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

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BBL033132
Synonyms: (2Z)- 3- (5- amino- 1H- 1,2,4- triazol- 3- yl)prop- 2- enoicacid
Smiles: OC(=O)/C=C\c1n[nH]c(n1)N

BBL033133
Synonyms: 2- (2- methoxyethoxy)- 4- methyl- 1,3- thiazole- 5- carboxylicacid
Smiles: COCCOc1nc(c(s1)C(=O)O)C

BBL033134
Synonyms: (7- hydroxy[1,2,4]triazolo[1,5- a]pyrimidin- 6- yl)aceticacid
Smiles: OC(=O)Cc1cnc2n(c1O)ncn2

BBL033135
Synonyms: 4- amino- N- (pyridin- 4- yl)butanamide
Smiles: NCCCC(=O)Nc1ccncc1

BBL033136
Synonyms: [1- (propan- 2- yl)- 1H- indol- 3- yl]aceticacid
Smiles: OC(=O)Cc1cn(c2c1cccc2)C(C)C

BBL033137
Synonyms: 1- [1- (propan- 2- yl)- 1H- pyrrol- 2- yl]methanamine
Smiles: [NH]Cc1cccn1C(C)C

BBL033138
Synonyms: 3- bromo- 5- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 1- methyl- 1H- 1,2,4- triazole
Smiles: Cc1nn(c(c1)C)c1nc(nn1C)Br

BBL033139
Synonyms: 4- (5,7- dioxo- 5,7- dihydro- 6H- pyrrolo[3,4- b]pyrazin- 6- yl)butanoicacid
Smiles: OC(=O)CCCN1C(=O)c2c(C1=O)nccn2

BBL033140
Synonyms: 6- (5,7- dioxo- 5,7- dihydro- 6H- pyrrolo[3,4- b]pyrazin- 6- yl)hexanoicacid
Smiles: OC(=O)CCCCCN1C(=O)c2c(C1=O)nccn2

BBL033141
Synonyms: [6- oxo- 3- (thiomorpholin- 4- yl)pyridazin- 1(6H)- yl]aceticacid
Smiles: OC(=O)Cn1nc(ccc1=O)N1CCSCC1

BBL033142
Synonyms: 6- chloro- N- [3- (4- methylpiperazin- 1- yl)propyl]pyridazin- 3- amine
Smiles: CN1CCN(CC1)CCCNc1ccc(nn1)Cl

BBL033143
Synonyms: 2- oxo- 6- phenyl- 1,2- dihydropyridine- 4- carboxylicacid
Smiles: OC(=O)c1cc(=O)[nH]c(c1)c1ccccc1

BBL033144
Synonyms: 3- (4,5- dibromo- 2- methyl- 1H- imidazol- 1- yl)propanoicacid
Smiles: OC(=O)CCn1c(C)nc(c1Br)Br

BBL033145
Synonyms: methyl3- tert- butyl- 1- methyl- 1H- pyrazole- 5- carboxylate
Smiles: COC(=O)c1cc(nn1C)C(C)(C)C

BBL033146
Synonyms: methyl3- (5,7- dimethyl- 2- oxo- 3- phenyl- 1,2- dihydropyrazolo[1,5- a]pyrimidin- 6- yl)propanoate
Smiles: COC(=O)CCc1c(C)nc2n(c1C)[nH]c(=O)c2c1ccccc1

BBL033147
Synonyms: methyl4- [3,5- dimethyl- 1- (propan- 2- yl)- 1H- pyrazol- 4- yl]- 2,4- dioxobutanoate
Smiles: COC(=O)C(=O)CC(=O)c1c(C)nn(c1C)C(C)C

BBL033148
Synonyms: 3- (5,7- dioxo- 5,7- dihydro- 6H- pyrrolo[3,4- b]pyrazin- 6- yl)propanoicacid
Smiles: OC(=O)CCN1C(=O)c2c(C1=O)nccn2

BBL033149
Synonyms: methyl2- methyl- 4- (propan- 2- yl)- 1,3- thiazole- 5- carboxylate
Smiles: COC(=O)c1sc(nc1C(C)C)C

BBL033150
Synonyms: 3- (3- hydroxy- 1H- 1,2,4- triazol- 5- yl)propanoicacid
Smiles: OC(=O)CCc1[nH]nc(n1)O

BBL033151
Synonyms: 3- [3- (1H- indol- 4- yl)- 1,2,4- oxadiazol- 5- yl]- 2,2- dimethylcyclopropanecarboxylicacid
Smiles: OC(=O)C1C(C1(C)C)c1onc(n1)c1cccc2c1cc[nH]2

BBL033152
Synonyms: methyl(5- amino- 1H- 1,2,4- triazol- 3- yl)acetate
Smiles: COC(=O)Cc1n[nH]c(n1)N

BBL033153
Synonyms: (4- hydroxy- 2- methylpyrimidin- 5- yl)aceticacid
Smiles: OC(=O)Cc1cnc(nc1O)C

BBL033154
Synonyms: (4- aminotetrahydro- 2H- thiopyran- 4- yl)aceticacid
Smiles: OC(=O)CC1(N)CCSCC1

BBL033155
Synonyms: N- (3- methyl- 1,2- oxazol- 5- yl)- beta- alaninamide
Smiles: Cc1cc(on1)NC(=O)CCN

BBL033156
Synonyms: 4- amino- N- (3- methyl- 1,2- oxazol- 5- yl)butanamide
Smiles: Cc1cc(on1)NC(=O)CCCN

BBL033157
Synonyms: 4- amino- N- [1- (propan- 2- yl)- 1H- pyrazol- 5- yl]butanamide
Smiles: NCCCC(=O)Nc1ccnn1C(C)C

BBL033158
Synonyms: N- {[3- (propan- 2- yl)- 1,2,4- oxadiazol- 5- yl]methyl}glycinamide
Smiles: NCC(=O)NCc1onc(n1)C(C)C

BBL033159
Synonyms: N- [(3- phenyl- 1,2,4- oxadiazol- 5- yl)methyl]glycinamide
Smiles: NCC(=O)NCc1onc(n1)c1ccccc1

BBL033160
Synonyms: N- {[3- (4- methoxyphenyl)- 1,2,4- oxadiazol- 5- yl]methyl}glycinamide
Smiles: NCC(=O)NCc1onc(n1)c1ccc(cc1)OC

BBL033161
Synonyms: N- [(3- benzyl- 1,2,4- oxadiazol- 5- yl)methyl]glycinamide
Smiles: NCC(=O)NCc1onc(n1)Cc1ccccc1

BBL033162
Synonyms: N- {[3- (propan- 2- yl)- 1,2,4- oxadiazol- 5- yl]methyl}- beta- alaninamide
Smiles: NCCC(=O)NCc1onc(n1)C(C)C

BBL033163
Synonyms: N- [(3- phenyl- 1,2,4- oxadiazol- 5- yl)methyl]- beta- alaninamide
Smiles: NCCC(=O)NCc1onc(n1)c1ccccc1

BBL033164
Synonyms: N- {2- [3- (propan- 2- yl)- 1,2,4- oxadiazol- 5- yl]ethyl}glycinamide
Smiles: NCC(=O)NCCc1onc(n1)C(C)C

BBL033165
Synonyms: N- [2- (3- phenyl- 1,2,4- oxadiazol- 5- yl)ethyl]glycinamide
Smiles: NCC(=O)NCCc1onc(n1)c1ccccc1

BBL033166
Synonyms: N- {2- [3- (propan- 2- yl)- 1,2,4- oxadiazol- 5- yl]ethyl}- beta- alaninamide
Smiles: NCCC(=O)NCCc1onc(n1)C(C)C

BBL033167
Synonyms: N- methyl- 1- (octahydro- 2H- quinolizin- 1- yl)methanamine
Smiles: CNCC1CCCN2C1CCCC2

BBL033168
Synonyms: 1- (6- oxo- 1,6- dihydropyridazin- 3- yl)piperidine- 4- carboxylicacid
Smiles: OC(=O)C1CCN(CC1)c1ccc(=O)[nH]n1

BBL033169
Synonyms: 2- methyl- 5- (propan- 2- yl)- 1,3- thiazole- 4- carboxylicacid
Smiles: Cc1sc(c(n1)C(=O)O)C(C)C

BBL033170
Synonyms: 3- (7,8- dimethoxy- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl)propanoicacid
Smiles: COc1cc2CN3C(=O)N(C(=O)C3Cc2cc1OC)CCC(=O)O

BBL033171
Synonyms: 1- [1- (2- aminoethyl)- 1H- indol- 3- yl]ethanone
Smiles: NCCn1cc(c2c1cccc2)C(=O)C

BBL033172
Synonyms: methyl2- methyl- 5- (propan- 2- yl)- 1,3- thiazole- 4- carboxylate
Smiles: COC(=O)c1nc(sc1C(C)C)C

BBL033173
Synonyms: 5- chloro- 3- (methylsulfonyl)- 1H- 1,2,4- triazole
Smiles: Clc1[nH]nc(n1)S(=O)(=O)C

BBL033174
Synonyms: 3- chloro- 5- propyl- 1H- 1,2,4- triazole
Smiles: CCCc1nc(n[nH]1)Cl

BBL033175
Synonyms: 3- chloro- 5- (2- methylphenyl)- 1H- 1,2,4- triazole
Smiles: Clc1n[nH]c(n1)c1ccccc1C

BBL033176
Synonyms: 3- (3- chloro- 1H- 1,2,4- triazol- 1- yl)propanenitrile
Smiles: Clc1nn(cn1)CCC#N

BBL033177
Synonyms: 5- bromo- 3- (methylsulfonyl)- 1H- 1,2,4- triazole
Smiles: Brc1[nH]nc(n1)S(=O)(=O)C

BBL033178
Synonyms: methyl1- (6- oxo- 1,6- dihydropyridazin- 3- yl)piperidine- 4- carboxylate
Smiles: COC(=O)C1CCN(CC1)c1ccc(=O)[nH]n1

BBL033179
Synonyms: 2,2- dimethyl- 3- [3- (pyridin- 4- yl)- 1,2,4- oxadiazol- 5- yl]cyclopropanecarboxylicacid
Smiles: OC(=O)C1C(C1(C)C)c1onc(n1)c1ccncc1

BBL033180
Synonyms: 2- amino- 5- (propan- 2- yl)- 1,3- thiazole- 4- carboxylicacid
Smiles: Nc1sc(c(n1)C(=O)O)C(C)C

BBL033181
Synonyms: [2- (cyanoamino)- 4- hydroxypyrimidin- 5- yl]aceticacid
Smiles: N#CNc1ncc(c(n1)O)CC(=O)O

BBL033182
Synonyms: 5- (3- methylbutyl)- 1H- pyrazole- 3- carboxylicacid
Smiles: CC(CCc1[nH]nc(c1)C(=O)O)C

BBL033183
Synonyms: N- (octahydro- 2H- quinolizin- 1- ylmethyl)ethanamine
Smiles: CCNCC1CCCN2C1CCCC2

BBL033184
Synonyms: 16,17- dimethylpregn- 4- ene- 3,20- dione
Smiles: O=C1CCC2(C(=C1)CCC1C2CCC2(C1CC(C2(C)C(=O)C)C)C)C

BBL033185
Synonyms: 17- hydroxy- 10,13- dimethyl- 1,2,4,7,8,9,10,11,12,13,14,15,16,17- tetradecahydrospiro[cyclopenta[a]phenanthrene- 3,2'- [1,3]dioxolane]- 17- carbonitrile
Smiles: N#CC1(O)CCC2C1(C)CCC1C2CC=C2C1(C)CCC1(C2)OCCO1

BBL033186
Synonyms: 17,21- dihydroxy- 16- methyl- 9,11- epoxypregna- 1,4- diene- 3,20- dione
Smiles: OCC(=O)C1(O)C(C)CC2C1(C)CC1OC31C2CCC1=CC(=O)C=CC31C

BBL033187
Synonyms: 4- hydroxy- 3,7- dimethoxy- 17- methyl- 7,8- didehydromorphinan- 6- one
Smiles: COC1=CC2C3Cc4c(C2(CC1=O)CCN3C)c(O)c(cc4)OC

BBL033188
Synonyms: 3,6,9- trimethyldecahydro- 3,12- epoxy[1,2]dioxepino[4,3- i]isochromen- 10- ol
Smiles: OC1OC2OC3(C)CCC4C2(C(C1C)CCC4C)OO3

BBL033189
Synonyms: 9- [5- (hydroxymethyl)tetrahydrofuran- 2- yl]- 9H- purin- 6- ol
Smiles: OCC1CCC(O1)n1cnc2c1ncnc2O

BBL033190
Synonyms: 3- (6- chloropyridazin- 3- yl)- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: Clc1ccc(nn1)N1CC2CC(C1)c1n(C2)c(=O)ccc1

BBL033191
Synonyms: 6',9- dimethoxycinchonan
Smiles: COC(c1ccnc2c1cc(OC)cc2)C1CC2CCN1CC2C=C

BBL033192
Synonyms: 3,5- dihydroxy- 4- [3- (4- hydroxyphenyl)propanoyl]phenyl2- O- (6- deoxyhexopyranosyl)hexopyranoside
Smiles: OCC1OC(Oc2cc(O)c(c(c2)O)C(=O)CCc2ccc(cc2)O)C(C(C1O)O)OC1OC(C)C(C(C1O)O)O

BBL033193
Synonyms: 1- [3- (trifluoromethoxy)benzyl]piperidin- 4- amine
Smiles: NC1CCN(CC1)Cc1cccc(c1)OC(F)(F)F

