC1)C

STK857806
Synonyms: N- (6- bromo- 2- methylquinolin- 4- yl)pyridine- 2- carboxamide
Smiles: Brc1ccc2c(c1)c(cc(n2)C)NC(=O)c1ccccn1

STK640762
Synonyms: 5- [(2E)- 2- (4- bromobenzylidene)hydrazinyl]- 1,2,4- triazin- 3- ol
Smiles: Brc1ccc(cc1)/C=N/Nc1cnnc(n1)O

STK640766
Synonyms: 2- (2,5- dimethyl- 7- oxo- 3- phenyl- 7H- furo[3,2- g]chromen- 6- yl)- N- (pyridin- 3- yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1c1ccccc1)C)Nc1cccnc1

STK640767
Synonyms: 6- fluoro- 4- hydroxy- N- [(2E)- 5- (2- methylpropyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]quinoline- 3- carboxamide
Smiles: CC(Cc1n[nH]/c(=N\C(=O)c2cnc3c(c2O)cc(cc3)F)/s1)C

STK640768
Synonyms: (8- fluoro- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)(pyridin- 4- yl)methanone
Smiles: Fc1ccc2c(c1)c1CN(CCc1[nH]2)C(=O)c1ccncc1

STK640769
Synonyms: (4aR,7aS)- 4- (1,3- benzodioxol- 5- ylmethyl)- 1- (3- chloro- 4- methoxyphenyl)hexahydrothieno[3,4- b]pyrazin- 2(1H)- one6,6- dioxide
Smiles: COc1ccc(cc1Cl)N1C(=O)CN([C@@H]2[C@H]1CS(=O)(=O)C2)Cc1ccc2c(c1)OCO2

STK640772
Synonyms: 3- [(1,3- benzodioxol- 5- yloxy)methyl]- 6- (4- chlorobenzyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Clc1ccc(cc1)Cc1sc2n(n1)c(nn2)COc1ccc2c(c1)OCO2

STK640777
Synonyms: 5- (4- fluorophenyl)- 1,3- dimethyl- 6- (5- methyl- 1,2- oxazol- 3- yl)- 1H- pyrrolo[3,4- d]pyrimidine- 2,4(3H,6H)- dione
Smiles: Fc1ccc(cc1)c1n(cc2c1c(=O)n(C)c(=O)n2C)c1noc(c1)C

STK640784
Synonyms: 2- [(5- benzyl- 4- methyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N- [(2Z)- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]acetamide
Smiles: O=C(/N=c/1\scc([nH]1)C)CSc1nnc(n1C)Cc1ccccc1

STK640785
Synonyms: 2- {3- [(2,4- dichlorophenoxy)methyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl}- 1H- indole
Smiles: Clc1ccc(c(c1)Cl)OCc1nnc2n1nc(s2)c1cc2c([nH]1)cccc2

STK640786
Synonyms: 4- (2,4- dichlorophenyl)- 3- methyl- 1- (pyrimidin- 2- yl)- 4,5- dihydro- 1H- pyrazolo[3,4- b]pyridin- 6- ol
Smiles: Clc1ccc(c(c1)Cl)C1CC(=Nc2c1c(C)nn2c1ncccn1)O

STK640787
Synonyms: (4aR,7aS)- 4- [2- (3,4- dimethoxyphenyl)ethyl]- 1- [4- (propan- 2- yl)phenyl]hexahydrothieno[3,4- b]pyrazin- 2(1H)- one6,6- dioxide
Smiles: COc1ccc(cc1OC)CCN1CC(=O)N([C@H]2[C@@H]1CS(=O)(=O)C2)c1ccc(cc1)C(C)C

STK640789
Synonyms: (7E)- 7- (4- methoxybenzylidene)- 9- methyl- 3- [2- (morpholin- 4- yl)ethyl]- 3,4- dihydro- 2H- furo[3,2- g][1,3]benzoxazin- 6(7H)- one
Smiles: COc1ccc(cc1)/C=C\1/Oc2c(C1=O)cc1c(c2C)OCN(C1)CCN1CCOCC1

STK640790
Synonyms: 3- (4- fluorophenyl)- 7- imino- 2- (methoxymethyl)- 4,7- dihydropyrazolo[1,5- a]pyrimidine- 6- carbonitrile
Smiles: COCc1nn2c(c1c1ccc(cc1)F)[nH]cc(c2=N)C#N

STK640791
Synonyms: 2'- (2- methoxyethyl)- 4'- (piperidin- 1- ylcarbonyl)- 2'H- spiro[cyclohexane- 1,3'- isoquinolin]- 1'(4'H)- one
Smiles: COCCN1C(=O)c2ccccc2C(C21CCCCC2)C(=O)N1CCCCC1

STK640796
Synonyms: N- [(2E)- 1,3- benzothiazol- 2(3H)- ylidene]- 1- (3- methoxyphenyl)- 5- oxopyrrolidine- 3- carboxamide
Smiles: COc1cccc(c1)N1CC(CC1=O)C(=O)/N=c\1/sc2c([nH]1)cccc2

STK640797
Synonyms: N- (2,5- dimethoxyphenyl)- 5- fluoro- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: COc1ccc(c(c1)NC(=O)c1cc(F)ccc1n1cnnn1)OC

STK640799
Synonyms: 1- (4- acetylpiperazin- 1- yl)- 2- (5- bromo- 1H- indol- 1- yl)ethanone
Smiles: Brc1ccc2c(c1)ccn2CC(=O)N1CCN(CC1)C(=O)C

STK640800
Synonyms: N- [3- (diethylamino)propyl]- N'- (2,4- dihydroxypyrimidin- 5- yl)ethanediamide
Smiles: CCN(CCCNC(=O)C(=O)Nc1cnc(nc1O)O)CC

STK640803
Synonyms: 2- (3,4- dihydroisoquinolin- 2(1H)- yl)- 4- hydroxy- 7- oxo- 5,6,7,8- tetrahydropyrido[2,3- d]pyrimidine- 5- carboxylicacid
Smiles: O=C1Nc2nc(nc(c2C(C1)C(=O)O)O)N1CCc2c(C1)cccc2

STK640805
Synonyms: 6- methyl- 3- (3- methylthiophen- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Cc1sc2n(n1)c(nn2)c1sccc1C

STK640806
Synonyms: N- [(2E)- 3- cyano- 10- methyl- 5- oxo- 1- propyl- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidin- 2- ylidene]- 3,4- dimethoxybenzamide
Smiles: CCCn1/c(=N/C(=O)c2ccc(c(c2)OC)OC)/c(C#N)cc2c1nc1c(C)cccn1c2=O

STK640810
Synonyms: 2- [(4- amino- 5- phenylthieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- 1- (piperidin- 1- yl)ethanone
Smiles: O=C(N1CCCCC1)CSc1nc(N)c2c(n1)scc2c1ccccc1

STK640813
Synonyms: 2- (1- oxophthalazin- 2(1H)- yl)benzoicacid
Smiles: OC(=O)c1ccccc1n1ncc2c(c1=O)cccc2

STK640814
Synonyms: N- {4- [3- (8- fluoro- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)- 2,5- dioxopyrrolidin- 1- yl]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1C(=O)CC(C1=O)N1CCc2c(C1)c1cc(F)ccc1[nH]2

STK640816
Synonyms: 7- (2,5- dimethoxyphenyl)- 2- methyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine- 5- carboxylicacid
Smiles: COc1ccc(cc1C1C=C(N=c2n1nc([nH]2)C)C(=O)O)OC

STK640817
Synonyms: 1- (2- methoxyethyl)- 4,6- dimethyl- 2- oxo- 1,2- dihydropyridine- 3- carbonitrile
Smiles: COCCn1c(C)cc(c(c1=O)C#N)C

STK640818
Synonyms: N- {(2S)- 1- [(3- chloro- 4- methoxyphenyl)amino]- 1- oxopropan- 2- yl}- 4,6- dimethoxy- 1- methyl- 1H- indole- 2- carboxamide
Smiles: COc1cc(OC)c2c(c1)n(C)c(c2)C(=O)N[C@H](C(=O)Nc1ccc(c(c1)Cl)OC)C

STK640820
Synonyms: 3- (3,4- dimethoxyphenyl)- 9- (thiophen- 2- ylmethyl)- 9,10- dihydro- 2H,8H- chromeno[8,7- e][1,3]oxazin- 2- one
Smiles: COc1cc(ccc1OC)c1cc2ccc3c(c2oc1=O)CN(CO3)Cc1cccs1

STK640822
Synonyms: 3- [4- methyl- 2- oxo- 7- (propan- 2- yloxy)- 2H- chromen- 6- yl]- N- (5- methyl- 1,3- thiazol- 2- yl)propanamide
Smiles: O=C(Nc1ncc(s1)C)CCc1cc2c(C)cc(=O)oc2cc1OC(C)C

STK640823
Synonyms: 1- [4- (methylsulfonyl)piperazin- 1- yl]- 4- {4- [(2E)- 3- phenylprop- 2- en- 1- yl]piperazin- 1- yl}butane- 1,4- dione
Smiles: O=C(N1CCN(CC1)C/C=C/c1ccccc1)CCC(=O)N1CCN(CC1)S(=O)(=O)C

STK640825
Synonyms: [(5Z)- 5- ({3- [3- (dimethylsulfamoyl)phenyl]- 1- phenyl- 1H- pyrazol- 4- yl}methylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]aceticacid
Smiles: OC(=O)CN1C(=S)S/C(=C\c2cn(nc2c2cccc(c2)S(=O)(=O)N(C)C)c2ccccc2)/C1=O

STK640832
Synonyms: N- {2- [(3,4- dimethoxyphenyl)carbonyl]- 3- methyl- 1- benzofuran- 5- yl}pyridine- 2- carboxamide
Smiles: COc1cc(ccc1OC)C(=O)c1oc2c(c1C)cc(cc2)NC(=O)c1ccccn1

STK640833
Synonyms: 1- methyl- N- (naphthalen- 1- yl)- 5- oxo- 2- phenylpyrrolidine- 3- carboxamide
Smiles: O=C(C1CC(=O)N(C1c1ccccc1)C)Nc1cccc2c1cccc2

STK857811
Synonyms: 4- chloro- 3- (1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)- N- (2- fluorophenyl)benzamide
Smiles: O=C1CCS(=O)(=O)N1c1cc(ccc1Cl)C(=O)Nc1ccccc1F

STK640838
Synonyms: N- [4- (propan- 2- yl)phenyl]- 1- ([1,2,4]triazolo[4,3- b]pyridazin- 6- yl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ccc2n(n1)cnn2)Nc1ccc(cc1)C(C)C

STK640840
Synonyms: [4- (3- chlorobenzyl)piperazin- 1- yl](6- fluoro- 1H- indol- 3- yl)aceticacid
Smiles: OC(=O)C(c1c[nH]c2c1ccc(c2)F)N1CCN(CC1)Cc1cccc(c1)Cl

STK640842
Synonyms: N'- [6- (4- chlorophenyl)pyridazin- 3- yl]- N,N- diethylpropane- 1,3- diamine
Smiles: CCN(CCCNc1ccc(nn1)c1ccc(cc1)Cl)CC