BBL033194
Synonyms: 3- chloro- 1- (2- phenylethyl)- 1H- 1,2,4- triazole
Smiles: Clc1ncn(n1)CCc1ccccc1

BBL033195
Synonyms: 3- chloro- 5- methyl- 1- (2- phenylethyl)- 1H- 1,2,4- triazole
Smiles: Clc1nn(c(n1)C)CCc1ccccc1

BBL033196
Synonyms: methyl1',3',5'- trimethyl- 1'H,2H- 3,4'- bipyrazole- 5- carboxylate
Smiles: COC(=O)c1n[nH]c(c1)c1c(C)nn(c1C)C

BBL033197
Synonyms: 4- bromo- 5- (2- methylpropyl)- 1H- pyrazole- 3- carboxylicacid
Smiles: CC(Cc1[nH]nc(c1Br)C(=O)O)C

BBL033198
Synonyms: 6- methyl- 5- (piperazin- 1- ylmethyl)pyrimidine- 2,4(1H,3H)- dione
Smiles: Cc1[nH]c(=O)[nH]c(=O)c1CN1CCNCC1

BBL033199
Synonyms: 6- fluoro- 2,3,4,9- tetrahydro- 1H- carbazol- 1- amine
Smiles: Fc1ccc2c(c1)c1CCCC(c1[nH]2)N

BBL033200
Synonyms: 6- methoxy- 2,3,4,9- tetrahydro- 1H- carbazol- 1- amine
Smiles: COc1ccc2c(c1)c1CCCC(c1[nH]2)N

BBL033201
Synonyms: 2- (1,1- dioxidotetrahydrothiophen- 3- yl)- 2,4,5,6- tetrahydrocyclopenta[c]pyrazol- 3- amine
Smiles: Nc1n(nc2c1CCC2)C1CCS(=O)(=O)C1

BBL033202
Synonyms: 1- methyl- 1,5- dihydro- 6H- [1,2]diazepino[4,5,6- cd]indol- 6- one
Smiles: O=c1[nH]ncc2c3c1cccc3n(c2)C

BBL033203
Synonyms: 3- bromo- 1,5- dimethyl- 1H- 1,2,4- triazole
Smiles: Brc1nn(c(n1)C)C

BBL033204
Synonyms: 1- (1H- benzimidazol- 2- ylmethyl)cyclohexanamine
Smiles: NC1(CCCCC1)Cc1nc2c([nH]1)cccc2

BBL033205
Synonyms: N- [5- (piperazin- 1- ylmethyl)- 1,3- thiazol- 2- yl]acetamide
Smiles: CC(=O)Nc1ncc(s1)CN1CCNCC1

BBL033206
Synonyms: tetrazolo[1,5- a]quinoline- 5- carboxylicacid
Smiles: OC(=O)c1cc2nnnn2c2c1cccc2

BBL033207
Synonyms: methylN- (pyrrolidin- 1- ylcarbonyl)glycinate
Smiles: COC(=O)CNC(=O)N1CCCC1

BBL033208
Synonyms: [3- methyl- 5- (thiophen- 2- yl)- 1,2- oxazol- 4- yl]aceticacid
Smiles: OC(=O)Cc1c(C)noc1c1cccs1

BBL033209
Synonyms: 1- [3- (2,4- difluorophenyl)- 1,2,4- oxadiazol- 5- yl]methanamine
Smiles: NCc1onc(n1)c1ccc(cc1F)F

BBL033210
Synonyms: 4- methyl- 3- (1H- pyrazol- 1- yl)aniline
Smiles: Nc1ccc(c(c1)n1cccn1)C

BBL033211
Synonyms: 2- (1H- tetrazol- 5- ylmethyl)aniline
Smiles: Nc1ccccc1Cc1nnn[nH]1

BBL033212
Synonyms: 4- [(3- methyl- 1H- 1,2,4- triazol- 5- yl)methoxy]aniline
Smiles: Nc1ccc(cc1)OCc1[nH]nc(n1)C

BBL033213
Synonyms: 4- {[3- (propan- 2- yl)- 1H- 1,2,4- triazol- 5- yl]methoxy}aniline
Smiles: Nc1ccc(cc1)OCc1[nH]nc(n1)C(C)C

BBL033214
Synonyms: 1- {3- [2- chloro- 5- (trifluoromethyl)phenyl]- 1,2,4- oxadiazol- 5- yl}methanamine
Smiles: NCc1onc(n1)c1cc(ccc1Cl)C(F)(F)F

BBL033215
Synonyms: 4- methoxy- 3- (1H- pyrazol- 1- yl)benzoicacid
Smiles: COc1ccc(cc1n1cccn1)C(=O)O

BBL033216
Synonyms: 3- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 4- methoxybenzoicacid
Smiles: COc1ccc(cc1n1nc(cc1C)C)C(=O)O

BBL033217
Synonyms: N- (1- methyl- 1H- 1,2,4- triazol- 5- yl)ethane- 1,2- diamine
Smiles: Cn1ncnc1NCCN

BBL033218
Synonyms: 1- (propan- 2- yl)- 1H- indol- 4- amine
Smiles: Nc1cccc2c1ccn2C(C)C

BBL033219
Synonyms: methyl2,5- dioxo- 2,5,6,7- tetrahydro- 1H- cyclopenta[b]pyridine- 3- carboxylate
Smiles: COC(=O)c1cc2C(=O)CCc2[nH]c1=O

BBL033220
Synonyms: 2- methoxy- 3- (2- methoxyphenyl)propanoicacid
Smiles: COC(C(=O)O)Cc1ccccc1OC

BBL033221
Synonyms: 5- [(E)- 2- (furan- 2- yl)ethenyl]- 3- methyl- 1,2- oxazol- 4- amine
Smiles: Cc1noc(c1N)/C=C/c1ccco1

BBL033222
Synonyms: 3- pentyl- 3,4- dihydro- 1H- 1,4- benzodiazepine- 2,5- dione
Smiles: CCCCCC1NC(=O)c2c(NC1=O)cccc2

BBL033223
Synonyms: 5- [(E)- 2- (3- methoxyphenyl)ethenyl]- 3- methyl- 1,2- oxazol- 4- amine
Smiles: COc1cccc(c1)/C=C/c1onc(c1N)C

BBL033224
Synonyms: 1- (2,5- dimethoxyphenyl)- 3- (2- hydroxy- 5- methylphenyl)propane- 1,3- dione
Smiles: COc1ccc(cc1C(=O)CC(=O)c1cc(C)ccc1O)OC

BBL033225
Synonyms: 2,4- dioxo- 5- (propan- 2- yl)- 1,2,3,4- tetrahydropyrido[2,3- d]pyrimidine- 7- carboxylicacid
Smiles: O=c1[nH]c2nc(cc(c2c(=O)[nH]1)C(C)C)C(=O)O

BBL033226
Synonyms: 2- methoxy- 3- (4- methoxyphenyl)propanoicacid
Smiles: COc1ccc(cc1)CC(C(=O)O)OC

BBL033227
Synonyms: 2- acetyl- 5- methylphenyl2- (propan- 2- yloxy)benzoate
Smiles: CC(Oc1ccccc1C(=O)Oc1cc(C)ccc1C(=O)C)C

BBL033228
Synonyms: 3- methyl- 5- [(E)- 2- phenylethenyl]- 1,2- oxazol- 4- amine
Smiles: Nc1c(C)noc1/C=C/c1ccccc1

BBL033229
Synonyms: 3- phenyl- 2- (1H- tetrazol- 5- yl)propanoicacid
Smiles: OC(=O)C(c1nnn[nH]1)Cc1ccccc1

BBL033230
Synonyms: 4- (2- amino[1,3]thiazolo[4,3- b][1,3,4]thiadiazol- 5- yl)phenol
Smiles: Oc1ccc(cc1)C1SC=c2n1nc(s2)N

BBL033231
Synonyms: methyl5- methyl- 1- (pyrimidin- 2- yl)- 1H- pyrazole- 4- carboxylate
Smiles: COC(=O)c1cnn(c1C)c1ncccn1

BBL033232
Synonyms: 3- bromo- 5- (3- chlorophenyl)- 1H- 1,2,4- triazole
Smiles: Clc1cccc(c1)c1[nH]nc(n1)Br

BBL033233
Synonyms: methyl(5- bromo- 3- nitro- 1H- 1,2,4- triazol- 1- yl)acetate
Smiles: [O-][N+](=O)c1nn(c(n1)Br)CC(=O)OC

BBL033234
Synonyms: [2- chloro- 6- (morpholin- 4- yl)- 9H- purin- 9- yl]aceticacid
Smiles: OC(=O)Cn1cnc2c1nc(Cl)nc2N1CCOCC1

BBL033235
Synonyms: [2- chloro- 6- (pyrrolidin- 1- yl)- 9H- purin- 9- yl]aceticacid
Smiles: OC(=O)Cn1cnc2c1nc(Cl)nc2N1CCCC1

BBL033236
Synonyms: 4- [6- (propan- 2- yloxy)[1,2,4]triazolo[4,3- b]pyridazin- 3- yl]butanoicacid
Smiles: OC(=O)CCCc1nnc2n1nc(cc2)OC(C)C

BBL033237
Synonyms: [4- (1,2,3- thiadiazol- 4- yl)phenoxy]aceticacid
Smiles: OC(=O)COc1ccc(cc1)c1nnsc1

BBL033238
Synonyms: 5- (3- aminophenyl)- 5- methylimidazolidine- 2,4- dionehydrochloride
Smiles: O=C1NC(=O)C(N1)(C)c1cccc(c1)N.Cl

BBL033239
Synonyms: [5- (furan- 2- yl)- 3- methyl- 1,2- oxazol- 4- yl]aceticacid
Smiles: OC(=O)Cc1c(C)noc1c1ccco1

BBL033240
Synonyms: [3- methyl- 5- (thiophen- 3- yl)- 1,2- oxazol- 4- yl]aceticacid
Smiles: OC(=O)Cc1c(C)noc1c1cscc1

BBL033241
Synonyms: 5- chloro- 1- (2- methoxyethyl)- 1H- indole- 3- carboxylicacid
Smiles: COCCn1cc(c2c1ccc(c2)Cl)C(=O)O

BBL033242
Synonyms: 2,7- dioxo- 3- phenyl- 1,2,4,7- tetrahydropyrazolo[1,5- a]pyrimidine- 6- carboxylicacid
Smiles: OC(=O)c1c[nH]c2n(c1=O)[nH]c(=O)c2c1ccccc1

BBL033243
Synonyms: 3- oxo- 4- (propan- 2- yl)- 2,3- dihydro- 1H- pyrazolo[3,4- b]pyridine- 6- carboxylicacid
Smiles: CC(c1cc(nc2c1c(=O)[nH][nH]2)C(=O)O)C

BBL033244
Synonyms: 1- {[3- (trifluoromethoxy)phenyl]amino}cyclohexanecarboxylicacid
Smiles: OC(=O)C1(CCCCC1)Nc1cccc(c1)OC(F)(F)F

BBL033245
Synonyms: 1- (tetrazolo[1,5- b]pyridazin- 6- yl)piperidine- 3- carboxylicacid
Smiles: OC(=O)C1CCCN(C1)c1ccc2n(n1)nnn2

BBL033246
Synonyms: [1- (1H- tetrazol- 1- yl)cyclohexyl]aceticacid
Smiles: OC(=O)CC1(CCCCC1)n1cnnn1

BBL033247
Synonyms: [4- tert- butyl- 1- (1H- tetrazol- 1- yl)cyclohexyl]aceticacid
Smiles: OC(=O)CC1(CCC(CC1)C(C)(C)C)n1cnnn1

BBL033248
Synonyms: [4- (1H- tetrazol- 1- yl)tetrahydro- 2H- thiopyran- 4- yl]aceticacid
Smiles: OC(=O)CC1(CCSCC1)n1cnnn1

BBL033249
Synonyms: 3- (3- hydroxy- 6- oxopyridazin- 1(6H)- yl)propanenitrile
Smiles: Oc1ccc(=O)n(n1)CCC#N

BBL033250
Synonyms: 1- amino- 6- hydroxy- 4- methyl- 2- oxo- 1,2- dihydropyridine- 3- carbonitrile
Smiles: N#Cc1c(C)cc(n(c1=O)N)O

BBL033251
Synonyms: 5- benzyl- 1- methyl- 1H- pyrrole- 2- carbaldehyde
Smiles: O=Cc1ccc(n1C)Cc1ccccc1

BBL033252
Synonyms: methyl5- benzyl- 1- methyl- 1H- pyrrole- 2- carboxylate
Smiles: COC(=O)c1ccc(n1C)Cc1ccccc1

BBL033253
Synonyms: 5- benzyl- 1H- pyrrole- 2- carbaldehyde
Smiles: O=Cc1ccc([nH]1)Cc1ccccc1

BBL033254
Synonyms: 5- benzyl- 1H- pyrrole- 2- carboxylicacid
Smiles: OC(=O)c1ccc([nH]1)Cc1ccccc1

BBL033255
Synonyms: 3- chloro- 5- methyl- 1- (3- phenylpropyl)- 1H- 1,2,4- triazole
Smiles: Clc1nn(c(n1)C)CCCc1ccccc1

BBL033256
Synonyms: 3- bromo- 5- methyl- 1- (3- phenylpropyl)- 1H- 1,2,4- triazole
Smiles: Brc1nn(c(n1)C)CCCc1ccccc1

BBL033257
Synonyms: methyl(3- bromo- 5- methyl- 1H- 1,2,4- triazol- 1- yl)acetate
Smiles: Cc1nc(nn1CC(=O)OC)Br

BBL033258
Synonyms: 2- (3- chloro- 5- hydrazinyl- 1H- 1,2,4- triazol- 1- yl)ethanol
Smiles: NNc1nc(nn1CCO)Cl

BBL033259
Synonyms: 2- [(5- chloro- 1H- 1,2,4- triazol- 3- yl)sulfonyl]ethanol
Smiles: OCCS(=O)(=O)c1n[nH]c(n1)Cl

BBL033260
Synonyms: 3- [(5- chloro- 1H- 1,2,4- triazol- 3- yl)sulfonyl]propan- 1- ol
Smiles: OCCCS(=O)(=O)c1n[nH]c(n1)Cl

BBL033261
Synonyms: 2- [(5- bromo- 1H- 1,2,4- triazol- 3- yl)sulfonyl]ethanol
Smiles: OCCS(=O)(=O)c1n[nH]c(n1)Br

BBL033262
Synonyms: 3- methyl- 5- [(E)- 2- (thiophen- 3- yl)ethenyl]- 1,2- oxazol- 4- amine
Smiles: Cc1noc(c1N)/C=C/c1cscc1

BBL033263
Synonyms: 1- oxo- 2- (pyridin- 2- yl)- 1,2- dihydroisoquinoline- 4- carboxylicacid
Smiles: OC(=O)c1cn(c2ccccn2)c(=O)c2c1cccc2

BBL033264
Synonyms: 4- oxo- 4- {[4- (pyridin- 2- yl)- 1,3- thiazol- 2- yl]amino}butanoicacid
Smiles: O=C(Nc1scc(n1)c1ccccn1)CCC(=O)O

BBL033265
Synonyms: 4- methyl- 2- (propan- 2- yloxy)- 1,3- thiazole- 5- carboxylicacid
Smiles: CC(Oc1nc(c(s1)C(=O)O)C)C

BBL033266
Synonyms: 2- hydroxy- 5- (2- oxopyrrolidin- 1- yl)benzoicacid
Smiles: O=C1CCCN1c1ccc(c(c1)C(=O)O)O

BBL033267
Synonyms: 3- bromo- 2- (2- methylpropyl)pyrazolo[1,5- d][1,2,4]triazin- 4(5H)- one
Smiles: CC(Cc1nn2c(c1Br)c(=O)[nH]nc2)C

BBL033268
Synonyms: 4- (2- methylpropyl)- 3- oxo- 2,3- dihydro- 1H- pyrazolo[3,4- b]pyridine- 6- carboxylicacid
Smiles: CC(Cc1cc(nc2c1c(=O)[nH][nH]2)C(=O)O)C

BBL033269
Synonyms: [2- chloro- 6- (thiomorpholin- 4- yl)- 9H- purin- 9- yl]aceticacid
Smiles: OC(=O)Cn1cnc2c1nc(Cl)nc2N1CCSCC1

BBL033270
Synonyms: [2- chloro- 6- (piperidin- 1- yl)- 9H- purin- 9- yl]aceticacid
Smiles: OC(=O)Cn1cnc2c1nc(Cl)nc2N1CCCCC1

BBL033271
Synonyms: 1- oxo- 2- (pyridin- 4- ylmethyl)- 1,2- dihydroisoquinoline- 4- carboxylicacid
Smiles: OC(=O)c1cn(Cc2ccncc2)c(=O)c2c1cccc2

BBL033272
Synonyms: [(octahydro- 2H- quinolizin- 1- ylmethyl)sulfanyl]aceticacid
Smiles: OC(=O)CSCC1CCCN2C1CCCC2

BBL033273
Synonyms: 2- amino- 5- (3- fluorophenyl)- 1,3- thiazole- 4- carboxylicacid
Smiles: Fc1cccc(c1)c1sc(nc1C(=O)O)N

BBL033274
Synonyms: 4- chloro- 1- methyl- 2- oxo- 1,2- dihydroquinoline- 3- carboxylicacid
Smiles: OC(=O)c1c(Cl)c2ccccc2n(c1=O)C

BBL033275
Synonyms: 5- methoxy- 1- (propan- 2- yl)- 1H- indole- 3- carboxylicacid
Smiles: COc1ccc2c(c1)c(cn2C(C)C)C(=O)O

BBL033276
Synonyms: 5- methoxy- 1- (2- methoxyethyl)- 1H- indole- 3- carbaldehyde
Smiles: COCCn1cc(c2c1ccc(c2)OC)C=O

BBL033277
Synonyms: N- (octahydro- 2H- quinolizin- 1- ylmethyl)butan- 1- amine
Smiles: CCCCNCC1CCCN2C1CCCC2

BBL033278
Synonyms: N- (octahydro- 2H- quinolizin- 1- ylmethyl)propan- 1- amine
Smiles: CCCNCC1CCCN2C1CCCC2

BBL033279
Synonyms: 1- (propan- 2- yl)- 1H- indole- 3- carboxylicacid
Smiles: OC(=O)c1cn(c2c1cccc2)C(C)C

BBL033280
Synonyms: 2- amino- 5- (2- methylpropyl)- 1,3- thiazole- 4- carboxylicacid
Smiles: CC(Cc1sc(nc1C(=O)O)N)C

BBL033281
Synonyms: Historical
Smiles: N#CCC(=O)Nc1ccc(cc1)c1nc2c([nH]1)cccc2

BBL033282
Synonyms: Allium
Smiles: N#CCC(=O)Nc1ccc(cc1)O

BBL033283
Synonyms: 3- chloro- 1- methyl- 1H- 1,2,4- triazole
Smiles: Cn1cnc(n1)Cl

BBL033284
Synonyms: 3- chloro- 1,5- dimethyl- 1H- 1,2,4- triazole
Smiles: Clc1nn(c(n1)C)C

BBL033285
Synonyms: 3- chloro- 1- (3- phenylpropyl)- 1H- 1,2,4- triazole
Smiles: Clc1ncn(n1)CCCc1ccccc1

BBL033286
Synonyms: 2- hydroxy- 5- (3- methylbutyl)- 4- oxo- 3,4- dihydropyrido[2,3- d]pyrimidine- 7- carboxylicacid
Smiles: CC(CCc1cc(nc2c1c(=O)[nH]c(n2)O)C(=O)O)C

BBL033287
Synonyms: methyl[4- oxo- 3- (propan- 2- yl)- 3,4- dihydrophthalazin- 1- yl]acetate
Smiles: COC(=O)Cc1nn(C(C)C)c(=O)c2c1cccc2

BBL033288
Synonyms: 5- (thiophen- 3- yl)- 1,2- oxazole- 3- carboxylicacid
Smiles: OC(=O)c1noc(c1)c1cscc1

BBL033289
Synonyms: 1- (6- oxo- 1,6- dihydropyridazin- 3- yl)piperidine- 3- carboxylicacid
Smiles: OC(=O)C1CCCN(C1)c1ccc(=O)[nH]n1

BBL033290
Synonyms: 3- (2,3- dioxo- 2,3- dihydro- 1H- indol- 5- yl)propanoicacid
Smiles: OC(=O)CCc1ccc2c(c1)C(=O)C(=O)N2

BBL033291
Synonyms: 1- (2,1,3- benzoxadiazol- 4- yl)- 1H- pyrrole- 2,5- dione
Smiles: O=C1C=CC(=O)N1c1cccc2c1non2

BBL033292
Synonyms: 1- [6- (trifluoromethyl)pyridin- 3- yl]- 1H- pyrrole- 2,5- dione
Smiles: O=C1C=CC(=O)N1c1ccc(nc1)C(F)(F)F

BBL033293
Synonyms: 4- oxo- 4- (5,6,7,8- tetrahydro- 4H- cyclohepta[d][1,3]thiazol- 2- ylamino)butanoicacid
Smiles: OC(=O)CCC(=O)Nc1nc2c(s1)CCCCC2

BBL033294
Synonyms: methyl3- (3- methylbutyl)- 1H- pyrazole- 5- carboxylate
Smiles: COC(=O)c1[nH]nc(c1)CCC(C)C

BBL033295
Synonyms: 3- (8- hydroxy- 6- methyl[1,2,4]triazolo[4,3- b]pyridazin- 7- yl)propanoicacid
Smiles: OC(=O)CCc1c(C)nn2c(c1O)nnc2

BBL033296
Synonyms: 1- [(4- amino- 2- chlorophenyl)carbonyl]imidazolidin- 2- one
Smiles: Nc1ccc(c(c1)Cl)C(=O)N1CCNC1=O

BBL033297
Synonyms: 1- (2,1,3- benzothiadiazol- 5- yl)- 1H- pyrrole- 2,5- dione
Smiles: O=C1C=CC(=O)N1c1ccc2c(c1)nsn2

BBL033298
Synonyms: 1- [2- (2,5- dimethyl- 1H- pyrrol- 1- yl)ethyl]- 1H- benzimidazol- 5- amine
Smiles: Nc1ccc2c(c1)ncn2CCn1c(C)ccc1C

BBL033299
Synonyms: 3- chloro- 2- methylpyrazolo[1,5- d][1,2,4]triazin- 4(5H)- one
Smiles: Cc1nn2c(c1Cl)c(=O)[nH]nc2

BBL033300
Synonyms: 3- chloro- 2- (propan- 2- yl)pyrazolo[1,5- d][1,2,4]triazin- 4(5H)- one
Smiles: CC(c1nn2c(c1Cl)c(=O)[nH]nc2)C

BBL033301
Synonyms: methyl3- (4- chlorophenyl)- 1- methyl- 1H- pyrazole- 5- carboxylate
Smiles: COC(=O)c1cc(nn1C)c1ccc(cc1)Cl

BBL033302
Synonyms: methyl4- bromo- 1- methyl- 3- (2- methylpropyl)- 1H- pyrazole- 5- carboxylate
Smiles: COC(=O)c1n(C)nc(c1Br)CC(C)C

BBL033303
Synonyms: methyl4- bromo- 1- methyl- 3- (propan- 2- yl)- 1H- pyrazole- 5- carboxylate
Smiles: COC(=O)c1n(C)nc(c1Br)C(C)C

BBL033304
Synonyms: 4- (9H- purin- 6- yloxy)aniline
Smiles: Nc1ccc(cc1)Oc1ncnc2c1nc[nH]2

BBL033305
Synonyms: 2- (2,5- dioxopyrrolidin- 1- yl)- 5- (propan- 2- yl)- 1,3- thiazole- 4- carboxylicacid
Smiles: O=C1CCC(=O)N1c1sc(c(n1)C(=O)O)C(C)C

BBL033306
Synonyms: 2- (2,5- dioxopyrrolidin- 1- yl)- 5- (2- methylpropyl)- 1,3- thiazole- 4- carboxylicacid
Smiles: CC(Cc1sc(nc1C(=O)O)N1C(=O)CCC1=O)C

BBL033307
Synonyms: 3- (4- oxo- 4H- pyrido[2,1- c][1,2,4]triazin- 3- yl)propanoicacid
Smiles: OC(=O)CCc1nnc2n(c1=O)cccc2

BBL033308
Synonyms: (10- fluoro- 2,4- dimethylpyrimido[1,2- b]indazol- 3- yl)aceticacid
Smiles: OC(=O)Cc1c(C)nc2n(c1C)nc1c2c(F)ccc1

BBL033309
Synonyms: 3- (10- fluoro- 2,4- dimethylpyrimido[1,2- b]indazol- 3- yl)propanoicacid
Smiles: OC(=O)CCc1c(C)nc2n(c1C)nc1c2c(F)ccc1

BBL033310
Synonyms: 3- ([1,2,4]triazolo[4,3- a]pyridin- 3- yl)phenol
Smiles: Oc1cccc(c1)c1nnc2n1cccc2

BBL033311
Synonyms: 4- ([1,2,4]triazolo[4,3- a]pyridin- 3- yl)phenol
Smiles: Oc1ccc(cc1)c1nnc2n1cccc2

BBL033312
Synonyms: 2- methyl- 7- (2- methylpropyl)- 3- phenylpyrazolo[1,5- a]pyrimidine- 5- carboxylicacid
Smiles: CC(Cc1cc(nc2n1nc(c2c1ccccc1)C)C(=O)O)C

BBL033313
Synonyms: 3- [6- (propan- 2- yloxy)[1,2,4]triazolo[4,3- b]pyridazin- 3- yl]propanoicacid
Smiles: OC(=O)CCc1nnc2n1nc(cc2)OC(C)C

BBL033314
Synonyms: 2- (2,5- dioxopyrrolidin- 1- yl)- 4- methyl- 1,3- thiazole- 5- carboxylicacid
Smiles: O=C1CCC(=O)N1c1nc(c(s1)C(=O)O)C

BBL033315
Synonyms: 2- (2- iodoquinolin- 3- yl)- 5,7- dimethyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- ol
Smiles: OC1C2(C)CN3CC1(C)CN(C2)C3c1cc2ccccc2nc1I

BBL033316
Synonyms: 2- iodo- 6- methoxyquinoline- 3- carbaldehyde
Smiles: COc1ccc2c(c1)cc(c(n2)I)C=O

BBL033317
Synonyms: 2- (2- iodo- 6- methoxyquinolin- 3- yl)- 5,7- dimethyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- ol
Smiles: COc1ccc2c(c1)cc(c(n2)I)C1N2CC3(CN1CC(C2)(C3O)C)C

BBL033318
Synonyms: 7,8- dimethoxy- 5- methyl- 3,5- dihydro- 4H- pyridazino[4,5- b]indol- 4- one
Smiles: COc1cc2c(cc1OC)c1c(n2C)c(=O)[nH]nc1