STK640843
Synonyms: 2- [(3,5- dihydroxy- 1,2,4- triazin- 6- yl)amino]- N'- [(E)- (2,3,6- trichlorophenyl)methylidene]acetohydrazide(non- preferredname)
Smiles: O=C(CNc1nnc(nc1O)O)N/N=C/c1c(Cl)ccc(c1Cl)Cl

STK640846
Synonyms: 1- ethyl- 3- [(8- methoxy- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)carbonyl]- 7- methyl- 1,8- naphthyridin- 4(1H)- one
Smiles: COc1ccc2c(c1)c1CN(CCc1[nH]2)C(=O)c1cn(CC)c2c(c1=O)ccc(n2)C

STK640847
Synonyms: 2- (4- {[4- (furan- 2- ylcarbonyl)piperazin- 1- yl]sulfonyl}phenyl)- 4,4- dimethyl- 1,2- thiazolidin- 3- one1,1- dioxide
Smiles: O=C1N(c2ccc(cc2)S(=O)(=O)N2CCN(CC2)C(=O)c2ccco2)S(=O)(=O)CC1(C)C

STK640848
Synonyms: 1- methyl- 3- [2- oxo- 2- (piperidin- 1- yl)ethoxy]- 5,6,7,8- tetrahydroisoquinoline- 4- carbonitrile
Smiles: N#Cc1c(OCC(=O)N2CCCCC2)nc(c2c1CCCC2)C

STK640849
Synonyms: 5- [(2- phenylethyl)amino]- 9- (propan- 2- yl)- 7,8,9,10- tetrahydro[1,2,4]triazolo[3,4- a][2,7]naphthyridine- 6- carbonitrile
Smiles: N#Cc1c(NCCc2ccccc2)n2cnnc2c2c1CCN(C2)C(C)C

STK640855
Synonyms: 3- chloro- 4- fluoro- N- (3- {1- methyl- 5- [(methylsulfonyl)amino]- 1H- benzimidazol- 2- yl}propyl)benzamide
Smiles: O=C(c1ccc(c(c1)Cl)F)NCCCc1nc2c(n1C)ccc(c2)NS(=O)(=O)C

STK640859
Synonyms: N- (2- methoxyphenyl)- 1- (3- methyl[1,2,4]triazolo[4,3- b]pyridazin- 6- yl)piperidine- 4- carboxamide
Smiles: COc1ccccc1NC(=O)C1CCN(CC1)c1ccc2n(n1)c(C)nn2

STK640860
Synonyms: ethyl1- {[5- (1,1- dioxido- 1,2- thiazinan- 2- yl)- 2- methoxyphenyl]sulfonyl}piperidine- 4- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)S(=O)(=O)c1cc(ccc1OC)N1CCCCS1(=O)=O

STK640862
Synonyms: N- [(3,5- dimethyl- 1,2- oxazol- 4- yl)methyl]- N'- [4- (3- ethyl- 2- hydroxy- 6- oxo- 3,4,5,6- tetrahydropyridin- 3- yl)phenyl]ethanediamide
Smiles: CCC1(CCC(=O)N=C1O)c1ccc(cc1)NC(=O)C(=O)NCc1c(C)noc1C

STK640863
Synonyms: ethyl(2Z)- 2- {[(4- tert- butylphenyl)carbonyl]imino}- 1- (2- methoxyethyl)- 10- methyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxylate
Smiles: COCCn1/c(=N\C(=O)c2ccc(cc2)C(C)(C)C)/c(cc2c1nc1c(C)cccn1c2=O)C(=O)OCC

STK640866
Synonyms: 2- (2- benzyl- 1H- benzimidazol- 1- yl)- N- [2- (1H- indol- 3- yl)ethyl]acetamide
Smiles: O=C(Cn1c(Cc2ccccc2)nc2c1cccc2)NCCc1c[nH]c2c1cccc2

STK640869
Synonyms: N- (cyanomethyl)- 2- [4- (6- methoxy- 2- oxo- 2H- chromen- 3- yl)phenoxy]acetamide
Smiles: N#CCNC(=O)COc1ccc(cc1)c1cc2cc(OC)ccc2oc1=O

STK640871
Synonyms: N- (4- methoxybenzyl)- 3- (pyridin- 2- yl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: COc1ccc(cc1)CNC(=O)c1onc(n1)c1ccccn1

STK640872
Synonyms: 4- (3- cyclohexyl- 2,4- dioxoimidazolidin- 1- yl)- 3- methoxy- N,N- dimethylbenzenesulfonamide
Smiles: COc1cc(ccc1N1CC(=O)N(C1=O)C1CCCCC1)S(=O)(=O)N(C)C

STK640873
Synonyms: N- cyclohexyl- 3- (1H- indol- 3- ylmethyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)Cc1c[nH]c2c1cccc2)NC1CCCCC1

STK640874
Synonyms: N- {(2S)- 1- [(furan- 2- ylmethyl)amino]- 3- methyl- 1- oxobutan- 2- yl}- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: O=C(c1ccc2c(c1)sc(n2)n1cccc1)N[C@H](C(=O)NCc1ccco1)C(C)C

STK640875
Synonyms: N- cyclopropyl- 2- [(2- hydroxy- 4,5- dihydro- 3H- 1- benzazepin- 3- yl)sulfanyl]acetamide
Smiles: O=C(NC1CC1)CSC1CCc2c(N=C1O)cccc2

STK640879
Synonyms: 2- benzyl- 10,10- dimethyl- 6- [2- (morpholin- 4- yl)- 2- oxoethyl]- 6,8,10,11- tetrahydro- 5H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 5- one
Smiles: O=C(N1CCOCC1)Cn1c(=O)n2nc(nc2c2c1sc1c2CC(OC1)(C)C)Cc1ccccc1

STK640880
Synonyms: 2- (2- chlorophenyl)- N- (2- hydroxy- 5- methylphenyl)- 4- methyl- 1,3- thiazole- 5- carboxamide
Smiles: Cc1ccc(c(c1)NC(=O)c1sc(nc1C)c1ccccc1Cl)O

STK640881
Synonyms: 1- (1,2- dimethyl- 1H- indol- 3- yl)propan- 2- amine
Smiles: CC(Cc1c(C)n(c2c1cccc2)C)N

STK640882
Synonyms: 2- ({[5- (morpholin- 4- ylmethyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}methyl)quinazolin- 4- ol
Smiles: C=CCn1c(SCc2nc(O)c3c(n2)cccc3)nnc1CN1CCOCC1

STK640884
Synonyms: 2- (4- fluorophenyl)- 6- hydroxy- 5- [2- (5- methoxy- 1H- indol- 3- yl)ethyl]- 4- methyl- 2,5- dihydro- 3H- pyrazolo[4,3- c]pyridin- 3- one
Smiles: COc1ccc2c(c1)c(c[nH]2)CCn1c(O)cc2c(c1C)c(=O)n(n2)c1ccc(cc1)F

STK857817
Synonyms: N- (4- {[4- (morpholin- 4- ylcarbonyl)benzyl]sulfamoyl}phenyl)acetamide
Smiles: O=C(c1ccc(cc1)CNS(=O)(=O)c1ccc(cc1)NC(=O)C)N1CCOCC1

STK640889
Synonyms: methylN- [(5- bromo- 1H- indol- 1- yl)acetyl]- L- alaninate
Smiles: COC(=O)[C@@H](NC(=O)Cn1ccc2c1ccc(c2)Br)C

STK640892
Synonyms: 3- (2- methyl- 1,3- thiazol- 4- yl)- 2- oxo- 2H- chromen- 7- yl3- phenylpropanoate
Smiles: O=C(Oc1ccc2c(c1)oc(=O)c(c2)c1csc(n1)C)CCc1ccccc1

STK640895
Synonyms: 5- (2- hydroxy- 6- methyl- 4- oxopyrimidin- 1(4H)- yl)- 1,3- dihydro- 2H- benzimidazol- 2- one
Smiles: O=c1cc(C)n(c(n1)O)c1ccc2c(c1)[nH]c(=O)[nH]2

STK640896
Synonyms: 3- phenyl- 6- (phenylsulfanyl)[1,2,4]triazolo[4,3- b]pyridazine
Smiles: c1ccc(cc1)Sc1ccc2n(n1)c(nn2)c1ccccc1

STK857818
Synonyms: N'- [(4- methyl- 3- nitrophenyl)sulfonyl]pyridine- 4- carbohydrazide
Smiles: O=C(c1ccncc1)NNS(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])C

STK640898
Synonyms: 4- (3- hydroxyphenyl)- 5- [2- (5- methoxy- 1H- indol- 3- yl)ethyl]- 3- (3- methoxyphenyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1cccc(c1)c1[nH]nc2c1C(c1cccc(c1)O)N(C2=O)CCc1c[nH]c2c1cc(OC)cc2

STK640900
Synonyms: 3- hydroxy- N- (2- methoxyphenyl)- 6- (morpholin- 4- yl)- 4- phenylthieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1ccccc1NC(=O)c1sc2c(c1O)c(cc(n2)N1CCOCC1)c1ccccc1

STK640901
Synonyms: N- benzyl- 2- [4- (1H- indol- 2- ylcarbonyl)piperazin- 1- yl]- 2- oxoacetamide
Smiles: O=C(C(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2)NCc1ccccc1

STK640902
Synonyms: 4- (1H- indol- 3- yl)- 1- [4- (tetrahydrofuran- 2- ylcarbonyl)piperazin- 1- yl]butan- 1- one
Smiles: O=C(N1CCN(CC1)C(=O)C1CCCO1)CCCc1c[nH]c2c1cccc2

STK640904
Synonyms: 4- hydroxy- 2- methyl- N- [(2E)- 5- (propan- 2- yl)- 1,3,4- thiadiazol- 2(3H)- ylidene]quinoline- 6- carboxamide
Smiles: Cc1cc(O)c2c(n1)ccc(c2)C(=O)/N=c/1\[nH]nc(s1)C(C)C

STK640906
Synonyms: methyl2- ({[2- (morpholin- 4- yl)- 4- oxo- 4,5- dihydro- 1,3- thiazol- 5- yl]acetyl}amino)- 5- propylthiophene- 3- carboxylate
Smiles: CCCc1sc(c(c1)C(=O)OC)NC(=O)CC1SC(=NC1=O)N1CCOCC1

STK640916
Synonyms: 1- {[1- (3- methyl[1,2,4]triazolo[4,3- b]pyridazin- 6- yl)piperidin- 4- yl]carbonyl}piperidine- 4- carboxamide
Smiles: NC(=O)C1CCN(CC1)C(=O)C1CCN(CC1)c1ccc2n(n1)c(C)nn2

STK640917
Synonyms: 2- (4,6- dimethyl- 2- oxopyrimidin- 1(2H)- yl)- N- [(3- phenyl- 1,2,4- oxadiazol- 5- yl)methyl]acetamide
Smiles: O=C(Cn1c(C)cc(nc1=O)C)NCc1onc(n1)c1ccccc1

STK640919
Synonyms: N- (cyclopropylmethyl)- 3- [4- (propan- 2- yloxy)phenyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: CC(Oc1ccc(cc1)c1noc(n1)C(=O)NCC1CC1)C

STK640920
Synonyms: 2- (4,6- dimethylpyrimidin- 2- yl)- 8- (furan- 2- yl)- 1- hydroxy- 2,7,8,9- tetrahydro- 6H- pyrazolo[3,4- c]isoquinolin- 6- one
Smiles: Cc1cc(C)nc(n1)n1nc2c(c1O)c1CC(CC(=O)c1cn2)c1ccco1

STK640921
Synonyms: N- [4- (4,5- dihydro- 1H- [1,4]diazepino[1,2- a]benzimidazol- 2(3H)- yl)phenyl]- 2- phenoxyacetamide
Smiles: O=C(Nc1ccc(cc1)N1CCCn2c(C1)nc1c2cccc1)COc1ccccc1

STK640925
Synonyms: N- {[1- (2,1,3- benzothiadiazol- 4- ylsulfonyl)piperidin- 4- yl]carbonyl}glycine
Smiles: OC(=O)CNC(=O)C1CCN(CC1)S(=O)(=O)c1cccc2c1nsn2

STK640927
Synonyms: 9- phenyl- 9,10- dihydro- 8H- spiro[chromeno[8,7- e][1,3]oxazine- 2,1'- cyclohexan]- 4(3H)- one
Smiles: O=C1CC2(CCCCC2)Oc2c1ccc1c2CN(CO1)c1ccccc1

STK640930
Synonyms: tert- butyl4- {[2- (2- methyl- 1H- indol- 3- yl)ethyl]carbamoyl}piperidine- 1- carboxylate
Smiles: O=C(C1CCN(CC1)C(=O)OC(C)(C)C)NCCc1c(C)[nH]c2c1cccc2

STK640931
Synonyms: 3- {(2E)- 2- [(2E)- 3- phenylprop- 2- en- 1- ylidene]hydrazinyl}- 1,2,4- triazin- 5- ol
Smiles: Oc1cnnc(n1)N/N=C/C=C/c1ccccc1

STK640933
Synonyms: 5- bromo- N- (4- chlorophenyl)- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: Clc1ccc(cc1)NC(=O)c1cc(Br)ccc1n1cnnn1

STK640934
Synonyms: 2- [(3,5- dihydroxy- 1,2,4- triazin- 6- yl)amino]- N'- [(E)- (2- fluorophenyl)methylidene]propanehydrazide(non- preferredname)
Smiles: O=C(C(Nc1nnc(nc1O)O)C)N/N=C/c1ccccc1F

STK640936
Synonyms: 6- (butylsulfanyl)- 8- (4- methylphenyl)- 2,3,4,8- tetrahydropyrazolo[4,3- e]pyrimido[1,2- c]pyrimidine
Smiles: CCCCSc1nc2n(ncc2c2=NCCCn12)c1ccc(cc1)C

STK640937
Synonyms: 5- [5- (benzylamino)- 4- cyano- 1,3- oxazol- 2- yl]- 2- methoxy- N,N- dimethylbenzenesulfonamide
Smiles: N#Cc1nc(oc1NCc1ccccc1)c1ccc(c(c1)S(=O)(=O)N(C)C)OC

STK640940
Synonyms: 3- (3,4- dimethoxyphenyl)- 9- [2- (2- methoxyphenyl)ethyl]- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1cc(ccc1OC)c1coc2c(c1=O)ccc1c2CN(CCc2ccccc2OC)CO1

STK640942
Synonyms: 1- (3- methyl[1,2,4]triazolo[4,3- b]pyridazin- 6- yl)- N- [2- (morpholin- 4- yl)ethyl]piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ccc2n(n1)c(C)nn2)NCCN1CCOCC1

STK640944
Synonyms: N- {(2S)- 1- [4- (2- fluorophenyl)piperazin- 1- yl]- 1- oxo- 3- phenylpropan- 2- yl}pyridine- 3- carboxamide
Smiles: O=C([C@@H](NC(=O)c1cccnc1)Cc1ccccc1)N1CCN(CC1)c1ccccc1F

STK640951
Synonyms: 3- (3- methoxy- 1,2- oxazol- 5- yl)- N- {4- oxo- 2- [4- (propan- 2- yl)phenyl]- 4H- chromen- 6- yl}propanamide
Smiles: COc1noc(c1)CCC(=O)Nc1ccc2c(c1)c(=O)cc(o2)c1ccc(cc1)C(C)C

STK640962
Synonyms: 1- [2- (dimethylamino)ethyl]- 6- ethyl- 2,3,5- trimethyl- 1H- pyrrolo[2,3- b]pyridin- 4- amine
Smiles: CCc1nc2n(CCN(C)C)c(c(c2c(c1C)N)C)C

STK640967
Synonyms: {1- [({[2- (2- fluorophenyl)- 1,3- thiazol- 4- yl]acetyl}amino)methyl]cyclohexyl}aceticacid
Smiles: O=C(Cc1csc(n1)c1ccccc1F)NCC1(CCCCC1)CC(=O)O

STK640968
Synonyms: 3- methyl- N- [1- (pyridin- 3- ylcarbonyl)- 1,2,3,4- tetrahydroquinolin- 6- yl]butanamide
Smiles: CC(CC(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccnc1)C

STK640973
Synonyms: (2Z)- 1- methyl- 2- (phenylimino)- 1,2- dihydroquinazolin- 4- ol
Smiles: Oc1n/c(=N\c2ccccc2)/n(c2c1cccc2)C

STK640979
Synonyms: N- [4- (1,3- benzothiazol- 2- yl)phenyl]- N'- (2- hydroxyethyl)ethanediamide
Smiles: OCCNC(=O)C(=O)Nc1ccc(cc1)c1nc2c(s1)cccc2

STK640982
Synonyms: (3E)- 3- (4- hydroxybenzylidene)- 2- (2- hydroxyethyl)- 2,3- dihydro- 4H- 1,2- benzothiazin- 4- one1,1- dioxide
Smiles: OCCN1/C(=C/c2ccc(cc2)O)/C(=O)c2c(S1(=O)=O)cccc2

STK640984
Synonyms: 6- (azepan- 1- yl)- 1- methyl- 4- (pyrrolidin- 1- yl)- 1H- pyrazolo[3,4- d]pyrimidine
Smiles: Cn1ncc2c1nc(nc2N1CCCC1)N1CCCCCC1

STK640985
Synonyms: (4E)- 4- [(2,4- dimethylpyrimidin- 5- yl)(hydroxy)methylidene]- 5- (4- fluorophenyl)- 1- [3- (morpholin- 4- yl)propyl]pyrrolidine- 2,3- dione
Smiles: Fc1ccc(cc1)C1N(CCCN2CCOCC2)C(=O)C(=O)/C/1=C(\c1cnc(nc1C)C)/O

STK640987
Synonyms: methylN- [(5- bromo- 1H- indol- 1- yl)acetyl]- L- valinate
Smiles: COC(=O)[C@H](C(C)C)NC(=O)Cn1ccc2c1ccc(c2)Br

STK640988
Synonyms: (8- methyl- 1- oxa- 4,8- diazaspiro[4.5]dec- 4- yl)(3,4,5- trimethoxyphenyl)methanone
Smiles: COc1cc(cc(c1OC)OC)C(=O)N1CCOC21CCN(CC2)C

STK640989
Synonyms: (2S)- N- (1- benzylpiperidin- 4- yl)- 2- (1- oxo- 1,3- dihydro- 2H- isoindol- 2- yl)propanamide
Smiles: O=C([C@@H](N1Cc2c(C1=O)cccc2)C)NC1CCN(CC1)Cc1ccccc1

STK640990
Synonyms: 4- ({[(4- methoxyphenyl)sulfonyl]amino}methyl)- N- (pyridin- 4- ylmethyl)benzamide
Smiles: COc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)C(=O)NCc1ccncc1

STK640992
Synonyms: N- [2- (dimethylamino)ethyl]- 2- [(12- oxo- 6,7,8,9,10,12- hexahydroazepino[2,1- b]quinazolin- 2- yl)oxy]acetamide
Smiles: CN(CCNC(=O)COc1ccc2c(c1)c(=O)n1c(n2)CCCCC1)C

STK640994
Synonyms: N- (4- fluorobenzyl)- 1- ([1,2,4]triazolo[4,3- b]pyridazin- 6- yl)piperidine- 4- carboxamide
Smiles: Fc1ccc(cc1)CNC(=O)C1CCN(CC1)c1ccc2n(n1)cnn2

STK641004
Synonyms: (2Z)- 2- (acetylimino)- 2,3- dihydro- 1,3- benzothiazole- 6- carboxylicacid
Smiles: CC(=O)/N=c\1/[nH]c2c(s1)cc(cc2)C(=O)O

STK641005
Synonyms: trans- 4- ({[(4- chlorophenyl)sulfonyl]amino}methyl)- N- [3- (1H- imidazol- 1- yl)propyl]cyclohexanecarboxamide
Smiles: Clc1ccc(cc1)S(=O)(=O)NC[C@@H]1CC[C@H](CC1)C(=O)NCCCn1ccnc1

STK641006
Synonyms: 2- (5- bromo- 1H- indol- 1- yl)- N- (pyridin- 3- yl)acetamide
Smiles: O=C(Cn1ccc2c1ccc(c2)Br)Nc1cccnc1

STK641007
Synonyms: 1- (3- methyl[1,2,4]triazolo[4,3- b]pyridazin- 6- yl)- N- (2- phenylethyl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ccc2n(n1)c(C)nn2)NCCc1ccccc1

STK641009
Synonyms: (1,3- dioxo- 2- azaspiro[4.4]non- 2- yl)aceticacid
Smiles: OC(=O)CN1C(=O)CC2(C1=O)CCCC2

STK641010
Synonyms: 2- chloro- 5- (1,1- dioxido- 1,2- thiazinan- 2- yl)- N- (pyridin- 3- ylmethyl)benzamide
Smiles: O=C(c1cc(ccc1Cl)N1CCCCS1(=O)=O)NCc1cccnc1

STK641015
Synonyms: 2- (4- methylpiperazin- 1- yl)- 6- [(pyridin- 2- ylsulfanyl)methyl]pyrimidin- 4- ol
Smiles: CN1CCN(CC1)c1nc(CSc2ccccn2)cc(n1)O

STK641020
Synonyms: 2- fluoro- N- {(1Z)- 1- (1- methyl- 1H- indol- 3- yl)- 3- oxo- 3- [(pyridin- 3- ylmethyl)amino]prop- 1- en- 2- yl}benzamide
Smiles: O=C(/C(=C/c1cn(c2c1cccc2)C)/NC(=O)c1ccccc1F)NCc1cccnc1

STK641021
Synonyms: [5- bromo- 2- (1H- tetrazol- 1- yl)phenyl][4- (pyrimidin- 2- yl)piperazin- 1- yl]methanone
Smiles: Brc1ccc(c(c1)C(=O)N1CCN(CC1)c1ncccn1)n1cnnn1

STK641023
Synonyms: 7- (2- chlorophenyl)- 5- hydrazinyl- 1,3- dimethylpyrimido[4,5- d]pyrimidine- 2,4(1H,3H)- dione
Smiles: NNc1nc(nc2c1c(=O)n(c(=O)n2C)C)c1ccccc1Cl

STK641029
Synonyms: 3- (1H- indol- 6- yl)- N- [2- oxo- 2- (propan- 2- ylamino)ethyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: CC(NC(=O)CNC(=O)c1onc(n1)c1ccc2c(c1)[nH]cc2)C