BBL033319
Synonyms: [3- (2- methylpropyl)- 4- oxo- 3,4- dihydrophthalazin- 1- yl]aceticacid
Smiles: CC(Cn1nc(CC(=O)O)c2c(c1=O)cccc2)C

BBL033320
Synonyms: methylN- [(2- methylpropyl)carbamoyl]glycinate
Smiles: COC(=O)CNC(=O)NCC(C)C

BBL033321
Synonyms: 6- (2- methylpropyl)- 2- oxo- 1,2- dihydropyridine- 4- carboxylicacid
Smiles: CC(Cc1cc(cc(=O)[nH]1)C(=O)O)C

BBL033322
Synonyms: methyl4- bromo- 3- (4- chlorophenyl)- 1- methyl- 1H- pyrazole- 5- carboxylate
Smiles: COC(=O)c1n(C)nc(c1Br)c1ccc(cc1)Cl

BBL033323
Synonyms: 4- bromo- 5- methyl- 1,2- oxazol- 3- ol
Smiles: Oc1noc(c1Br)C

BBL033324
Synonyms: 3- cyclopentyl- 1,3- diazaspiro[4.5]decane- 2,4- dione
Smiles: O=C1NC2(C(=O)N1C1CCCC1)CCCCC2

BBL033325
Synonyms: 3- chloro- 1,2,5- thiadiazole
Smiles: Clc1cnsn1

BBL033326
Synonyms: N- [5- (propan- 2- yl)- 1,3,4- thiadiazol- 2- yl]prolinamide
Smiles: O=C(C1CCCN1)Nc1nnc(s1)C(C)C

BBL033327
Synonyms: 1- [(3- amino- 4- chlorophenyl)carbonyl]imidazolidin- 2- one
Smiles: O=C1NCCN1C(=O)c1ccc(c(c1)N)Cl

BBL033328
Synonyms: 1- [(5- amino- 2- chlorophenyl)carbonyl]imidazolidin- 2- one
Smiles: Nc1cc(C(=O)N2CCNC2=O)c(cc1)Cl

BBL033329
Synonyms: 5- amino- N,N- dimethyl- 2- (methylamino)benzamide
Smiles: CNc1ccc(cc1C(=O)N(C)C)N

BBL033330
Synonyms: 5- amino- N- methyl- 2- (1H- pyrazol- 1- yl)benzamide
Smiles: CNC(=O)c1cc(N)ccc1n1cccn1

BBL033331
Synonyms: 5- amino- N- methyl- 2- (4- methylpiperazin- 1- yl)benzamide
Smiles: CNC(=O)c1cc(N)ccc1N1CCN(CC1)C

BBL033332
Synonyms: 4- methyl- 2- propoxy- 1,3- thiazole- 5- carboxylicacid
Smiles: CCCOc1nc(c(s1)C(=O)O)C

BBL033333
Synonyms: methyl2- cyano- 3- oxobutanoate
Smiles: N#CC(C(=O)OC)C(=O)C

BBL033334
Synonyms: 1- benzyl- 3- bromo- 5- methoxy- 1H- 1,2,4- triazole
Smiles: COc1nc(nn1Cc1ccccc1)Br

BBL033335
Synonyms: 1- benzyl- 3- bromo- 5- (propan- 2- yloxy)- 1H- 1,2,4- triazole
Smiles: CC(Oc1nc(nn1Cc1ccccc1)Br)C

BBL033336
Synonyms: 3- (2- aminoethyl)- 6,7- dimethoxy- 2- methylquinazolin- 4(3H)- one
Smiles: NCCn1c(C)nc2c(c1=O)cc(c(c2)OC)OC

BBL033337
Synonyms: 1,2,4,5,6- pentamethyl- 5,6,7,8- tetrahydro- 1H- 6,8a- methanopyrrolo[3,2- c]azepine
Smiles: CC1=CC2=C(C)N(C3(CC2(N1C)CC3)C)C

BBL033338
Synonyms: [3- acetyl- 4- (acetylamino)- 1H- indol- 1- yl]aceticacid
Smiles: CC(=O)Nc1cccc2c1c(cn2CC(=O)O)C(=O)C

BBL033339
Synonyms: 3- (2- aminoethyl)- 6- fluoro- 2- methylquinazolin- 4(3H)- one
Smiles: Cc1nc2ccc(cc2c(=O)n1CCN)F

BBL033340
Synonyms: methyl1- {[(3- methylbutyl)carbamoyl]amino}cyclohexanecarboxylate
Smiles: COC(=O)C1(CCCCC1)NC(=O)NCCC(C)C

BBL033341
Synonyms: methyl1- [(pyrrolidin- 1- ylcarbonyl)amino]cyclohexanecarboxylate
Smiles: COC(=O)C1(CCCCC1)NC(=O)N1CCCC1

BBL033342
Synonyms: [4- tert- butyl- 1- (1H- pyrrol- 1- yl)cyclohexyl]aceticacid
Smiles: OC(=O)CC1(CCC(CC1)C(C)(C)C)n1cccc1

BBL033343
Synonyms: 5- (3- methoxyphenyl)- 1H- imidazole- 2- thiol
Smiles: COc1cccc(c1)c1cnc([nH]1)S

BBL033344
Synonyms: 4- bromo- 1- methyl- 3- (4- methylphenyl)- 1H- pyrazole- 5- carboxylicacid
Smiles: Cc1ccc(cc1)c1nn(c(c1Br)C(=O)O)C

BBL033345
Synonyms: methyl4- bromo- 1- methyl- 3- (4- methylphenyl)- 1H- pyrazole- 5- carboxylate
Smiles: COC(=O)c1n(C)nc(c1Br)c1ccc(cc1)C

BBL033346
Synonyms: methyl1- methyl- 3- (2- methylpropyl)- 1H- pyrazole- 5- carboxylate
Smiles: COC(=O)c1cc(nn1C)CC(C)C

BBL033347
Synonyms: N- (5- methyl- 1,3- thiazol- 2- yl)pyridin- 2- amine
Smiles: Cc1cnc(s1)Nc1ccccn1

BBL033348
Synonyms: methyl1- [(propan- 2- ylcarbamoyl)amino]cyclohexanecarboxylate
Smiles: COC(=O)C1(CCCCC1)NC(=O)NC(C)C

BBL033349
Synonyms: methyl1- {[(2- methylpropyl)carbamoyl]amino}cyclohexanecarboxylate
Smiles: COC(=O)C1(CCCCC1)NC(=O)NCC(C)C

BBL033350
Synonyms: methyl1- [(piperidin- 1- ylcarbonyl)amino]cyclohexanecarboxylate
Smiles: COC(=O)C1(CCCCC1)NC(=O)N1CCCCC1

BBL033351
Synonyms: methyl1- [(morpholin- 4- ylcarbonyl)amino]cyclohexanecarboxylate
Smiles: COC(=O)C1(CCCCC1)NC(=O)N1CCOCC1

BBL033352
Synonyms: methyl1- [(thiomorpholin- 4- ylcarbonyl)amino]cyclohexanecarboxylate
Smiles: COC(=O)C1(CCCCC1)NC(=O)N1CCSCC1

BBL033353
Synonyms: (4,5- dicyano- 1H- imidazol- 1- yl)aceticacid
Smiles: OC(=O)Cn1cnc(c1C#N)C#N

BBL033354
Synonyms: 4- bromo- 2,5- dimethyl- 1H- pyrrole- 3- carbaldehyde
Smiles: O=Cc1c(C)[nH]c(c1Br)C

BBL033355
Synonyms: methyl5- [(2- formyl- 5- methyl- 1H- pyrrol- 1- yl)methyl]furan- 2- carboxylate
Smiles: COC(=O)c1ccc(o1)Cn1c(C)ccc1C=O

BBL033356
Synonyms: 1- {[5- (methoxycarbonyl)furan- 2- yl]methyl}- 1H- pyrrole- 2- carboxylicacid
Smiles: COC(=O)c1ccc(o1)Cn1cccc1C(=O)O

BBL033357
Synonyms: 1- (4- chlorobenzyl)- 5- methyl- 1H- pyrrole- 2- carboxylicacid
Smiles: Clc1ccc(cc1)Cn1c(C)ccc1C(=O)O

BBL033358
Synonyms: 4- iodo- 2,5- dimethyl- 1H- pyrrole- 3- carbaldehyde
Smiles: O=Cc1c(C)[nH]c(c1I)C

BBL033359
Synonyms: 4- iodo- 1,2,5- trimethyl- 1H- pyrrole- 3- carbaldehyde
Smiles: O=Cc1c(C)n(c(c1I)C)C

BBL033360
Synonyms: 1- (4- chloro- 3- nitrophenyl)- 2,5- dimethyl- 1H- pyrrole
Smiles: [O-][N+](=O)c1cc(ccc1Cl)n1c(C)ccc1C

BBL033361
Synonyms: 4- (1H- pyrazol- 5- yl)thiophene- 2- sulfonylchloride
Smiles: ClS(=O)(=O)c1scc(c1)c1ccn[nH]1

BBL033362
Synonyms: 7- (piperazin- 1- yl)[1,2,4]triazolo[4,3- a]pyrimidine
Smiles: N1CCN(CC1)c1ccn2c(n1)nnc2

BBL033363
Synonyms: 4- [(2- amino- 9H- purin- 6- yl)amino]butanoicacid
Smiles: Nc1nc(NCCCC(=O)O)c2c(n1)[nH]cn2

BBL033364
Synonyms: 7,8- dimethoxy- 3- methyl- 5H- indeno[1,2- b][1,2]oxazolo[4,5- e]pyridine- 4- carboxylicacid
Smiles: COc1cc2c(cc1OC)Cc1c2nc2onc(c2c1C(=O)O)C

BBL033365
Synonyms: 7,8- dimethoxy- 1- (propan- 2- yl)- 1,5- dihydroindeno[1,2- b]pyrazolo[4,3- e]pyridine- 4- carboxylicacid
Smiles: COc1cc2c(cc1OC)Cc1c2nc2c(c1C(=O)O)cnn2C(C)C

BBL033366
Synonyms: 7,8- dimethoxy- 1,3- dimethyl- 1,5- dihydroindeno[1,2- b]pyrazolo[4,3- e]pyridine- 4- carboxylicacid
Smiles: COc1cc2c(cc1OC)Cc1c2nc2n(C)nc(c2c1C(=O)O)C

BBL033367
Synonyms: N- (5- methyl- 1,3,4- thiadiazol- 2- yl)prolinamide
Smiles: O=C(C1CCCN1)Nc1nnc(s1)C

BBL033368
Synonyms: methylN- (cyclopentylcarbamoyl)glycinate
Smiles: COC(=O)CNC(=O)NC1CCCC1

BBL033369
Synonyms: 4- methyl- 2- (pyridin- 3- ylamino)- 1,3- thiazole- 5- carboxylicacid
Smiles: OC(=O)c1sc(nc1C)Nc1cccnc1

BBL033370
Synonyms: 4- {[4- (methoxycarbonyl)- 5- methyl- 1,3- thiazol- 2- yl]amino}- 4- oxobutanoicacid
Smiles: COC(=O)c1nc(sc1C)NC(=O)CCC(=O)O

BBL033371
Synonyms: 5- (3- fluorophenyl)- 2- methyl- 1,3- thiazole- 4- carboxylicacid
Smiles: Fc1cccc(c1)c1sc(nc1C(=O)O)C

BBL033372
Synonyms: 5- benzyl- 2- methyl- 1,3- thiazole- 4- carboxylicacid
Smiles: Cc1nc(c(s1)Cc1ccccc1)C(=O)O

BBL033373
Synonyms: methylN- [(3- methylbutyl)carbamoyl]glycinate
Smiles: COC(=O)CNC(=O)NCCC(C)C

BBL033374
Synonyms: methyl1- [(cyclopentylcarbamoyl)amino]cyclohexanecarboxylate
Smiles: COC(=O)C1(CCCCC1)NC(=O)NC1CCCC1

BBL033375
Synonyms: 4- [6- (morpholin- 4- yl)[1,2,4]triazolo[4,3- b]pyridazin- 3- yl]butanoicacid
Smiles: OC(=O)CCCc1nnc2n1nc(cc2)N1CCOCC1

BBL033376
Synonyms: 4- [6- (dimethylamino)[1,2,4]triazolo[4,3- b]pyridazin- 3- yl]butanoicacid
Smiles: OC(=O)CCCc1nnc2n1nc(cc2)N(C)C

BBL033377
Synonyms: 3- [6- (dimethylamino)[1,2,4]triazolo[4,3- b]pyridazin- 3- yl]propanoicacid
Smiles: OC(=O)CCc1nnc2n1nc(cc2)N(C)C

BBL033378
Synonyms: 4- [6- (thiomorpholin- 4- yl)[1,2,4]triazolo[4,3- b]pyridazin- 3- yl]butanoicacid
Smiles: OC(=O)CCCc1nnc2n1nc(cc2)N1CCSCC1

BBL033379
Synonyms: 4- [6- (piperidin- 1- yl)[1,2,4]triazolo[4,3- b]pyridazin- 3- yl]butanoicacid
Smiles: OC(=O)CCCc1nnc2n1nc(cc2)N1CCCCC1

BBL033380
Synonyms: 3- [6- (piperidin- 1- yl)[1,2,4]triazolo[4,3- b]pyridazin- 3- yl]propanoicacid
Smiles: OC(=O)CCc1nnc2n1nc(cc2)N1CCCCC1