STK641030
Synonyms: N- (2- methoxyethyl)- 2- {(2E)- 2- [(methylsulfonyl)imino]- 2,3- dihydro- 1,3- thiazol- 4- yl}acetamide
Smiles: COCCNC(=O)Cc1cs/c(=N/S(=O)(=O)C)/[nH]1

STK641034
Synonyms: 2,3- dimethyl- 1- (pyridin- 3- yl)- 5,6,7,8- tetrahydro- 1H- pyrrolo[2,3- b]quinolin- 4- amine
Smiles: Nc1c2CCCCc2nc2c1c(C)c(n2c1cccnc1)C

STK641035
Synonyms: 5- bromo- N- (5- methyl- 1,3- thiazol- 2- yl)- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: Brc1ccc(c(c1)C(=O)Nc1ncc(s1)C)n1cnnn1

STK641036
Synonyms: N- [5- (4,5- dihydro- 1H- [1,4]diazepino[1,2- a]benzimidazol- 2(3H)- yl)- 2- methoxyphenyl]cyclohexanecarboxamide
Smiles: COc1ccc(cc1NC(=O)C1CCCCC1)N1CCCn2c(C1)nc1c2cccc1

STK641037
Synonyms: 5- bromo- 2- [(2- chlorobenzyl)sulfanyl]- N- [(2E)- 5- methyl- 1,3,4- thiadiazol- 2(3H)- ylidene]pyrimidine- 4- carboxamide
Smiles: Cc1n[nH]/c(=N\C(=O)c2nc(ncc2Br)SCc2ccccc2Cl)/s1

STK641038
Synonyms: 1- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 2- (5- methoxy- 1H- indol- 1- yl)ethanone
Smiles: COc1ccc2c(c1)ccn2CC(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK641039
Synonyms: N- [(2Z)- 4- phenyl- 5- (piperidin- 1- ylmethyl)- 1,3- thiazol- 2(3H)- ylidene]benzamide
Smiles: O=C(c1ccccc1)/N=c/1\sc(c([nH]1)c1ccccc1)CN1CCCCC1

STK641041
Synonyms: 2- [4- methoxy- 3- (pyrrolidin- 1- ylsulfonyl)phenyl]- 1,2- thiazinane1,1- dioxide
Smiles: COc1ccc(cc1S(=O)(=O)N1CCCC1)N1CCCCS1(=O)=O

STK641042
Synonyms: 4- chloro- N- (pyridin- 4- yl)- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: Clc1ccc(c(c1)n1cnnn1)C(=O)Nc1ccncc1

STK641043
Synonyms: ethyl[(2Z)- 2- ({[(5- amino- 1,3,4- thiadiazol- 2- yl)sulfanyl]acetyl}imino)- 2,3- dihydro- 1,3- thiazol- 4- yl]acetate
Smiles: CCOC(=O)Cc1cs/c(=N\C(=O)CSc2nnc(s2)N)/[nH]1

STK641047
Synonyms: 1- (diphenylacetyl)- N- [(1S)- 2- hydroxy- 1- phenylethyl]piperidine- 4- carboxamide
Smiles: OC[C@H](c1ccccc1)NC(=O)C1CCN(CC1)C(=O)C(c1ccccc1)c1ccccc1

STK641052
Synonyms: N- (2,4- dihydroxypyrimidin- 5- yl)- N'- [2- (3,5- dimethyl- 1H- pyrazol- 1- yl)ethyl]ethanediamide
Smiles: Cc1nn(c(c1)C)CCNC(=O)C(=O)Nc1cnc(nc1O)O

STK641053
Synonyms: (7E)- 9- methyl- 3- [3- (morpholin- 4- yl)propyl]- 7- (thiophen- 2- ylmethylidene)- 3,4- dihydro- 2H- furo[3,2- g][1,3]benzoxazin- 6(7H)- one
Smiles: O=C1/C(=C\c2cccs2)/Oc2c1cc1CN(CCCN3CCOCC3)COc1c2C

STK641054
Synonyms: N- (2,1,3- benzothiadiazol- 5- yl)- N'- [3- (dimethylamino)propyl]ethanediamide
Smiles: CN(CCCNC(=O)C(=O)Nc1ccc2c(c1)nsn2)C

STK641056
Synonyms: [4- (diphenylmethyl)piperazin- 1- yl](1H- indol- 3- yl)aceticacid
Smiles: OC(=O)C(c1c[nH]c2c1cccc2)N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK641059
Synonyms: 3,4,5- trimethoxy- N- [1- (pyridin- 3- ylcarbonyl)- 1,2,3,4- tetrahydroquinolin- 7- yl]benzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)Nc1ccc2c(c1)N(CCC2)C(=O)c1cccnc1

STK641060
Synonyms: 1- [1- (furan- 2- ylmethyl)- 2,5- dimethyl- 1H- pyrrol- 3- yl]- 2- [(4- hydroxypyrimidin- 2- yl)sulfanyl]ethanone
Smiles: Oc1ccnc(n1)SCC(=O)c1cc(n(c1C)Cc1ccco1)C

STK641061
Synonyms: 4- (4- fluorophenyl)- 3- methyl- 1- (pyrimidin- 2- yl)- 4,5- dihydro- 1H- pyrazolo[3,4- b]pyridin- 6- ol
Smiles: Fc1ccc(cc1)C1CC(=Nc2c1c(C)nn2c1ncccn1)O

STK641064
Synonyms: 2- (tetrahydrofuran- 2- ylmethyl)- 1,2,3,4- tetrahydropyrazino[1,2- a]benzimidazole- 8- carboxamide
Smiles: NC(=O)c1ccc2c(c1)nc1n2CCN(C1)CC1CCCO1

STK641066
Synonyms: 6- {3- [4- (4- methoxyphenyl)piperazin- 1- yl]- 3- oxopropyl}- 4- methyl- 7- (propan- 2- yloxy)- 2H- chromen- 2- one
Smiles: COc1ccc(cc1)N1CCN(CC1)C(=O)CCc1cc2c(C)cc(=O)oc2cc1OC(C)C

STK641067
Synonyms: 1- {[5- (3- bromophenyl)- 1,3,4- oxadiazol- 2- yl]carbonyl}prolinamide
Smiles: NC(=O)C1CCCN1C(=O)c1nnc(o1)c1cccc(c1)Br

STK641068
Synonyms: 5- (pyridin- 4- yl)- 2- (pyrrolidin- 1- yl)pyrido[2,3- d]pyrimidin- 4- ol
Smiles: Oc1nc(nc2c1c(ccn2)c1ccncc1)N1CCCC1

STK641069
Synonyms: [5- fluoro- 2- (1H- tetrazol- 1- yl)phenyl](thiomorpholin- 4- yl)methanone
Smiles: Fc1ccc(c(c1)C(=O)N1CCSCC1)n1cnnn1

STK641074
Synonyms: (4E)- 4- [hydroxy(7- methoxy- 1- benzofuran- 2- yl)methylidene]- 1- [3- (1H- imidazol- 1- yl)propyl]- 5- (5- methylfuran- 2- yl)pyrrolidine- 2,3- dione
Smiles: COc1cccc2c1oc(c2)/C(=C/1\C(=O)C(=O)N(C1c1ccc(o1)C)CCCn1cncc1)/O

STK641080
Synonyms: 6- (1- phenyl- 1H- pyrazol- 4- yl)- 3- (pyridin- 4- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: c1ccc(cc1)n1ncc(c1)c1sc2n(n1)c(nn2)c1ccncc1

STK641081
Synonyms: 2- chloro- N- cyclopropyl- 5- (1,1- dioxido- 1,2- thiazinan- 2- yl)benzamide
Smiles: O=C(c1cc(ccc1Cl)N1CCCCS1(=O)=O)NC1CC1

STK641082
Synonyms: N- cyclohexyl- N'- [(4- phenyltetrahydro- 2H- pyran- 4- yl)methyl]butanediamide
Smiles: O=C(NCC1(CCOCC1)c1ccccc1)CCC(=O)NC1CCCCC1

STK641083
Synonyms: 2- [6- (3,4- dichlorophenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 3- yl]quinoline
Smiles: Clc1ccc(cc1Cl)c1nn2c(s1)nnc2c1ccc2c(n1)cccc2

STK641084
Synonyms: 2- cyclopentyl- N- (propan- 2- yl)- 1,2,3,4- tetrahydropyrazino[1,2- a]benzimidazole- 8- carboxamide
Smiles: CC(NC(=O)c1ccc2c(c1)nc1n2CCN(C1)C1CCCC1)C

STK641086
Synonyms: 5- [(2,2- dimethyl- 3,4- dihydro- 2H- chromen- 6- yl)methyl]- 4- methyl- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cn1c(n[nH]c1=S)Cc1ccc2c(c1)CCC(O2)(C)C

STK641088
Synonyms: N- (2- chlorophenyl)- 2,4- dihydroxyquinoline- 3- carboxamide
Smiles: O=C(c1c(O)nc2c(c1O)cccc2)Nc1ccccc1Cl

STK641090
Synonyms: 9- (3- methoxypropyl)- 3- phenyl- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COCCCN1COc2c(C1)c1occ(c(=O)c1cc2)c1ccccc1

STK641092
Synonyms: 2,3- dimethyl- 8- (phenylamino)thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 4- ol
Smiles: Oc1nc2nnc(n2c2c1c(C)c(s2)C)Nc1ccccc1

STK641094
Synonyms: 1- (morpholin- 4- yl)- 2- [2- (piperidin- 1- ylmethyl)- 1H- benzimidazol- 1- yl]ethanone
Smiles: O=C(N1CCOCC1)Cn1c(CN2CCCCC2)nc2c1cccc2

STK641096
Synonyms: N- cyclopentyl- N~3~- {[(4- hydroxy- 1- phenyl- 1H- pyrazolo[3,4- d]pyrimidin- 6- yl)methyl]carbamoyl}- beta- alaninamide
Smiles: O=C(NCc1nc(O)c2c(n1)n(nc2)c1ccccc1)NCCC(=O)NC1CCCC1

STK641097
Synonyms: N- (4- {[(2Z)- 6- (methylsulfonyl)- 1,3- benzothiazol- 2(3H)- ylidene]sulfamoyl}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)/N=c/1\sc2c([nH]1)ccc(c2)S(=O)(=O)C

STK641098
Synonyms: N- [3- (acetylamino)phenyl]- 3- (6- bromo- 1H- indol- 1- yl)propanamide
Smiles: O=C(Nc1cccc(c1)NC(=O)C)CCn1ccc2c1cc(Br)cc2

STK641100
Synonyms: methyl[(4- cyano- 1- methyl- 5,6,7,8- tetrahydroisoquinolin- 3- yl)oxy]acetate
Smiles: COC(=O)COc1nc(C)c2c(c1C#N)CCCC2

STK641102
Synonyms: 3- benzyl- 6,7- dimethoxyquinazolin- 4(3H)- one
Smiles: COc1cc2c(cc1OC)ncn(c2=O)Cc1ccccc1

STK641103
Synonyms: N- benzyl- 2- [2- (morpholin- 4- yl)- 4- oxo- 4,5- dihydro- 1,3- thiazol- 5- yl]acetamide
Smiles: O=C(CC1SC(=NC1=O)N1CCOCC1)NCc1ccccc1

STK857826
Synonyms: 3- (2- fluorobenzyl)- 6,7- dimethoxyquinazolin- 4(3H)- one
Smiles: COc1cc2c(cc1OC)ncn(c2=O)Cc1ccccc1F

STK641104
Synonyms: 3- methyl- 2- oxo- N- [1- (pyridin- 3- ylcarbonyl)- 1,2,3,4- tetrahydroquinolin- 6- yl]- 2,3- dihydro- 1,3- benzoxazole- 6- sulfonamide
Smiles: O=C(N1CCCc2c1ccc(c2)NS(=O)(=O)c1ccc2c(c1)oc(=O)n2C)c1cccnc1

STK641105
Synonyms: 2- [(4- fluorophenyl)sulfonyl]- 8- methoxy- 2,3,4,5- tetrahydro- 1H- pyrido[4,3- b]indole
Smiles: COc1ccc2c(c1)c1CN(CCc1[nH]2)S(=O)(=O)c1ccc(cc1)F

STK641107
Synonyms: 3- (1H- indol- 6- yl)- N- (propan- 2- yl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: CC(NC(=O)c1onc(n1)c1ccc2c(c1)[nH]cc2)C

STK641108
Synonyms: N- (2- {[(3- fluorophenyl)carbonyl]amino}ethyl)- 1- methyl- 1H- indole- 2- carboxamide
Smiles: Fc1cccc(c1)C(=O)NCCNC(=O)c1cc2c(n1C)cccc2

STK641111
Synonyms: [(7- chloro- 4- hydroxyquinazolin- 2- yl)methyl](2- phenylethyl)phosphinicacid
Smiles: Clc1ccc2c(c1)nc(nc2O)CP(=O)(CCc1ccccc1)O

STK641112
Synonyms: N- benzyl- 2,4- dihydroxyquinoline- 3- carboxamide
Smiles: O=C(c1c(O)nc2c(c1O)cccc2)NCc1ccccc1

STK857828
Synonyms: 3- [(4- acetylphenyl)amino]- 1- methyl- 1H- pyrrole- 2,5- dione
Smiles: O=C1C=C(C(=O)N1C)Nc1ccc(cc1)C(=O)C

STK641115
Synonyms: 2- (2- fluoro- 6- methoxyphenyl)- 4- methyl- N- [4- (1H- 1,2,4- triazol- 1- ylmethyl)phenyl]- 1,3- thiazole- 5- carboxamide
Smiles: COc1cccc(c1c1sc(c(n1)C)C(=O)Nc1ccc(cc1)Cn1ncnc1)F

STK641117
Synonyms: N- [(2E)- 3- cyano- 5- oxo- 1- pentyl- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidin- 2- ylidene]- 3,4- dimethylbenzamide
Smiles: CCCCCn1/c(=N/C(=O)c2ccc(c(c2)C)C)/c(C#N)cc2c1nc1ccccn1c2=O

STK641119
Synonyms: 2- cyclopropyl- N- (2,5- dimethoxyphenyl)quinoline- 4- carboxamide
Smiles: COc1ccc(c(c1)NC(=O)c1cc(nc2c1cccc2)C1CC1)OC

STK857830
Synonyms: 8- nitro- 11H- indeno[1,2- b]quinoxalin- 11- one
Smiles: [O-][N+](=O)c1ccc2c(c1)nc1c(n2)c2c(C1=O)cccc2

STK641122
Synonyms: 3- (2- hydroxy- 3- methoxybenzyl)- 2- (propan- 2- yl)- 3,4- dihydro- 2H- 1,2- benzothiazin- 4- ol1,1- dioxide
Smiles: COc1cccc(c1O)CC1C(O)c2ccccc2S(=O)(=O)N1C(C)C

STK641123
Synonyms: N- [(2S)- 1- hydroxy- 3- phenylpropan- 2- yl]- 3- (1H- indol- 4- yl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: OC[C@@H](NC(=O)c1onc(n1)c1cccc2c1cc[nH]2)Cc1ccccc1

STK641130
Synonyms: N- (2- fluorophenyl)- 3- (7- hydroxy- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 6- yl)propanamide
Smiles: O=C(Nc1ccccc1F)CCc1c(C)nc2n(c1O)ncn2

STK641132
Synonyms: ethyl(2Z)- 2- {[(2- ethoxyphenyl)carbonyl]imino}- 1- (3- methoxypropyl)- 10- methyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxylate
Smiles: COCCCn1/c(=N\C(=O)c2ccccc2OCC)/c(cc2c1nc1c(C)cccn1c2=O)C(=O)OCC

STK641135
Synonyms: 4- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 2- methyl- 6- [3- (trifluoromethyl)phenoxy]pyrimidine
Smiles: Cc1nc(Oc2cccc(c2)C(F)(F)F)cc(n1)n1nc(cc1C)C

STK641136
Synonyms: N- [2- (1,4- dioxa- 8- azaspiro[4.5]dec- 8- yl)- 2- oxoethyl]- 1,3,4,9- tetrahydro- 2H- beta- carboline- 2- carboxamide
Smiles: O=C(N1CCc2c(C1)[nH]c1c2cccc1)NCC(=O)N1CCC2(CC1)OCCO2

STK641137
Synonyms: (5- chloro- 1H- indol- 3- yl)[4- (3- chlorophenyl)piperazin- 1- yl]aceticacid
Smiles: Clc1cccc(c1)N1CCN(CC1)C(c1c[nH]c2c1cc(Cl)cc2)C(=O)O

STK641141
Synonyms: 7- [4- (benzyloxy)phenyl]- 2- (methylsulfanyl)- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine- 5- carboxylicacid
Smiles: CSc1[nH]c2=NC(=CC(n2n1)c1ccc(cc1)OCc1ccccc1)C(=O)O

STK641142
Synonyms: (5- chloro- 1H- indol- 3- yl){4- [5- (trifluoromethyl)pyridin- 2- yl]piperazin- 1- yl}aceticacid
Smiles: Clc1ccc2c(c1)c(c[nH]2)C(N1CCN(CC1)c1ccc(cn1)C(F)(F)F)C(=O)O

STK641143
Synonyms: (5- methyl- 1H- indol- 3- yl){4- [2- oxo- 2- (pyrrolidin- 1- yl)ethyl]piperazin- 1- yl}aceticacid
Smiles: OC(=O)C(c1c[nH]c2c1cc(C)cc2)N1CCN(CC1)CC(=O)N1CCCC1

STK641145
Synonyms: tert- butyl{[trans- 4- (1H- indol- 6- ylcarbamoyl)cyclohexyl]methyl}carbamate
Smiles: O=C(OC(C)(C)C)NC[C@@H]1CC[C@H](CC1)C(=O)Nc1ccc2c(c1)[nH]cc2

STK641148
Synonyms: N- {(2E)- 3- cyano- 10- methyl- 5- oxo- 1- [3- (propan- 2- yloxy)propyl]- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidin- 2- ylidene}- 3- methoxybenzamide
Smiles: N#Cc1cc2c(n(/c/1=N/C(=O)c1cccc(c1)OC)CCCOC(C)C)nc1n(c2=O)cccc1C

STK641150
Synonyms: methyl(2E)- [(2E)- 2- {2- [(2- chlorophenyl)carbonyl]hydrazinylidene}- 4- hydroxy- 1,3- thiazol- 5(2H)- ylidene]ethanoate
Smiles: COC(=O)/C=C\1/S/C(=N/NC(=O)c2ccccc2Cl)/N=C1O

STK641156
Synonyms: 4- (1,3- benzothiazol- 2- yl)- 5- imino- 1- propyl- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: CCCN1CC(=C(C1=N)c1nc2c(s1)cccc2)O

STK641158
Synonyms: N- cyclopropyl- 2- {[(4- hydroxy- 6,7- dimethoxyquinazolin- 2- yl)methyl]sulfanyl}acetamide
Smiles: COc1cc2nc(CSCC(=O)NC3CC3)nc(c2cc1OC)O

STK641159
Synonyms: methyl4- chloro- 2- ({[5- fluoro- 2- (1H- tetrazol- 1- yl)phenyl]carbonyl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1NC(=O)c1cc(F)ccc1n1cnnn1)Cl

STK641164
Synonyms: 3- (1H- indol- 6- yl)- N- (2- methoxyethyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: COCCNC(=O)c1onc(n1)c1ccc2c(c1)[nH]cc2

STK641165
Synonyms: 2- phenoxy- N- [1- (pyridin- 3- ylcarbonyl)- 2,3- dihydro- 1H- indol- 6- yl]acetamide
Smiles: O=C(Nc1ccc2c(c1)N(CC2)C(=O)c1cccnc1)COc1ccccc1

STK641167
Synonyms: methyl2- (7,8- dimethoxy- 2- oxo- 2H- chromen- 4- yl)- 3- (2- fluorophenyl)propanoate
Smiles: COC(=O)C(c1cc(=O)oc2c1ccc(c2OC)OC)Cc1ccccc1F

STK641173
Synonyms: 3- bromo- N- (1- ethyl- 2- {[(4- methylpyrimidin- 2- yl)sulfanyl]methyl}- 1H- benzimidazol- 5- yl)benzamide
Smiles: CCn1c(CSc2nccc(n2)C)nc2c1ccc(c2)NC(=O)c1cccc(c1)Br

STK641174
Synonyms: 7- (4- acetylpiperazin- 1- yl)- 1- cyclopropyl- N- [(2Z)- 4,5- dimethyl- 1,3- thiazol- 2(3H)- ylidene]- 6- fluoro- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CC(=O)N1CCN(CC1)c1cc2n(cc(c(=O)c2cc1F)C(=O)/N=c\1/[nH]c(c(s1)C)C)C1CC1

STK641175
Synonyms: N- [(2Z)- 1,3- benzothiazol- 2(3H)- ylidene]- 5- bromo- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: Brc1ccc(c(c1)C(=O)/N=c/1\sc2c([nH]1)cccc2)n1cnnn1

STK641176
Synonyms: 2- (6- bromo- 1H- indol- 1- yl)- N- (4- sulfamoylbenzyl)acetamide
Smiles: O=C(Cn1ccc2c1cc(Br)cc2)NCc1ccc(cc1)S(=O)(=O)N

STK641180
Synonyms: {4- [(4- ethoxyphenyl)sulfonyl]piperazin- 1- yl}(1H- indol- 3- yl)aceticacid
Smiles: CCOc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(c1c[nH]c2c1cccc2)C(=O)O

STK641182
Synonyms: N- (4- hydroxyphenyl)- 2- (2- phenyl- 1H- indol- 1- yl)acetamide
Smiles: O=C(Cn1c(cc2c1cccc2)c1ccccc1)Nc1ccc(cc1)O

STK641183
Synonyms: 1- (4- methoxyphenyl)- 4- {3- [3- (trifluoromethyl)phenyl]- 1,2,4- oxadiazol- 5- yl}pyrrolidin- 2- one
Smiles: COc1ccc(cc1)N1CC(CC1=O)c1onc(n1)c1cccc(c1)C(F)(F)F

STK641184
Synonyms: N- (2- methoxyphenyl)- 4,5- dimethyl- 2- phenylthieno[2,3- d]pyrimidine- 6- carboxamide
Smiles: COc1ccccc1NC(=O)c1sc2c(c1C)c(C)nc(n2)c1ccccc1