BBL033381
Synonyms: 4- [6- (pyrrolidin- 1- yl)[1,2,4]triazolo[4,3- b]pyridazin- 3- yl]butanoicacid
Smiles: OC(=O)CCCc1nnc2n1nc(cc2)N1CCCC1

BBL033382
Synonyms: 2- ethoxy- 5- nitropyrimidin- 4- amine
Smiles: CCOc1ncc(c(n1)N)[N+](=O)[O-]

BBL033383
Synonyms: 6- methyl- 5- (piperazin- 1- yl)pyrimidine- 2,4(1H,3H)- dione
Smiles: Cc1[nH]c(=O)[nH]c(=O)c1N1CCNCC1

BBL033384
Synonyms: 1,2- dihydroxycyclobuta[b]quinoxaline- 5- carboxylicacid
Smiles: OC1=C(O)c2c1nc1c(n2)ccc(c1)C(=O)O

BBL033385
Synonyms: 4- bromo- 1- methyl- 1H- pyrrole- 2- carbaldehyde
Smiles: Cn1cc(cc1C=O)Br

BBL033386
Synonyms: 3- [(2,2- dimethyl- 3,4- dihydro- 2H- chromen- 6- yl)methyl]- 1H- 1,2,4- triazol- 5- amine
Smiles: Nc1[nH]nc(n1)Cc1ccc2c(c1)CCC(O2)(C)C

BBL033387
Synonyms: 2- (5,7- dioxo- 5,7- dihydro- 6H- pyrrolo[3,4- b]pyrazin- 6- yl)- 4- methylpentanoicacid
Smiles: CC(CC(N1C(=O)c2c(C1=O)nccn2)C(=O)O)C

BBL033388
Synonyms: 3- (1H- indol- 2- yl)- 1H- 1,2,4- triazol- 5- amine
Smiles: Nc1[nH]nc(n1)c1cc2c([nH]1)cccc2

BBL033389
Synonyms: 3- [2- (3,5- dimethyl- 1,2- oxazol- 4- yl)ethyl]- 1H- 1,2,4- triazol- 5- amine
Smiles: Nc1[nH]nc(n1)CCc1c(C)noc1C

BBL033390
Synonyms: 5- (4- phenoxyphenyl)- 1H- pyrazole- 4- carboxylicacid
Smiles: OC(=O)c1cn[nH]c1c1ccc(cc1)Oc1ccccc1

BBL033391
Synonyms: 2- (5,7- dioxo- 5,7- dihydro- 6H- pyrrolo[3,4- b]pyrazin- 6- yl)- 3- phenylpropanoicacid
Smiles: OC(=O)C(N1C(=O)c2c(C1=O)nccn2)Cc1ccccc1

BBL033392
Synonyms: 2- bromo- 1- azabicyclo[2.2.2]octan- 3- one
Smiles: O=C1C2CCN(C1Br)CC2

BBL033393
Synonyms: tert- butyl{1- [5- (methylsulfanyl)- 1,3,4- oxadiazol- 2- yl]- 2- phenylethyl}carbamate
Smiles: CSc1nnc(o1)C(Cc1ccccc1)NC(=O)OC(C)(C)C

BBL033394
Synonyms: tert- butyl{1- [5- (butylsulfanyl)- 1,3,4- oxadiazol- 2- yl]- 2- phenylethyl}carbamate
Smiles: CCCCSc1nnc(o1)C(Cc1ccccc1)NC(=O)OC(C)(C)C

BBL033395
Synonyms: tert- butyl[2- phenyl- 1- (5- sulfanyl- 1,3,4- oxadiazol- 2- yl)ethyl]carbamate
Smiles: O=C(OC(C)(C)C)NC(c1nnc(o1)S)Cc1ccccc1

BBL033396
Synonyms: N- [2- (5- amino- 1H- 1,2,4- triazol- 3- yl)ethyl]benzamide
Smiles: O=C(c1ccccc1)NCCc1n[nH]c(n1)N

BBL033397
Synonyms: 3- [4- (5,5- dimethyl- 4,5- dihydro- 1,3- thiazol- 2- yl)piperazin- 1- yl]propanoicacid
Smiles: OC(=O)CCN1CCN(CC1)C1=NCC(S1)(C)C

BBL033398
Synonyms: 1- [3- (4- bromo- 2- fluorophenyl)- 1,2,4- oxadiazol- 5- yl]methanamine
Smiles: NCc1onc(n1)c1ccc(cc1F)Br

BBL033399
Synonyms: 4- bromo- 3',5'- dimethyl- 1'- (propan- 2- yl)- 1'H,2H- 3,4'- bipyrazole- 5- carboxylicacid
Smiles: CC(n1nc(c(c1C)c1[nH]nc(c1Br)C(=O)O)C)C

BBL033400
Synonyms: methyl2- (3- amino- 1H- 1,2,4- triazol- 5- yl)cyclohexanecarboxylate
Smiles: COC(=O)C1CCCCC1c1[nH]nc(n1)N

BBL033401
Synonyms: 2- (5,7- dioxo- 5,7- dihydro- 6H- pyrrolo[3,4- b]pyrazin- 6- yl)- 3- methylbutanoicacid
Smiles: CC(C(N1C(=O)c2c(C1=O)nccn2)C(=O)O)C

BBL033402
Synonyms: 4- (5- amino- 1H- 1,2,4- triazol- 3- yl)- 1- methylpyrrolidin- 2- one
Smiles: O=C1CC(CN1C)c1n[nH]c(n1)N

BBL033403
Synonyms: 2- amino- 6- methoxy- 4- [2- (propan- 2- yl)- 2H- tetrazol- 5- yl]phenol
Smiles: COc1cc(cc(c1O)N)c1nnn(n1)C(C)C

BBL033404
Synonyms: methyl4- bromo- 5- (3- methylbutyl)- 1H- pyrazole- 3- carboxylate
Smiles: COC(=O)c1n[nH]c(c1Br)CCC(C)C

BBL033405
Synonyms: [5- methyl- 3- (thiophen- 3- yl)- 1H- pyrazol- 4- yl]aceticacid
Smiles: OC(=O)Cc1c(C)[nH]nc1c1cscc1

BBL033406
Synonyms: [5- methyl- 3- (thiophen- 2- yl)- 1H- pyrazol- 4- yl]aceticacid
Smiles: OC(=O)Cc1c(C)[nH]nc1c1cccs1

BBL033407
Synonyms: 3- (1H- indol- 3- yl)- 1H- 1,2,4- triazol- 5- amine
Smiles: Nc1[nH]nc(n1)c1c[nH]c2c1cccc2

BBL033408
Synonyms: methyl3- (5- hydroxy- 4H- 1,2,4- triazol- 3- yl)propanoate
Smiles: COC(=O)CCc1nnc([nH]1)O

BBL033409
Synonyms: 2- (trifluoromethyl)- 3,4- dihydro- 2H- chromen- 4- amine
Smiles: NC1CC(Oc2c1cccc2)C(F)(F)F

BBL033410
Synonyms: methyl(2E)- 3- (5- bromo- 4H- 1,2,4- triazol- 3- yl)prop- 2- enoate
Smiles: COC(=O)/C=C/c1nnc([nH]1)Br

BBL033411
Synonyms: (5,7- dioxo- 5,7- dihydro- 6H- pyrrolo[3,4- b]pyrazin- 6- yl)(phenyl)aceticacid
Smiles: OC(=O)C(N1C(=O)c2c(C1=O)nccn2)c1ccccc1

BBL033412
Synonyms: 5- methyl- 4,5,6,7- tetrahydro- 1H- pyrazolo[4,3- c]pyridin- 3- amine
Smiles: CN1CCc2c(C1)c(N)n[nH]2

BBL033413
Synonyms: 5- (5- amino- 1H- 1,2,4- triazol- 3- yl)pyridin- 3- ol
Smiles: Oc1cncc(c1)c1n[nH]c(n1)N

BBL033414
Synonyms: 7- (2- aminoethyl)- 2- methylpyrido[3,4- e][1,2,4]triazolo[1,5- a]pyrimidin- 6(7H)- one
Smiles: NCCn1ccc2c(c1=O)cnc1n2nc(n1)C

BBL033415
Synonyms: 4- iodo- 5- (3- methylbutyl)- 1H- pyrazole- 3- carboxylicacid
Smiles: CC(CCc1[nH]nc(c1I)C(=O)O)C

BBL033416
Synonyms: 2- [3- (pyrazin- 2- yl)- 1H- 1,2,4- triazol- 5- yl]aniline
Smiles: Nc1ccccc1c1[nH]nc(n1)c1cnccn1

BBL033417
Synonyms: 4- bromo- 5- (3- methylbutyl)- 1H- pyrazole- 3- carboxylicacid
Smiles: CC(CCc1[nH]nc(c1Br)C(=O)O)C

BBL033418
Synonyms: (2E)- 3- (5- bromo- 4H- 1,2,4- triazol- 3- yl)prop- 2- enoicacid
Smiles: OC(=O)/C=C/c1nnc([nH]1)Br

BBL033419
Synonyms: 3- bromo- 5- methyl- 1- (2- phenylethyl)- 1H- 1,2,4- triazole
Smiles: Brc1nn(c(n1)C)CCc1ccccc1

BBL033420
Synonyms: 5- (2,5- dimethyl- 1H- pyrrol- 1- yl)- 1H- 1,2,4- triazol- 3- amine
Smiles: Nc1n[nH]c(n1)n1c(C)ccc1C

BBL033421
Synonyms: 3- bromo- 1- (3- methylbutyl)- 1H- 1,2,4- triazole
Smiles: CC(CCn1cnc(n1)Br)C

BBL033422
Synonyms: 5- (4- fluorobenzyl)- 1H- 1,2,4- triazol- 3- amine
Smiles: Fc1ccc(cc1)Cc1[nH]nc(n1)N

BBL033423
Synonyms: 3- amino- N- cyclopropyl- 1H- 1,2,4- triazole- 5- carboxamide
Smiles: O=C(c1[nH]nc(n1)N)NC1CC1

BBL033424
Synonyms: [3- (furan- 2- yl)- 5- methyl- 1H- pyrazol- 4- yl]aceticacid
Smiles: OC(=O)Cc1c(C)[nH]nc1c1ccco1

BBL033425
Synonyms: 1- methyl- 2- oxo- 1,2,5,6,7,8- hexahydroquinoline- 3- carbonitrile
Smiles: N#Cc1cc2CCCCc2n(c1=O)C

BBL033426
Synonyms: methyl4- methyl- 3- oxo- 2,3- dihydro- 1H- pyrazolo[3,4- b]pyridine- 6- carboxylate
Smiles: COC(=O)c1cc(C)c2c(n1)[nH][nH]c2=O

BBL033427
Synonyms: 6- tert- butyl- 2- oxo- 1,2- dihydropyridine- 4- carboxylicacid
Smiles: OC(=O)c1cc(=O)[nH]c(c1)C(C)(C)C

BBL033428
Synonyms: 1- (3,5- dimethyl- 4H- 1,2,4- triazol- 4- yl)- 3- hydroxy- 1,4,5,6- tetrahydro- 2H- indol- 2- one
Smiles: O=C1C(=C2C(=CCCC2)N1n1c(C)nnc1C)O

BBL033429
Synonyms: 4- oxo- 5- (propan- 2- yl)- 2- thioxo- 1,2,3,4- tetrahydropyrido[2,3- d]pyrimidine- 7- carboxylicacid
Smiles: CC(c1cc(nc2c1c(=O)[nH]c(=S)[nH]2)C(=O)O)C

BBL033430
Synonyms: 3- (3- bromo- 5,7- dimethyl- 2- oxo- 1,2- dihydropyrazolo[1,5- a]pyrimidin- 6- yl)propanoicacid
Smiles: OC(=O)CCc1c(C)nc2n(c1C)[nH]c(=O)c2Br

BBL033431
Synonyms: (2,2- dimethyl- 4- propyltetrahydro- 2H- pyran- 4- yl)aceticacid
Smiles: CCCC1(CCOC(C1)(C)C)CC(=O)O

BBL033432
Synonyms: N- (2- amino- 9H- purin- 6- yl)- beta- alanine
Smiles: Nc1nc(NCCC(=O)O)c2c(n1)[nH]cn2

BBL033433
Synonyms: N- (2- amino- 9H- purin- 6- yl)glycine
Smiles: Nc1nc(NCC(=O)O)c2c(n1)[nH]cn2

BBL033434
Synonyms: 2- (2,2- dimethyl- 4- propyltetrahydro- 2H- pyran- 4- yl)ethanamine
Smiles: CCCC1(CCN)CCOC(C1)(C)C

BBL033435
Synonyms: 2- iodo- 7- methoxyquinoline- 3- carbaldehyde
Smiles: COc1ccc2c(c1)nc(c(c2)C=O)I

BBL033436
Synonyms: methyl(1- {[(propan- 2- ylcarbamoyl)amino]methyl}cyclohexyl)acetate
Smiles: COC(=O)CC1(CCCCC1)CNC(=O)NC(C)C

BBL033437
Synonyms: methyl(1- {[(pyrrolidin- 1- ylcarbonyl)amino]methyl}cyclohexyl)acetate
Smiles: COC(=O)CC1(CCCCC1)CNC(=O)N1CCCC1

BBL033438
Synonyms: methyl(1- {[(morpholin- 4- ylcarbonyl)amino]methyl}cyclohexyl)acetate
Smiles: COC(=O)CC1(CCCCC1)CNC(=O)N1CCOCC1