STK641191
Synonyms: (2E)- N- [(2Z)- 5- {[2- oxo- 2- (pyrrolidin- 1- yl)ethyl]sulfanyl}- 1,3,4- thiadiazol- 2(3H)- ylidene]- 3- phenylprop- 2- enamide
Smiles: O=C(/N=c\1/[nH]nc(s1)SCC(=O)N1CCCC1)/C=C/c1ccccc1

STK641192
Synonyms: 2- [(2- hydroxy- 4,5- dihydro- 3H- 1- benzazepin- 3- yl)sulfanyl]- N- (prop- 2- en- 1- yl)acetamide
Smiles: C=CCNC(=O)CSC1CCc2c(N=C1O)cccc2

STK641196
Synonyms: N- [2- hydroxy- 1- methyl- 5- oxo- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]thiophene- 2- carboxamide
Smiles: OC1=NC(C(=O)N1C)(NC(=O)c1cccs1)C(F)(F)F

STK857834
Synonyms: N'- [(E)- (5- chloro- 3- methyl- 1- phenyl- 1H- pyrazol- 4- yl)methylidene]- 3- [(3,5- dihydroxy- 1,2,4- triazin- 6- yl)amino]propanehydrazide(non- preferredname)
Smiles: O=C(N/N=C/c1c(C)nn(c1Cl)c1ccccc1)CCNc1nnc(nc1O)O

STK641199
Synonyms: trans- N- (1H- indol- 6- yl)- 4- ({[(4- methylphenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide
Smiles: Cc1ccc(cc1)S(=O)(=O)NC[C@@H]1CC[C@H](CC1)C(=O)Nc1ccc2c(c1)[nH]cc2

STK641201
Synonyms: 4- (2- chlorophenyl)- 5- hydroxy- 8- methyl- 4,8- dihydropyrimido[4,5- d]pyrimidine- 2,7(1H,3H)- dione
Smiles: O=C1NC(c2ccccc2Cl)c2c(N1)n(C)c(=O)nc2O

STK641203
Synonyms: N- [2- (4- hydroxyphenyl)ethyl]- 2- {(2E)- 2- [(methylsulfonyl)imino]- 2,3- dihydro- 1,3- thiazol- 4- yl}acetamide
Smiles: O=C(Cc1cs/c(=N/S(=O)(=O)C)/[nH]1)NCCc1ccc(cc1)O

STK641210
Synonyms: {[(4- hydroxy- 6,7- dimethoxyquinazolin- 2- yl)methyl]sulfanyl}aceticacid
Smiles: COc1cc2nc(CSCC(=O)O)nc(c2cc1OC)O

STK641211
Synonyms: N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 2- [(2- hydroxy- 4,5- dihydro- 3H- 1- benzazepin- 3- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CSC1CCc2c(N=C1O)cccc2

STK641212
Synonyms: N- [2- (5- chloro- 1H- indol- 3- yl)ethyl]- 2,4- dimethyl- 1,3- thiazole- 5- carboxamide
Smiles: Clc1ccc2c(c1)c(CCNC(=O)c1sc(nc1C)C)c[nH]2

STK641213
Synonyms: 1- [3- (propan- 2- yl)[1,2,4]triazolo[4,3- b]pyridazin- 6- yl]- N- (pyridin- 3- ylmethyl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ccc2n(n1)c(nn2)C(C)C)NCc1cccnc1

STK641214
Synonyms: N- [5- (acetylamino)- 2- methoxyphenyl]- 5- bromo- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: COc1ccc(cc1NC(=O)c1cc(Br)ccc1n1cnnn1)NC(=O)C

STK641217
Synonyms: 6- (5- chloro- 2- methoxyphenyl)- 3- cyclopropyl[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1ccc(cc1c1nn2c(s1)nnc2C1CC1)Cl

STK641220
Synonyms: 8- (3- chlorophenyl)- 6- (prop- 2- en- 1- ylsulfanyl)- 2,3,4,8- tetrahydropyrazolo[4,3- e]pyrimido[1,2- c]pyrimidine
Smiles: C=CCSc1nc2n(ncc2c2=NCCCn12)c1cccc(c1)Cl

STK641221
Synonyms: N- [4- (4,5- dihydro- 1H- [1,4]diazepino[1,2- a]benzimidazol- 2(3H)- yl)phenyl]- 3- phenylpropanamide
Smiles: O=C(Nc1ccc(cc1)N1CCCn2c(C1)nc1c2cccc1)CCc1ccccc1

STK641222
Synonyms: N- {3- [(4- fluorophenyl)sulfonyl]propanoyl}- beta- alanine
Smiles: O=C(CCS(=O)(=O)c1ccc(cc1)F)NCCC(=O)O

STK641223
Synonyms: 3- {[5- (4- fluorophenyl)furan- 2- yl]methyl}- 2- (2- hydroxyethyl)- 3,4- dihydro- 2H- 1,2- benzothiazin- 4- ol1,1- dioxide
Smiles: OCCN1C(Cc2ccc(o2)c2ccc(cc2)F)C(O)c2c(S1(=O)=O)cccc2

STK641224
Synonyms: 4,6- dimethoxy- N- {(2S)- 1- [(3- methoxyphenyl)amino]- 1- oxopropan- 2- yl}- 1- methyl- 1H- indole- 2- carboxamide
Smiles: COc1cccc(c1)NC(=O)[C@@H](NC(=O)c1cc2c(n1C)cc(cc2OC)OC)C

STK641228
Synonyms: N- (3- chlorophenyl)- 2- [(2- hydroxy- 4,5- dihydro- 3H- 1- benzazepin- 3- yl)sulfanyl]acetamide
Smiles: O=C(Nc1cccc(c1)Cl)CSC1CCc2c(N=C1O)cccc2

STK641229
Synonyms: 3- (2- fluorophenyl)- 9- (2- methylpropyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: CC(CN1COc2c(C1)c1occ(c(=O)c1cc2)c1ccccc1F)C

STK857835
Synonyms: 4- [(7- methoxy- 2- methyl- 4- oxo- 4H- chromen- 3- yl)oxy]- N- (pyridin- 3- yl)benzamide
Smiles: COc1ccc2c(c1)oc(c(c2=O)Oc1ccc(cc1)C(=O)Nc1cccnc1)C

STK641230
Synonyms: tert- butyl{4- [(3- oxopiperazin- 1- yl)carbonyl]benzyl}carbamate
Smiles: O=C1NCCN(C1)C(=O)c1ccc(cc1)CNC(=O)OC(C)(C)C

STK641234
Synonyms: 4- (furan- 2- ylmethyl)- 5- (3- methylthiophen- 2- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1ccsc1c1n[nH]c(=S)n1Cc1ccco1

STK641235
Synonyms: 9- benzyl- 5- {[2- (3,4- dimethoxyphenyl)ethyl]amino}- 7,8,9,10- tetrahydro[1,2,4]triazolo[3,4- a][2,7]naphthyridine- 6- carbonitrile
Smiles: N#Cc1c(NCCc2ccc(c(c2)OC)OC)n2cnnc2c2c1CCN(C2)Cc1ccccc1

STK641238
Synonyms: tert- butyl(4- {[2- (5- fluoro- 1H- indol- 3- yl)ethyl]carbamoyl}benzyl)carbamate
Smiles: O=C(OC(C)(C)C)NCc1ccc(cc1)C(=O)NCCc1c[nH]c2c1cc(F)cc2

STK641239
Synonyms: methyl2- ({4- [4- (methylsulfonyl)piperazin- 1- yl]- 4- oxobutanoyl}amino)benzoate
Smiles: COC(=O)c1ccccc1NC(=O)CCC(=O)N1CCN(CC1)S(=O)(=O)C

STK641241
Synonyms: N- [1- (1H- indol- 3- yl)propan- 2- yl]- 2- {(2E)- 2- [(methylsulfonyl)imino]- 2,3- dihydro- 1,3- thiazol- 4- yl}acetamide
Smiles: CC(Cc1c[nH]c2c1cccc2)NC(=O)Cc1cs/c(=N/S(=O)(=O)C)/[nH]1

STK641242
Synonyms: 9- methyl- 5- [(pyridin- 3- ylmethyl)amino]- 7,8,9,10- tetrahydro[1,2,4]triazolo[3,4- a][2,7]naphthyridine- 6- carbonitrile
Smiles: N#Cc1c(NCc2cccnc2)n2cnnc2c2c1CCN(C2)C

STK641244
Synonyms: N- {2- [1- propanoyl- 5- (quinoxalin- 6- yl)- 4,5- dihydro- 1H- pyrazol- 3- yl]phenyl}methanesulfonamide
Smiles: CCC(=O)N1N=C(CC1c1ccc2c(c1)nccn2)c1ccccc1NS(=O)(=O)C

STK641247
Synonyms: 4- [3- (3- methylthiophen- 2- yl)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]benzenesulfonamide
Smiles: Cc1ccsc1c1n[nH]c(=S)n1c1ccc(cc1)S(=O)(=O)N

STK641248
Synonyms: 4- ({[(4- methoxyphenyl)sulfonyl]amino}methyl)- N- (5- methyl- 1,3- thiazol- 2- yl)benzamide
Smiles: COc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)C(=O)Nc1ncc(s1)C

STK641249
Synonyms: methyl{[4- cyano- 1- (2- methylpropyl)- 5,6,7,8- tetrahydroisoquinolin- 3- yl]oxy}acetate
Smiles: COC(=O)COc1nc(CC(C)C)c2c(c1C#N)CCCC2

STK641251
Synonyms: (2- methyl- 1H- indol- 3- yl)(thiomorpholin- 4- yl)aceticacid
Smiles: OC(=O)C(c1c(C)[nH]c2c1cccc2)N1CCSCC1

STK641252
Synonyms: 2- methoxy- N- {(1Z)- 1- (1- methyl- 1H- indol- 3- yl)- 3- oxo- 3- [(pyridin- 3- ylmethyl)amino]prop- 1- en- 2- yl}benzamide
Smiles: COc1ccccc1C(=O)N/C(=C\c1cn(c2c1cccc2)C)/C(=O)NCc1cccnc1

STK641253
Synonyms: 1- {[1- (2- chlorophenyl)- 6,7- dimethoxy- 1,4- dihydroindeno[1,2- c]pyrazol- 3- yl]carbonyl}piperidine- 4- carboxamide
Smiles: COc1cc2c(cc1OC)Cc1c2n(nc1C(=O)N1CCC(CC1)C(=O)N)c1ccccc1Cl

STK641255
Synonyms: N- [(2S)- 1- hydroxy- 3- phenylpropan- 2- yl]- 3- (1H- indol- 6- yl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: OC[C@@H](NC(=O)c1onc(n1)c1ccc2c(c1)[nH]cc2)Cc1ccccc1

STK641256
Synonyms: 2- (2- fluoro- 6- methoxyphenyl)- 4- methyl- N- [(2Z)- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]- 1,3- thiazole- 5- carboxamide
Smiles: COc1cccc(c1c1sc(c(n1)C)C(=O)/N=c/1\scc([nH]1)C)F

STK641258
Synonyms: N- [(2E)- 4,5- dimethyl- 1,3- thiazol- 2(3H)- ylidene]- 6- fluoro- 4- hydroxyquinoline- 3- carboxamide
Smiles: Fc1ccc2c(c1)c(O)c(cn2)C(=O)/N=c/1\[nH]c(c(s1)C)C