BBL033439
Synonyms: methyl(1- {[(tert- butylcarbamoyl)amino]methyl}cyclohexyl)acetate
Smiles: COC(=O)CC1(CCCCC1)CNC(=O)NC(C)(C)C

BBL033440
Synonyms: methyl{1- [(morpholin- 4- ylcarbonyl)amino]cyclohexyl}acetate
Smiles: COC(=O)CC1(CCCCC1)NC(=O)N1CCOCC1

BBL033441
Synonyms: [4- (1H- pyrrol- 1- yl)tetrahydro- 2H- thiopyran- 4- yl]aceticacid
Smiles: OC(=O)CC1(CCSCC1)n1cccc1

BBL033442
Synonyms: 3- (1H- tetrazol- 1- yl)- 3- (thiophen- 3- yl)propanoicacid
Smiles: OC(=O)CC(n1cnnn1)c1cscc1

BBL033443
Synonyms: (7,8- dimethoxy- 2- oxo- 1,2- dihydro- 3H- 3- benzazepin- 3- yl)aceticacid
Smiles: COc1cc2C=CN(C(=O)Cc2cc1OC)CC(=O)O

BBL033444
Synonyms: methyl4- oxo- 1,4- dihydropyrimido[1,2- b]indazole- 2- carboxylate
Smiles: COC(=O)c1cc(=O)n2c([nH]1)c1ccccc1n2

BBL033445
Synonyms: 4- {6- [(2- methoxyethyl)amino][1,2,4]triazolo[4,3- b]pyridazin- 3- yl}butanoicacid
Smiles: COCCNc1ccc2n(n1)c(CCCC(=O)O)nn2

BBL033446
Synonyms: 2- acetyl- 5- amino- 1,2- oxazol- 3(2H)- one
Smiles: CC(=O)n1oc(cc1=O)N

BBL033447
Synonyms: 1- (2- methoxybenzyl)- 5- methyl- 1H- pyrrole- 2- carboxylicacid
Smiles: COc1ccccc1Cn1c(C)ccc1C(=O)O

BBL033448
Synonyms: N~2~- (4- aminophenyl)- N~2~- (methylsulfonyl)glycinamide
Smiles: NC(=O)CN(S(=O)(=O)C)c1ccc(cc1)N

BBL033449
Synonyms: methylN- (4- aminophenyl)- N- (methylsulfonyl)glycinate
Smiles: COC(=O)CN(S(=O)(=O)C)c1ccc(cc1)N

BBL033450
Synonyms: N~2~- (3- aminophenyl)- N~2~- (methylsulfonyl)glycinamide
Smiles: NC(=O)CN(S(=O)(=O)C)c1cccc(c1)N

BBL033451
Synonyms: methylN- (3- aminophenyl)- N- (methylsulfonyl)glycinate
Smiles: COC(=O)CN(S(=O)(=O)C)c1cccc(c1)N

BBL033452
Synonyms: methylN- (methylsulfonyl)- N- pyridin- 3- ylglycinate
Smiles: COC(=O)CN(S(=O)(=O)C)c1cccnc1

BBL033453
Synonyms: 3- chloro- 5- (3- chlorophenyl)- 1H- 1,2,4- triazole
Smiles: Clc1cccc(c1)c1[nH]nc(n1)Cl

BBL033454
Synonyms: 5- (2- bromophenyl)- 3- chloro- 1H- 1,2,4- triazole
Smiles: Clc1n[nH]c(n1)c1ccccc1Br

BBL033455
Synonyms: methyl{1- [(cyclopropylcarbamoyl)amino]cyclohexyl}acetate
Smiles: COC(=O)CC1(CCCCC1)NC(=O)NC1CC1

BBL033456
Synonyms: methyl(1- {[(2- methylpropyl)carbamoyl]amino}cyclohexyl)acetate
Smiles: COC(=O)CC1(CCCCC1)NC(=O)NCC(C)C

BBL033457
Synonyms: 3- {6- [(2- methoxyethyl)amino][1,2,4]triazolo[4,3- b]pyridazin- 3- yl}propanoicacid
Smiles: COCCNc1ccc2n(n1)c(CCC(=O)O)nn2

BBL033458
Synonyms: 6- amino- 3- methyl- 1,2,3- benzotriazin- 4(3H)- one
Smiles: Nc1ccc2c(c1)c(=O)n(nn2)C

BBL033459
Synonyms: 6- amino- 3- (propan- 2- yl)- 1,2,3- benzotriazin- 4(3H)- one
Smiles: Nc1ccc2c(c1)c(=O)n(nn2)C(C)C

BBL033460
Synonyms: 6- amino- 3- (2- methoxyethyl)- 1,2,3- benzotriazin- 4(3H)- one
Smiles: COCCn1nnc2c(c1=O)cc(cc2)N

BBL033461
Synonyms: 3- [(3,5- dimethyl- 1H- pyrazol- 4- yl)methyl]aniline
Smiles: Nc1cccc(c1)Cc1c(C)n[nH]c1C

BBL033462
Synonyms: 6- amino- 3- (2- methylpropyl)- 1,2,3- benzotriazin- 4(3H)- one
Smiles: CC(Cn1nnc2c(c1=O)cc(cc2)N)C

BBL033463
Synonyms: [4- (acetylamino)- 1H- indol- 1- yl]aceticacid
Smiles: CC(=O)Nc1cccc2c1ccn2CC(=O)O

BBL033464
Synonyms: 2- chloro- N- (2- methyl- 1H- indol- 3- yl)acetamide
Smiles: ClCC(=O)Nc1c(C)[nH]c2c1cccc2

BBL033465
Synonyms: 4- chloro- 5- (4- methylphenyl)- 1H- pyrazole- 3- carboxylicacid
Smiles: Cc1ccc(cc1)c1[nH]nc(c1Cl)C(=O)O

BBL033466
Synonyms: N- {[4- (acetylamino)phenyl]sulfonyl}methionine
Smiles: CSCCC(C(=O)O)NS(=O)(=O)c1ccc(cc1)NC(=O)C

BBL033467
Synonyms: 2- (piperidin- 1- yl)bicyclo[3.3.1]nonan- 9- one
Smiles: O=C1C2CCCC1C(CC2)N1CCCCC1

BBL033468
Synonyms: methyl(2S)- 2- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)propanoate
Smiles: COC(=O)[C@@H](n1nnc2c(c1=O)cccc2)C

BBL033469
Synonyms: N- {[trans- 4- (propan- 2- yl)cyclohexyl]carbonyl}- D- phenylalanine
Smiles: CC([C@@H]1CC[C@H](CC1)C(=O)NC(C(=O)O)Cc1ccccc1)C

BBL033470
Synonyms: 3- hydroxyestra- 1,3,5(10)- trien- 17- one
Smiles: Oc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CCC2=O)C

BBL033471
Synonyms: octahydro- 5H- 4,7- methanoinden- 5- one
Smiles: O=C1CC2CC1C1C2CCC1

BBL033472
Synonyms: 2- isothiocyanatobicyclo[2.2.1]heptane
Smiles: S=C=NC1CC2CC1CC2

BBL033473
Synonyms: 1- (trifluoroacetyl)- L- prolylchloride
Smiles: ClC(=O)[C@@H]1CCCN1C(=O)C(F)(F)F

BBL033474
Synonyms: L- isoleucinamide
Smiles: CC[C@@H]([C@@H](C(=O)N)N)C

BBL033475
Synonyms: (3,4- dimethoxyphenyl)(oxo)acetate
Smiles: COc1cc(ccc1OC)C(=O)C(=O)[O-]

BBL033476
Synonyms: methylphenyl[(propan- 2- ylcarbamoyl)amino]acetate
Smiles: COC(=O)C(c1ccccc1)NC(=O)NC(C)C

BBL033477
Synonyms: {[(2- methylpropyl)carbamoyl]amino}(phenyl)aceticacid
Smiles: CC(CNC(=O)NC(c1ccccc1)C(=O)O)C

BBL033478
Synonyms: methylN- (morpholin- 4- ylcarbonyl)valinate
Smiles: COC(=O)C(C(C)C)NC(=O)N1CCOCC1

BBL033479
Synonyms: methyl[(morpholin- 4- ylcarbonyl)amino](phenyl)acetate
Smiles: COC(=O)C(c1ccccc1)NC(=O)N1CCOCC1

BBL033480
Synonyms: 5- methyl- 1,2- oxazol- 3- ol
Smiles: Oc1noc(c1)C

BBL033481
Synonyms: methylN- (morpholin- 4- ylcarbonyl)isoleucinate
Smiles: CCC(C(C(=O)OC)NC(=O)N1CCOCC1)C

BBL033482
Synonyms: phenyl[(propan- 2- ylcarbamoyl)amino]aceticacid
Smiles: CC(NC(=O)NC(c1ccccc1)C(=O)O)C

BBL033483
Synonyms: methylN- (cyclopentylcarbamoyl)isoleucinate
Smiles: CCC(C(C(=O)OC)NC(=O)NC1CCCC1)C

BBL033484
Synonyms: methylN- (pyrrolidin- 1- ylcarbonyl)valinate
Smiles: COC(=O)C(C(C)C)NC(=O)N1CCCC1

BBL033485
Synonyms: 4- {[(4- aminophenyl)carbonyl]amino}butanoate
Smiles: O=C(c1ccc(cc1)N)NCCCC(=O)[O-]

BBL033486
Synonyms: methyl{[(3- methylbutyl)carbamoyl]amino}(phenyl)acetate
Smiles: COC(=O)C(c1ccccc1)NC(=O)NCCC(C)C

BBL033487
Synonyms: 3,4- dihydroxy- 5- (hydroxymethyl)dihydrofuran- 2(3H)- one(non- preferredname)
Smiles: OCC1OC(=O)C(C1O)O

BBL033488
Synonyms: 1- [4- hydroxy- 3- (hydroxymethyl)tetrahydrofuran- 2- yl]- 5- methylpyrimidine- 2,4(1H,3H)- dione
Smiles: OCC1C(O)COC1n1cc(C)c(=O)[nH]c1=O

BBL033489
Synonyms: methylN- [(2- methylpropyl)carbamoyl]isoleucinate
Smiles: CCC(C(C(=O)OC)NC(=O)NCC(C)C)C

BBL033490
Synonyms: methylN- (pyrrolidin- 1- ylcarbonyl)phenylalaninate
Smiles: COC(=O)C(Cc1ccccc1)NC(=O)N1CCCC1

BBL033491
Synonyms: methylN- (piperidin- 1- ylcarbonyl)isoleucinate
Smiles: CCC(C(C(=O)OC)NC(=O)N1CCCCC1)C

BBL033492
Synonyms: methylN- [(3- methylbutyl)carbamoyl]isoleucinate
Smiles: CCC(C(C(=O)OC)NC(=O)NCCC(C)C)C

BBL033493
Synonyms: methylN- [(3- methylbutyl)carbamoyl]alaninate
Smiles: COC(=O)C(NC(=O)NCCC(C)C)C

BBL033494
Synonyms: methylN- (propan- 2- ylcarbamoyl)alaninate
Smiles: COC(=O)C(NC(=O)NC(C)C)C

BBL033495
Synonyms: 3- (3- aminophenyl)propanoate
Smiles: [O-]C(=O)CCc1cccc(c1)N

BBL033496
Synonyms: tert- butyl[6- (2- aminoethyl)- 2,2- dimethyl- 1,3- dioxan- 4- yl]acetate
Smiles: NCCC1CC(CC(=O)OC(C)(C)C)OC(O1)(C)C

BBL033501
Synonyms: 4H- 1,2,4- triazole- 3- carboxylicacid
Smiles: OC(=O)c1nnc[nH]1

BBL033502
Synonyms: methyltricyclo[3.3.1.1~3,7~]decane- 1- carboxylate
Smiles: COC(=O)C12CC3CC(C2)CC(C1)C3

BBL033504
Synonyms: N- (2- phenylethyl)prolinamide
Smiles: O=C(C1CCCN1)NCCc1ccccc1

BBL033507
Synonyms: 3- [(4S)- 1- benzyl- 2,5- dioxoimidazolidin- 4- yl]propanoicacid
Smiles: OC(=O)CC[C@@H]1NC(=O)N(C1=O)Cc1ccccc1

BBL033508
Synonyms: (2S)- 2- (1- oxo- 1,3- dihydro- 2H- isoindol- 2- yl)- 3- phenylpropanoicacid
Smiles: OC(=O)[C@@H](N1Cc2c(C1=O)cccc2)Cc1ccccc1

BBL033512
Synonyms: 1,5- anhydro- 2- deoxy- 3- C- methyl- D- erythro- pentitol
Smiles: O[C@@H]1COCC[C@]1(C)O

BBL033513
Synonyms: (4R)- 2- (2,3,4- trifluorophenyl)- 1,3- thiazolidine- 4- carboxylicacid
Smiles: OC(=O)[C@@H]1CSC(N1)c1ccc(c(c1F)F)F

BBL033514
Synonyms: (4R)- 2- (2- fluoro- 4- methoxyphenyl)- 1,3- thiazolidine- 4- carboxylicacid
Smiles: COc1ccc(c(c1)F)C1SC[C@H](N1)C(=O)O

BBL033515
Synonyms: (4R)- 2- (2,5- difluorophenyl)- 1,3- thiazolidine- 4- carboxylicacid
Smiles: OC(=O)[C@@H]1CSC(N1)c1cc(F)ccc1F

BBL033516
Synonyms: (2S)- 2- (1,3- dioxo- 1,3- dihydro- 2H- pyrrolo[3,4- c]pyridin- 2- yl)propanoicacid
Smiles: OC(=O)[C@@H](N1C(=O)c2c(C1=O)cncc2)C