STK641260
Synonyms: (4aR,7aS)- 4- (4- fluorobenzyl)- 1- [4- (propan- 2- yl)phenyl]hexahydrothieno[3,4- b]pyrazin- 2(1H)- one6,6- dioxide
Smiles: Fc1ccc(cc1)CN1CC(=O)N([C@H]2[C@@H]1CS(=O)(=O)C2)c1ccc(cc1)C(C)C

STK641263
Synonyms: 2- [(4,5- dimethyl- 1,3- oxazol- 2- yl)sulfanyl]- N- [(2E)- 5- (methylsulfanyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]acetamide
Smiles: CSc1n[nH]/c(=N\C(=O)CSc2oc(c(n2)C)C)/s1

STK641270
Synonyms: 6- {(2E)- 2- [4- (dimethylamino)benzylidene]- 1- methylhydrazinyl}- 2- hydroxy- 3- methylpyrimidin- 4(3H)- one
Smiles: CN(c1cc(=O)n(c(n1)O)C)/N=C/c1ccc(cc1)N(C)C

STK641271
Synonyms: N- [(2Z)- 3- [(3- chlorophenyl)amino]quinoxalin- 2(1H)- ylidene]- 4- methylbenzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1cccc(c1)Cl

STK641272
Synonyms: 4- (3- hydroxyphenyl)- 2,6- dihydro- 4H- pyrazolo[3,4- e][1,4]thiazepin- 7- ol
Smiles: Oc1cccc(c1)C1SCC(=Nc2c1c[nH]n2)O

STK641274
Synonyms: 2- ethyl- 3- (4- methoxyphenyl)pyrazolo[1,5- a]pyrido[3,4- e]pyrimidin- 6- ol
Smiles: CCc1nn2c(c1c1ccc(cc1)OC)ncc1c2ccnc1O

STK641276
Synonyms: N- {1- [2- (4- fluorophenyl)ethyl]- 2- hydroxy- 5- oxo- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl}furan- 2- carboxamide
Smiles: Fc1ccc(cc1)CCN1C(=NC(C1=O)(NC(=O)c1ccco1)C(F)(F)F)O

STK641277
Synonyms: N- [3- (5,7- dimethyl[1,2,4]triazolo[4,3- a]pyrimidin- 3- yl)propyl]- 4- fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)NCCCc1nnc2n1c(C)cc(n2)C

STK641279
Synonyms: 4- (1,3- benzothiazol- 2(3H)- ylideneamino)- 2- methyl- 5- oxo- 4- (trifluoromethyl)- 4,5- dihydro- 1H- pyrrole- 3- carbonitrile
Smiles: N#CC1=C(C)NC(=O)C1(/N=c/1\sc2c([nH]1)cccc2)C(F)(F)F

STK641282
Synonyms: 3- [(2E)- 2- (4- hydroxybenzylidene)hydrazinyl]- 1,2,4- triazin- 5- ol
Smiles: Oc1ccc(cc1)/C=N/Nc1nncc(n1)O

STK641289
Synonyms: 1- (4- hydroxy- 5,6- dimethylpyrimidin- 2- yl)- 3- (2- methoxyphenyl)guanidine
Smiles: COc1ccccc1NC(=N)Nc1nc(C)c(c(n1)O)C

STK641290
Synonyms: N- (2- {[1- (methylsulfonyl)- 2,3- dihydro- 1H- indol- 5- yl]amino}- 2- oxoethyl)benzamide
Smiles: O=C(Nc1ccc2c(c1)CCN2S(=O)(=O)C)CNC(=O)c1ccccc1

STK641292
Synonyms: 1- benzyl- 4- {[4- (thiophen- 2- ylcarbonyl)piperazin- 1- yl]carbonyl}pyrrolidin- 2- one
Smiles: O=C(C1CC(=O)N(C1)Cc1ccccc1)N1CCN(CC1)C(=O)c1cccs1

STK641295
Synonyms: 5- {4- [(4- fluorophenyl)sulfonyl]piperazin- 1- yl}- 5- oxo- N- (1,3- thiazol- 2- yl)pentanamide
Smiles: O=C(Nc1nccs1)CCCC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)F

STK641297
Synonyms: 2- (2,1,3- benzothiadiazol- 4- ylsulfonyl)- 6- bromo- 2,3,4,5- tetrahydro- 1H- pyrido[4,3- b]indole
Smiles: Brc1cccc2c1[nH]c1c2CN(CC1)S(=O)(=O)c1cccc2c1nsn2

STK641298
Synonyms: N- cyclohexyl- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: O=C(c1ccccc1n1cnnn1)NC1CCCCC1

STK641300
Synonyms: 4- fluoro- N- [2- (4- fluorophenyl)ethyl]- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: Fc1ccc(cc1)CCNC(=O)c1ccc(cc1n1cnnn1)F

STK641301
Synonyms: N- [1- (pyridin- 3- ylcarbonyl)- 1,2,3,4- tetrahydroquinolin- 6- yl]acetamide
Smiles: CC(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccnc1

STK641302
Synonyms: N- (2,4- dihydroxypyrimidin- 5- yl)- N'- [2- (4- hydroxyphenyl)ethyl]ethanediamide
Smiles: Oc1ccc(cc1)CCNC(=O)C(=O)Nc1cnc(nc1O)O

STK641303
Synonyms: (6- fluoro- 1H- indol- 3- yl)(morpholin- 4- yl)aceticacid
Smiles: OC(=O)C(c1c[nH]c2c1ccc(c2)F)N1CCOCC1

STK641304
Synonyms: 2- [3- (3,4- dimethoxyphenyl)- 1,2,4- oxadiazol- 5- yl]pyrazine
Smiles: COc1cc(ccc1OC)c1noc(n1)c1cnccn1

STK641305
Synonyms: (5Z)- 5- (4- ethoxybenzylidene)- 2- imino- 2,5- dihydro- 1,3- thiazol- 4- ol
Smiles: CCOc1ccc(cc1)/C=C/1\SC(=N)N=C1O

STK641306
Synonyms: N- [4- (4,5- dihydro- 1H- [1,4]diazepino[1,2- a]benzimidazol- 2(3H)- yl)phenyl]cyclohexanecarboxamide
Smiles: O=C(C1CCCCC1)Nc1ccc(cc1)N1CCCn2c(C1)nc1c2cccc1

STK641308
Synonyms: N- (1H- indol- 6- yl)- 1- (phenylsulfonyl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)S(=O)(=O)c1ccccc1)Nc1ccc2c(c1)[nH]cc2

STK641309
Synonyms: N- (2- {[(4- fluorophenyl)carbonyl]amino}ethyl)- 1- methyl- 1H- indole- 2- carboxamide
Smiles: Fc1ccc(cc1)C(=O)NCCNC(=O)c1cc2c(n1C)cccc2

STK641310
Synonyms: 5,7- diethyl- 6- hydroxy- 2- methyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decane- 2- carboxylicacid
Smiles: CCC12CN3CC(C2O)(CN(C1)C3(C)C(=O)O)CC

STK641311
Synonyms: N- [3- (5- amino- 1- methyl- 1H- benzimidazol- 2- yl)propyl]- 3- chloro- 4- fluorobenzamide
Smiles: Nc1ccc2c(c1)nc(n2C)CCCNC(=O)c1ccc(c(c1)Cl)F

STK641312
Synonyms: 5- fluoro- N- (tetrahydrofuran- 2- ylmethyl)- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: Fc1ccc(c(c1)C(=O)NCC1CCCO1)n1cnnn1

STK641314
Synonyms: 3- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl]- 6- [(naphthalen- 1- yloxy)methyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(Cc1[nH]nc(c1)c1nnc2n1nc(s2)COc1cccc2c1cccc2)C

STK857838
Synonyms: N- (4- oxo- 2- phenyl- 4H- chromen- 6- yl)furan- 2- carboxamide
Smiles: O=C(c1ccco1)Nc1ccc2c(c1)c(=O)cc(o2)c1ccccc1

STK641316
Synonyms: methylN- ({[(4- hydroxy- 6,7- dimethoxyquinazolin- 2- yl)methyl]sulfanyl}acetyl)glycinate
Smiles: COC(=O)CNC(=O)CSCc1nc(O)c2c(n1)cc(c(c2)OC)OC

STK641319
Synonyms: 8- methyl- 2- (piperidin- 1- yl)- 4- (pyridin- 2- yl)- 4,9- dihydro- 6H- pyrimido[1,2- a][1,3,5]triazin- 6- one
Smiles: Cc1cc(=O)n2c(=NC(=NC2c2ccccn2)N2CCCCC2)[nH]1

STK641321
Synonyms: N- [(2Z)- 4- [2- (2,6- dimethylmorpholin- 4- yl)- 2- oxoethyl]- 1,3- thiazol- 2(3H)- ylidene]methanesulfonamide
Smiles: CC1OC(C)CN(C1)C(=O)Cc1cs/c(=N\S(=O)(=O)C)/[nH]1

STK641323
Synonyms: 1- [4- (2- fluorophenyl)piperazin- 1- yl]- 3- (7- hydroxy- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 6- yl)propan- 1- one
Smiles: O=C(N1CCN(CC1)c1ccccc1F)CCc1c(C)nc2n(c1O)ncn2

STK641324
Synonyms: 1- [4- (2,1,3- benzoxadiazol- 4- ylsulfonyl)piperazin- 1- yl]- 2- phenoxyethanone
Smiles: O=C(N1CCN(CC1)S(=O)(=O)c1cccc2c1non2)COc1ccccc1

STK641325
Synonyms: 3- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl]- 6- (pyridin- 4- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(Cc1[nH]nc(c1)c1nnc2n1nc(s2)c1ccncc1)C

STK641327
Synonyms: N- [2- (2- chlorophenyl)- 4- oxo- 4H- chromen- 6- yl]- 2- methoxyacetamide
Smiles: COCC(=O)Nc1ccc2c(c1)c(=O)cc(o2)c1ccccc1Cl

STK641330
Synonyms: 1- (2,1,3- benzothiadiazol- 4- ylsulfonyl)- N- phenylpiperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)S(=O)(=O)c1cccc2c1nsn2)Nc1ccccc1

STK641331
Synonyms: (5- chloro- 1H- indol- 3- yl)(4- ethylpiperazin- 1- yl)aceticacid
Smiles: CCN1CCN(CC1)C(c1c[nH]c2c1cc(Cl)cc2)C(=O)O

STK641334
Synonyms: 4- (2,6- dimethoxyphenoxy)- 6- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 2- methylpyrimidine
Smiles: COc1cccc(c1Oc1nc(C)nc(c1)n1nc(cc1C)C)OC

STK641335
Synonyms: 2- [6- (2- chlorophenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 3- yl]quinoline
Smiles: Clc1ccccc1c1sc2n(n1)c(nn2)c1ccc2c(n1)cccc2

STK641336
Synonyms: 6- (butylsulfanyl)- 8- (3- methylphenyl)- 2,3,4,8- tetrahydropyrazolo[4,3- e]pyrimido[1,2- c]pyrimidine
Smiles: CCCCSc1nc2n(ncc2c2=NCCCn12)c1cccc(c1)C

STK641338
Synonyms: N- [(2Z)- 5- methyl- 4- {[4- (pyridin- 2- yl)piperazin- 1- yl]carbonyl}- 1,3- thiazol- 2(3H)- ylidene]benzenesulfonamide
Smiles: Cc1s/c(=N\S(=O)(=O)c2ccccc2)/[nH]c1C(=O)N1CCN(CC1)c1ccccn1