BBL033517
Synonyms: androst- 4- ene- 3,17- dione
Smiles: O=C1CC[C@]2(C(=C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CCC2=O)C)C

BBL033518
Synonyms: (2S,5R)- 3,3- dimethyl- 7- oxo- 4- thia- 1- azabicyclo[3.2.0]heptane- 2- carboxylicacid4,4- dioxide
Smiles: OC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C

BBL033519
Synonyms: (1S,3R,4S,5R)- 1,3,4,5- tetrahydroxycyclohexanecarboxylicacid
Smiles: O[C@@H]1[C@H](O)C[C@@](C[C@H]1O)(O)C(=O)O

BBL033520
Synonyms: (8R,9S,10R,13S,14S,17R)- 3- methoxy- 10,13- dimethyl- 1,2,3',4',7,8,9,10,11,12,13,14,15,16- tetradecahydro- 5'H- spiro[cyclopenta[a]phenanthrene- 17,2'- furan]- 5'- one
Smiles: COC1=CC2=CC[C@@H]3[C@@H]([C@]2(CC1)C)CC[C@]1([C@H]3CC[C@]21CCC(=O)O2)C

BBL033521
Synonyms: (2S)- 2- (3,4- dimethoxyphenyl)- 5- hydroxy- 4- oxo- 3,4- dihydro- 2H- chromen- 7- yl6- O- (6- deoxy- alpha- L- glucopyranosyl)- beta- D- glucopyranoside
Smiles: COc1ccc(cc1OC)[C@@H]1CC(=O)c2c(O1)cc(cc2O)O[C@@H]1O[C@H](CO[C@@H]2O[C@@H](C)[C@@H]([C@H]([C@@H]2O)O)O)[C@H]([C@@H]([C@H]1O)O)O

BBL033522
Synonyms: (3S)- 6,7- dimethoxy- N- methyl- 1,2,3,4- tetrahydroisoquinoline- 3- carboxamide
Smiles: CNC(=O)[C@H]1NCc2c(C1)cc(c(c2)OC)OC

BBL033523
Synonyms: 1- isothiocyanatotricyclo[3.3.1.1~3,7~]decane
Smiles: S=C=NC12CC3CC(C2)CC(C1)C3

BBL033524
Synonyms: (2S)- 2- (1H- tetrazol- 1- yl)propanoicacid
Smiles: OC(=O)[C@@H](n1cnnn1)C

BBL033525
Synonyms: (2S)- 3- methyl- 2- (1H- tetrazol- 1- yl)butanoicacid
Smiles: CC([C@H](n1cnnn1)C(=O)O)C

BBL033526
Synonyms: (2S)- 4- methyl- 2- (1H- tetrazol- 1- yl)pentanoicacid
Smiles: CC(C[C@H](n1cnnn1)C(=O)O)C

BBL033527
Synonyms: (2S)- 3- methyl- 2- (1H- tetrazol- 1- yl)pentanoicacid
Smiles: CC[C@H]([C@H](n1cnnn1)C(=O)O)C

BBL033528
Synonyms: (2Z,4E)- 5- (furan- 2- yl)- 3- methylpenta- 2,4- dienoate
Smiles: [O-]C(=O)/C=C(\C=C\c1ccco1)/C

BBL033529
Synonyms: 17- hydroxypregn- 4- ene- 3,20- dione
Smiles: O=C1CCC2(C(=C1)CCC1C2CCC2(C1CCC2(O)C(=O)C)C)C

BBL033530
Synonyms: 1,3,3- trimethyl- 6- azabicyclo[3.2.1]octane
Smiles: CC1(C)CC2NCC(C1)(C2)C

BBL033531
Synonyms: (1- ethyl- 3,5- dimethyl- 1H- pyrazol- 4- yl)(phenyl)iodonium
Smiles: CCn1nc(c(c1C)[I+]c1ccccc1)C

BBL033532
Synonyms: methyl3- hydroxy- 1H- 1,2,4- triazole- 5- carboxylate
Smiles: COC(=O)c1nc(n[nH]1)O

BBL033533
Synonyms: 3- (4- methoxy- 1H- indol- 1- yl)propan- 1- amine
Smiles: NCCCn1ccc2c1cccc2OC

BBL033534
Synonyms: {[(2- aminophenyl)carbonyl]amino}acetate
Smiles: [O-]C(=O)CNC(=O)c1ccccc1N

BBL033535
Synonyms: [(cyclopropylcarbamoyl)amino](phenyl)aceticacid
Smiles: O=C(NC(c1ccccc1)C(=O)O)NC1CC1

BBL033536
Synonyms: (2E)- 3- (3- hydroxy- 1H- 1,2,4- triazol- 5- yl)prop- 2- enoicacid
Smiles: OC(=O)/C=C/c1[nH]nc(n1)O

BBL033537
Synonyms: 3- (5- sulfanyl- 1H- 1,2,4- triazol- 3- yl)propanoicacid
Smiles: OC(=O)CCc1n[nH]c(n1)S

BBL033538
Synonyms: ethyl5- (2- methylpropyl)- 1H- pyrazole- 3- carboxylate
Smiles: CCOC(=O)c1n[nH]c(c1)CC(C)C

BBL033539
Synonyms: [(morpholin- 4- ylcarbonyl)amino](phenyl)aceticacid
Smiles: O=C(N1CCOCC1)NC(c1ccccc1)C(=O)O

BBL033540
Synonyms: N- [(4- methylpiperazin- 1- yl)carbonyl]phenylalanine
Smiles: CN1CCN(CC1)C(=O)NC(C(=O)O)Cc1ccccc1

BBL033541
Synonyms: 3- (5- methoxy- 1H- indol- 1- yl)propan- 1- amine
Smiles: NCCCn1ccc2c1ccc(c2)OC

BBL033542
Synonyms: 1- [(3- aminophenyl)carbonyl]pyrrolidine- 2- carboxylate
Smiles: [O-]C(=O)C1CCCN1C(=O)c1cccc(c1)N

BBL033543
Synonyms: 3- (5- sulfanyl- 1H- 1,2,4- triazol- 3- yl)propanamide
Smiles: NC(=O)CCc1n[nH]c(n1)S

BBL033544
Synonyms: methyl[(cyclopropylcarbamoyl)amino](phenyl)acetate
Smiles: COC(=O)C(c1ccccc1)NC(=O)NC1CC1

BBL033545
Synonyms: N- (piperidin- 1- ylcarbonyl)isoleucine
Smiles: CCC(C(C(=O)O)NC(=O)N1CCCCC1)C

BBL033546
Synonyms: methyl3- (5- sulfanyl- 1H- 1,2,4- triazol- 3- yl)propanoate
Smiles: COC(=O)CCc1n[nH]c(n1)S

BBL033547
Synonyms: 2- cyclopropyl- 1H- benzimidazol- 5- amine
Smiles: Nc1ccc2c(c1)nc([nH]2)C1CC1

BBL033548
Synonyms: N- (pyrrolidin- 1- ylcarbonyl)phenylalanine
Smiles: OC(=O)C(Cc1ccccc1)NC(=O)N1CCCC1

BBL033549
Synonyms: [(tert- butylcarbamoyl)amino](phenyl)aceticacid
Smiles: O=C(NC(C)(C)C)NC(c1ccccc1)C(=O)O

BBL033550
Synonyms: 9,10,16- trihydroxyhexadecanoicacid
Smiles: OCCCCCCC(C(CCCCCCCC(=O)O)O)O

BBL033551
Synonyms: 17- cyano- 17- hydroxyandrost- 5- en- 3- ylacetate
Smiles: N#CC1(O)CCC2C1(C)CCC1C2CC=C2C1(C)CCC(C2)OC(=O)C

BBL033552
Synonyms: 3,7,12- trihydroxycholan- 24- oate
Smiles: OC1CCC2(C(C1)CC(C1C2CC(O)C2(C1CCC2C(CCC(=O)[O-])C)C)O)C

BBL033553
Synonyms: 4- [(3,3- dimethyloxiran- 2- yl)methyl]morpholine
Smiles: CC1(C)OC1CN1CCOCC1

BBL033554
Synonyms: N- [(3,3- dimethyloxiran- 2- yl)methyl]- N- ethylethanamine
Smiles: CCN(CC1OC1(C)C)CC

BBL033555
Synonyms: 6,6- dibromo- 3,3- dimethyl- 7- oxo- 4- thia- 1- azabicyclo[3.2.0]heptane- 2- carboxylate
Smiles: [O-]C(=O)C1N2C(=O)C(C2SC1(C)C)(Br)Br

BBL033556
Synonyms: 6,6- dibromo- 3,3- dimethyl- 7- oxo- 4- thia- 1- azabicyclo[3.2.0]heptane- 2- carboxylate4,4- dioxide
Smiles: [O-]C(=O)C1N2C(=O)C(C2S(=O)(=O)C1(C)C)(Br)Br

BBL033557
Synonyms: 2- (2- methoxyphenyl)- 1,3,3- trimethylbicyclo[2.2.1]heptan- 2- ol
Smiles: COc1ccccc1C1(O)C2(C)CCC(C1(C)C)C2

BBL033558
Synonyms: methylN- (3,4- dihydroisoquinolin- 2(1H)- ylcarbonyl)isoleucinate
Smiles: CCC(C(C(=O)OC)NC(=O)N1CCc2c(C1)cccc2)C

BBL033559
Synonyms: methylN- (3,4- dihydroisoquinolin- 2(1H)- ylcarbonyl)valinate
Smiles: COC(=O)C(C(C)C)NC(=O)N1CCc2c(C1)cccc2

BBL033560
Synonyms: 3,7- dihydroxycholan- 24- oicacid
Smiles: OC1CCC2(C(C1)CC(C1C2CCC2(C1CCC2C(CCC(=O)O)C)C)O)C

BBL033561
Synonyms: 8- (prop- 2- en- 1- yl)- 1,2,3,4- tetrahydroquinoline
Smiles: C=CCc1cccc2c1NCCC2

BBL033562
Synonyms: N- [(2- methylpropyl)carbamoyl]isoleucine
Smiles: CCC(C(C(=O)O)NC(=O)NCC(C)C)C

BBL033563
Synonyms: 5- (butan- 2- yl)- 3- (2- methylpropyl)imidazolidine- 2,4- dione
Smiles: CCC(C1NC(=O)N(C1=O)CC(C)C)C

BBL033564
Synonyms: N- (4- methoxybenzyl)glutamicacid
Smiles: COc1ccc(cc1)CNC(C(=O)O)CCC(=O)O

BBL033565
Synonyms: 5- (butan- 2- yl)- 3- cyclohexylimidazolidine- 2,4- dione
Smiles: CCC(C1NC(=O)N(C1=O)C1CCCCC1)C

BBL033566
Synonyms: 2,6- dichloro- 4- (4H- 1,2,4- triazol- 4- yl)aniline
Smiles: Clc1cc(cc(c1N)Cl)n1cnnc1

BBL033567
Synonyms: 2- (2- chlorobenzyl)- 1H- benzimidazol- 5- amine
Smiles: Nc1ccc2c(c1)nc([nH]2)Cc1ccccc1Cl

BBL033568
Synonyms: N- (4- methyl- 1,3- thiazol- 2- yl)glycinamide
Smiles: Cc1csc(n1)NC(=O)CN

BBL033569
Synonyms: N- (6- methoxy- 1,3- benzothiazol- 2- yl)glycinamide
Smiles: NCC(=O)Nc1nc2c(s1)cc(cc2)OC

BBL033570
Synonyms: N- 1,3- benzothiazol- 2- yl- beta- alaninamide
Smiles: NCCC(=O)Nc1nc2c(s1)cccc2

BBL033571
Synonyms: 1- [3- methoxy- 2- (propan- 2- yloxy)phenyl]methanamine
Smiles: NCc1cccc(c1OC(C)C)OC

BBL033572
Synonyms: 5- oxo- 4,5- dihydro- 1H- 1,2,4- triazole- 3- carboxylate
Smiles: [O-]C(=O)c1n[nH]c(=O)[nH]1

BBL033573
Synonyms: 2- (2- chlorobenzyl)- 1- methyl- 1H- benzimidazol- 5- amine
Smiles: Nc1ccc2c(c1)nc(n2C)Cc1ccccc1Cl

BBL033576
Synonyms: N- naphthalen- 2- yl- beta- alaninamide
Smiles: NCCC(=O)Nc1ccc2c(c1)cccc2

BBL033577
Synonyms: 2- (4- aminophenyl)- 1- (piperidin- 1- yl)ethanone
Smiles: O=C(N1CCCCC1)Cc1ccc(cc1)N

BBL033578
Synonyms: 1- (3,4- dimethoxyphenyl)- 2- methylpropan- 1- amine
Smiles: COc1cc(ccc1OC)C(C(C)C)N

BBL033579
Synonyms: 5- oxo- 1- [1- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)ethyl]pyrrolidine- 3- carboxylicacid
Smiles: OC(=O)C1CC(=O)N(C1)C(C12CC3CC(C2)CC(C1)C3)C

BBL033580
Synonyms: 6'- methoxycinchonan- 9- ol
Smiles: C=CC1CN2CCC1CC2C(c1ccnc2c1cc(OC)cc2)O

BBL033581
Synonyms: 1- ethyl- 5- methyl- 3,7- diazabicyclo[3.3.1]nonan- 9- one
Smiles: CCC12CNCC(C2=O)(CNC1)C