STK641340
Synonyms: 1- [4- (4- chlorophenyl)- 4- hydroxypiperidin- 1- yl]- 2- [2- (2- fluorophenyl)- 1,3- thiazol- 5- yl]ethanone
Smiles: Clc1ccc(cc1)C1(O)CCN(CC1)C(=O)Cc1cnc(s1)c1ccccc1F

STK641343
Synonyms: N- (2- chlorophenyl)- 3- [(2- hydroxy- 4,5- dihydro- 3H- 1- benzazepin- 3- yl)sulfanyl]propanamide
Smiles: O=C(Nc1ccccc1Cl)CCSC1CCc2c(N=C1O)cccc2

STK641344
Synonyms: N- [(4- hydroxy- 1- phenyl- 1H- pyrazolo[3,4- d]pyrimidin- 6- yl)methyl]pyridine- 3- carboxamide
Smiles: O=C(c1cccnc1)NCc1nc(O)c2c(n1)n(nc2)c1ccccc1

STK857839
Synonyms: N- (6- bromo- 2- methylquinolin- 4- yl)- 3- (pyrrolidin- 1- ylsulfonyl)benzamide
Smiles: Brc1ccc2c(c1)c(cc(n2)C)NC(=O)c1cccc(c1)S(=O)(=O)N1CCCC1

STK641346
Synonyms: N- cyclopentyl- 3- (1H- indol- 4- yl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)c1cccc2c1cc[nH]2)NC1CCCC1

STK641349
Synonyms: 4- chloro- N- (tetrahydrofuran- 2- ylmethyl)- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: Clc1ccc(c(c1)n1cnnn1)C(=O)NCC1CCCO1

STK641352
Synonyms: N- [(1- ethylpyrrolidin- 2- yl)methyl]- 2- (4- fluorophenyl)- 4- methyl- 1,3- thiazole- 5- carboxamide
Smiles: CCN1CCCC1CNC(=O)c1sc(nc1C)c1ccc(cc1)F

STK641354
Synonyms: N- [3- (acetylamino)phenyl]- 2- (1,3- dioxo- 1,3- dihydro- 2H- pyrrolo[3,4- c]pyridin- 2- yl)acetamide
Smiles: CC(=O)Nc1cccc(c1)NC(=O)CN1C(=O)c2c(C1=O)cncc2

STK641355
Synonyms: 5- [(2E)- 2- (2- chlorobenzylidene)hydrazinyl]- 6- methyl- 1,2,4- triazin- 3- ol
Smiles: Oc1nnc(c(n1)N/N=C/c1ccccc1Cl)C

STK641356
Synonyms: 1H- indol- 3- yl{4- [2- (pyridin- 2- yl)ethyl]piperazin- 1- yl}aceticacid
Smiles: OC(=O)C(c1c[nH]c2c1cccc2)N1CCN(CC1)CCc1ccccn1

STK641357
Synonyms: (5- methoxy- 1H- indol- 3- yl)[(2- methylpropyl)amino]aceticacid
Smiles: COc1ccc2c(c1)c(c[nH]2)C(C(=O)O)NCC(C)C

STK641358
Synonyms: (3S,4R)- 4- [(4- ethylphenyl)sulfonyl]- N- methyl- N- [2- (pyridin- 4- yl)ethyl]tetrahydrothiophen- 3- amine1,1- dioxide
Smiles: CCc1ccc(cc1)S(=O)(=O)[C@H]1CS(=O)(=O)C[C@@H]1N(CCc1ccncc1)C

STK641361
Synonyms: 2- [2- (2,6- dichlorophenyl)- 1,3- thiazol- 5- yl]- 1- [4- (pyridin- 2- yl)piperazin- 1- yl]ethanone
Smiles: O=C(N1CCN(CC1)c1ccccn1)Cc1cnc(s1)c1c(Cl)cccc1Cl

STK641362
Synonyms: 4- fluoro- N- (prop- 2- en- 1- yl)- 2- (1H- tetrazol- 1- yl)benzamide
Smiles: C=CCNC(=O)c1ccc(cc1n1cnnn1)F

STK641363
Synonyms: methyl2- benzyl- 4,5- dimethylthieno[2,3- d]pyrimidine- 6- carboxylate
Smiles: COC(=O)c1sc2c(c1C)c(C)nc(n2)Cc1ccccc1

STK641366
Synonyms: 3,3- dimethyl- 6- [2- (morpholin- 4- yl)- 2- oxoethoxy]- 8- phenyl- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: N#Cc1c(OCC(=O)N2CCOCC2)nc(c2c1CC(C)(C)OC2)c1ccccc1

STK641367
Synonyms: 1- [4- (methylsulfonyl)piperazin- 1- yl]- 4- (4- phenylpiperazin- 1- yl)butane- 1,4- dione
Smiles: O=C(N1CCN(CC1)c1ccccc1)CCC(=O)N1CCN(CC1)S(=O)(=O)C

STK857841
Synonyms: methyl5- methyl- 2- ({[2- (morpholin- 4- yl)- 4- oxo- 4,5- dihydro- 1,3- thiazol- 5- yl]acetyl}amino)thiophene- 3- carboxylate
Smiles: COC(=O)c1cc(sc1NC(=O)CC1SC(=NC1=O)N1CCOCC1)C

STK641368
Synonyms: 3- {3- oxo- 3- [3- ([1,2,4]triazolo[4,3- a]pyridin- 3- yl)piperidin- 1- yl]propyl}quinazolin- 4(3H)- one
Smiles: O=C(N1CCCC(C1)c1nnc2n1cccc2)CCn1cnc2c(c1=O)cccc2

STK641369
Synonyms: 1- (diphenylacetyl)- N- (2- methoxyethyl)piperidine- 4- carboxamide
Smiles: COCCNC(=O)C1CCN(CC1)C(=O)C(c1ccccc1)c1ccccc1

STK641379
Synonyms: N- [(1- ethyl- 3,5- dimethyl- 1H- pyrazol- 4- yl)methyl]- 3- (pyridin- 3- yl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: CCn1nc(c(c1C)CNC(=O)c1onc(n1)c1cccnc1)C

STK641382
Synonyms: methyl2- {[(3- phenyl- 5,6- dihydro- 1,4- oxathiin- 2- yl)carbonyl]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COC(=O)c1c(NC(=O)C2=C(SCCO2)c2ccccc2)sc2c1CCCC2

STK641385
Synonyms: 9- methyl- 5- [(tetrahydrofuran- 2- ylmethyl)amino]- 7,8,9,10- tetrahydro[1,2,4]triazolo[3,4- a][2,7]naphthyridine- 6- carbonitrile
Smiles: N#Cc1c(NCC2CCCO2)n2cnnc2c2c1CCN(C2)C

STK641388
Synonyms: N- cyclopropyl- 4- (pyridin- 4- ylmethyl)piperazine- 1- carbothioamide
Smiles: S=C(N1CCN(CC1)Cc1ccncc1)NC1CC1

STK641391
Synonyms: 8- {2- [4- (3- chlorobenzyl)piperazin- 1- yl]ethyl}- 4- hydroxy- 1,6,7- trimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Clc1cccc(c1)CN1CCN(CC1)CCn1c2nc3c(n2c(c1C)C)c(O)nc(=O)n3C

STK641392
Synonyms: 7- (4- acetylpiperazin- 1- yl)- 1- ethyl- 6- fluoro- 4- oxo- N- (pyridin- 2- ylmethyl)- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)NCc2ccccn2)c(=O)c2c1cc(N1CCN(CC1)C(=O)C)c(c2)F

STK641395
Synonyms: 3- [({[2- (3- methoxyphenyl)- 1,3- thiazol- 4- yl]acetyl}amino)methyl]benzoicacid
Smiles: COc1cccc(c1)c1scc(n1)CC(=O)NCc1cccc(c1)C(=O)O

STK641396
Synonyms: (4E)- 1- [2- (dimethylamino)ethyl]- 4- [hydroxy(1- methyl- 1H- indol- 3- yl)methylidene]- 5- (pyridin- 3- yl)pyrrolidine- 2,3- dione
Smiles: CN(CCN1C(c2cccnc2)/C(=C(/c2cn(c3c2cccc3)C)\O)/C(=O)C1=O)C

STK641397
Synonyms: [4- (2- cyanoethyl)piperazin- 1- yl](2- methyl- 1H- indol- 3- yl)aceticacid
Smiles: N#CCCN1CCN(CC1)C(c1c(C)[nH]c2c1cccc2)C(=O)O

STK641400
Synonyms: N- [2- (4- methoxyphenyl)ethyl]- 4- methyl- 2- (2- propylpyridin- 4- yl)- 1,3- thiazole- 5- carboxamide
Smiles: CCCc1nccc(c1)c1sc(c(n1)C)C(=O)NCCc1ccc(cc1)OC

STK641403
Synonyms: N- benzyl- 2'- (2- methoxyethyl)- 1'- oxo- 1',4'- dihydro- 2'H- spiro[cyclohexane- 1,3'- isoquinoline]- 4'- carboxamide
Smiles: COCCN1C(=O)c2ccccc2C(C21CCCCC2)C(=O)NCc1ccccc1

STK641408
Synonyms: 3- (2- ethyl- 7- hydroxy- 5- methyl- 3- phenylpyrazolo[1,5- a]pyrimidin- 6- yl)propanoicacid
Smiles: CCc1nn2c(c1c1ccccc1)nc(c(c2O)CCC(=O)O)C

STK641409
Synonyms: 6- (furan- 2- yl)- 3- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(Cc1[nH]nc(c1)c1nnc2n1nc(s2)c1ccco1)C

STK641412
Synonyms: N- benzyl- 2- {[5- cyano- 3,3- dimethyl- 8- (propan- 2- yl)- 3,4- dihydro- 1H- pyrano[3,4- c]pyridin- 6- yl]oxy}acetamide
Smiles: N#Cc1c(OCC(=O)NCc2ccccc2)nc(c2c1CC(C)(C)OC2)C(C)C

STK641414
Synonyms: 7- [2- (3,4- dimethoxyphenyl)ethyl]- 5,6- dimethyl- N- (pyridin- 2- ylmethyl)- 7H- pyrrolo[2,3- d]pyrimidin- 4- amine
Smiles: COc1cc(ccc1OC)CCn1c2ncnc(c2c(c1C)C)NCc1ccccn1

STK641416
Synonyms: 5- [(2E)- 2- (3,5- dibromo- 4- hydroxybenzylidene)hydrazinyl]- 6- methyl- 1,2,4- triazin- 3- ol
Smiles: Oc1nnc(c(n1)N/N=C/c1cc(Br)c(c(c1)Br)O)C

STK641417
Synonyms: N- tert- butyl- 2- chloro- 5- (1,1- dioxido- 1,2- thiazinan- 2- yl)benzamide
Smiles: O=C(c1cc(ccc1Cl)N1CCCCS1(=O)=O)NC(C)(C)C

STK641418
Synonyms: 2'- {[(2Z)- 5- (ethylsulfanyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]carbamoyl}biphenyl- 2- carboxylicacid
Smiles: CCSc1n[nH]/c(=N/C(=O)c2ccccc2c2ccccc2C(=O)O)/s1