BBL033583
Synonyms: (2S)- 2- (4,5- dimethyl- 3- oxido- 1H- imidazol- 1- yl)pentanedioicacid
Smiles: [O-][n+]1cn(c(c1C)C)[C@H](C(=O)O)CCC(=O)O

BBL033584
Synonyms: (2S)- 5- amino- 2- (4,5- dimethyl- 3- oxido- 1H- imidazol- 1- yl)- 5- oxopentanoicacid
Smiles: [O-][n+]1cn(c(c1C)C)[C@H](C(=O)O)CCC(=O)N

BBL033585
Synonyms: [(4S)- 1- (4- methoxybenzyl)- 2,5- dioxoimidazolidin- 4- yl]aceticacid
Smiles: COc1ccc(cc1)CN1C(=O)N[C@H](C1=O)CC(=O)O

BBL033586
Synonyms: methyl(2S)- 2- (2,4- dioxo- 1,4- dihydroquinazolin- 3(2H)- yl)propanoate
Smiles: COC(=O)[C@@H](n1c(=O)[nH]c2c(c1=O)cccc2)C

BBL033587
Synonyms: N- {[4- (acetylamino)phenyl]sulfonyl}- L- tryptophan
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2

BBL033588
Synonyms: N- {[1- (tert- butoxycarbonyl)piperidin- 4- yl]carbonyl}- L- phenylalanine
Smiles: O=C(C1CCN(CC1)C(=O)OC(C)(C)C)N[C@H](C(=O)O)Cc1ccccc1

BBL033589
Synonyms: 1,5- dimethyl- 3- (propan- 2- yl)- 3,7- diazabicyclo[3.3.1]nonane
Smiles: CC(N1CC2(C)CNCC(C1)(C2)C)C

BBL033591
Synonyms: (3Z)- 3- [2- (2- bromo- 4- methylphenyl)hydrazinylidene]piperidin- 2- one
Smiles: Cc1ccc(c(c1)Br)N/N=C\1/CCCNC1=O

BBL033592
Synonyms: ethyl(2E)- 3- phenyl- 2- [(phenylcarbonyl)amino]prop- 2- enoate
Smiles: CCOC(=O)/C(=C\c1ccccc1)/NC(=O)c1ccccc1

BBL033593
Synonyms: (2S)- 2- (5,7- dioxo- 5,7- dihydro- 6H- pyrrolo[3,4- b]pyridin- 6- yl)propanoicacid
Smiles: OC(=O)[C@@H](N1C(=O)c2c(C1=O)nccc2)C

BBL033594
Synonyms: (4R)- 2- (4- hydroxy- 3,5- dimethoxyphenyl)- 1,3- thiazolidine- 4- carboxylicacid
Smiles: COc1cc(cc(c1O)OC)C1SC[C@H](N1)C(=O)O

BBL033595
Synonyms: (4R)- 2- (2,4,5- trimethoxyphenyl)- 1,3- thiazolidine- 4- carboxylicacid
Smiles: COc1cc(OC)c(cc1C1N[C@@H](CS1)C(=O)O)OC

BBL033596
Synonyms: (4R)- 2- (3- chloro- 4- hydroxyphenyl)- 1,3- thiazolidine- 4- carboxylicacid
Smiles: OC(=O)[C@@H]1CSC(N1)c1ccc(c(c1)Cl)O

BBL033597
Synonyms: (2S)- 2- (3- oxo- 1,2- benzothiazol- 2(3H)- yl)propanoicacid
Smiles: OC(=O)[C@@H](n1sc2c(c1=O)cccc2)C

BBL033598
Synonyms: (2S,5R)- 3- methyl- 7- oxo- 3- (1H- 1,2,3- triazol- 1- ylmethyl)- 4- thia- 1- azabicyclo[3.2.0]heptane- 2- carboxylicacid4,4- dioxide
Smiles: OC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)Cn1ccnn1

BBL033599
Synonyms: (1R,2R)- 1- methoxy- 2,3- dihydro- 1H- inden- 2- ol
Smiles: CO[C@H]1[C@H](O)Cc2c1cccc2

BBL033600
Synonyms: 1- [(2S)- 2- methyl- 3- sulfanylpropanoyl]- L- proline
Smiles: SC[C@H](C(=O)N1CCC[C@H]1C(=O)O)C

BBL033601
Synonyms: 5- methyl- 1,2,4,5- tetrahydrospiro[2- benzazepine- 3,1'- cycloheptane]
Smiles: CC1CC2(CCCCCC2)NCc2c1cccc2

BBL033602
Synonyms: 3,3,5,5- tetramethyl- 2,3,4,5- tetrahydro- 1H- 2- benzazepine
Smiles: CC1(C)NCc2c(C(C1)(C)C)cccc2

BBL033603
Synonyms: 5,7- dimethyl- 2- [4- (propan- 2- yl)phenyl]- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- amine
Smiles: CC(c1ccc(cc1)C1N2CC3(CN1CC(C2)(C3N)C)C)C

BBL033604
Synonyms: 2- (4- methoxyphenyl)- 5,7- dimethyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- amine
Smiles: COc1ccc(cc1)C1N2CC3(CN1CC(C2)(C3N)C)C

BBL033605
Synonyms: 5,7- dimethyl- 2- (1- methyl- 1H- indol- 3- yl)- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- amine
Smiles: NC1C2(C)CN3CC1(C)CN(C2)C3c1cn(c2c1cccc2)C

BBL033606
Synonyms: N- methyl- L- prolinamide
Smiles: CNC(=O)[C@@H]1CCCN1

BBL033607
Synonyms: 3- (diphenylmethoxy)- 8- methyl- 8- azabicyclo[3.2.1]octane
Smiles: CN1C2CCC1CC(C2)OC(c1ccccc1)c1ccccc1

BBL033608
Synonyms: (2S)- 2- (3- oxo- 1,2- benzothiazol- 2(3H)- yl)- 3- phenylpropanoicacid
Smiles: OC(=O)[C@@H](n1sc2c(c1=O)cccc2)Cc1ccccc1

BBL033609
Synonyms: (2S)- 3- methyl- 2- (3- oxo- 1,2- benzothiazol- 2(3H)- yl)butanoicacid
Smiles: CC([C@H](n1sc2c(c1=O)cccc2)C(=O)O)C

BBL033610
Synonyms: (2R)- (3- oxo- 1,2- benzothiazol- 2(3H)- yl)(phenyl)ethanoicacid
Smiles: OC(=O)[C@H](n1sc2c(c1=O)cccc2)c1ccccc1

BBL033611
Synonyms: (2S)- 4- methyl- 2- (3- oxo- 1,2- benzothiazol- 2(3H)- yl)pentanoicacid
Smiles: CC(C[C@H](n1sc2c(c1=O)cccc2)C(=O)O)C

BBL033612
Synonyms: 4- [(1- {[(3- carboxypropanoyl)oxy]methyl}- 1,4a- dimethyl- 6- methylidene- 5- [(E)- 2- (2- oxo- 2,5- dihydrofuran- 3- yl)ethenyl]decahydronaphthalen- 2- yl)oxy]- 4- oxobutanoate
Smiles: [O-]C(=O)CCC(=O)OC1CCC2(C(C1(C)COC(=O)CCC(=O)O)CCC(=C)C2/C=C/C1=CCOC1=O)C

BBL033613
Synonyms: 2- (2,4- dioxo- 1,4- dihydroquinazolin- 3(2H)- yl)propanoicacid
Smiles: OC(=O)C(n1c(=O)[nH]c2c(c1=O)cccc2)C

BBL033614
Synonyms: 4- (2- {2- ethyl- 5'- [6- hydroxy- 6- (hydroxymethyl)- 3,5- dimethyltetrahydro- 2H- pyran- 2- yl]- 3'- methyloctahydro- 2,2'- bifuran- 5- yl}- 9- hydroxy- 2,8- dimethyl- 1,6- dioxaspiro[4.5]dec- 7- yl)- 3- methoxy- 2- methylpentanoa
Smiles: COC(C(C1OC2(CCC(O2)(C)C2CCC(O2)(CC)C2OC(CC2C)C2OC(O)(CO)C(CC2C)C)CC(C1C)O)C)C(C(=O)[O-])C

BBL033615
Synonyms: 3,5- dimethyl- 1- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1H- pyrazol- 4- amine
Smiles: Cc1nn(c(c1N)C)C12CC3CC(C2)CC(C1)C3

BBL033616
Synonyms: [2- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 2H- tetrazol- 5- yl]aceticacid
Smiles: OC(=O)Cc1nnn(n1)C12CC3CC(C2)CC(C1)C3

BBL033617
Synonyms: N- tricyclo[3.3.1.1~3,7~]dec- 1- ylglycinamide
Smiles: NCC(=O)NC12CC3CC(C2)CC(C1)C3

BBL033618
Synonyms: 1- (propan- 2- ylsulfonyl)piperidin- 4- amine
Smiles: CC(S(=O)(=O)N1CCC(CC1)N)C

BBL033619
Synonyms: 6- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1,3- benzothiazol- 2- amine
Smiles: Nc1nc2c(s1)cc(cc2)C12CC3CC(C2)CC(C1)C3

BBL033620
Synonyms: 1- (2- amino- 7H- purin- 6- yl)piperidine- 4- carboxylicacid
Smiles: OC(=O)C1CCN(CC1)c1nc(N)nc2c1[nH]cn2

BBL033621
Synonyms: ethyl4- bromo- 5- (propan- 2- yl)- 1H- pyrazole- 3- carboxylate
Smiles: CCOC(=O)c1n[nH]c(c1Br)C(C)C

BBL033622
Synonyms: N~3~- methyl- N- pyridin- 3- yl- beta- alaninamide
Smiles: CNCCC(=O)Nc1cccnc1

BBL033623
Synonyms: ethyl4- bromo- 5- (2- methylpropyl)- 1H- pyrazole- 3- carboxylate
Smiles: CCOC(=O)c1n[nH]c(c1Br)CC(C)C

BBL033624
Synonyms: N- (2- chloro- 9H- purin- 6- yl)valine
Smiles: CC(C(C(=O)O)Nc1nc(Cl)nc2c1nc[nH]2)C

BBL033625
Synonyms: 4- chloro- 5- (3- methylbutyl)- 1H- pyrazole- 3- carboxylicacid
Smiles: CC(CCc1[nH]nc(c1Cl)C(=O)O)C

BBL033626
Synonyms: methyl4- bromo- 5- (3- chlorophenyl)- 1H- pyrazole- 3- carboxylate
Smiles: COC(=O)c1n[nH]c(c1Br)c1cccc(c1)Cl

BBL033627
Synonyms: N- (2- chloro- 9H- purin- 6- yl)phenylalanine
Smiles: OC(=O)C(Nc1nc(Cl)nc2c1nc[nH]2)Cc1ccccc1

BBL033628
Synonyms: N- (2- chloro- 9H- purin- 6- yl)alanine
Smiles: CC(C(=O)O)Nc1nc(Cl)nc2c1nc[nH]2

BBL033629
Synonyms: 4- chloro- 3- (3,5- dimethyl- 1H- pyrazol- 4- yl)aniline
Smiles: Nc1ccc(c(c1)c1c(C)n[nH]c1C)Cl

BBL033630
Synonyms: 2- chloro- 5- [(3,5- dimethyl- 1H- pyrazol- 1- yl)methyl]aniline
Smiles: Cc1nn(c(c1)C)Cc1ccc(c(c1)N)Cl

BBL033631
Synonyms: methyl4- bromo- 5- (propan- 2- yl)- 1H- pyrazole- 3- carboxylate
Smiles: COC(=O)c1n[nH]c(c1Br)C(C)C

BBL033632
Synonyms: N- (2- chloro- 9H- purin- 6- yl)isoleucine
Smiles: CC(C(C(=O)O)Nc1nc(Cl)nc2c1nc[nH]2)CC

BBL033633
Synonyms: [(2- chloro- 9H- purin- 6- yl)amino](phenyl)aceticacid
Smiles: OC(=O)C(c1ccccc1)Nc1nc(Cl)nc2c1nc[nH]2

BBL033634
Synonyms: 5- [4- (3- methylbutoxy)phenyl]- 1H- pyrazole- 3- carboxylicacid
Smiles: CC(CCOc1ccc(cc1)c1[nH]nc(c1)C(=O)O)C

BBL033635
Synonyms: 5- [4- (2- phenylethoxy)phenyl]- 1H- pyrazole- 3- carboxylicacid
Smiles: OC(=O)c1cc([nH]n1)c1ccc(cc1)OCCc1ccccc1

BBL033636
Synonyms: 5- bromo- 1H- 1,2,4- triazol- 3- ol
Smiles: Oc1n[nH]c(n1)Br

BBL033637
Synonyms: N- (2- chloro- 9H- purin- 6- yl)leucine
Smiles: CC(CC(C(=O)O)Nc1nc(Cl)nc2c1nc[nH]2)C

BBL033638
Synonyms: 5- (2,3- dihydro- 1- benzofuran- 5- yl)- 1H- pyrazole- 3- carboxylicacid
Smiles: OC(=O)c1n[nH]c(c1)c1ccc2c(c1)CCO2

BBL033639
Synonyms: N- (2- chloro- 9H- purin- 6- yl)methionine
Smiles: CSCCC(C(=O)O)Nc1nc(Cl)nc2c1nc[nH]2

BBL033640
Synonyms: 2- [3- (difluoromethoxy)phenyl]- 1,3- thiazolidine- 4- carboxylicacid
Smiles: FC(Oc1cccc(c1)C1SCC(N1)C(=O)O)F

BBL033641
Synonyms: 4- [(11,17- dihydroxy- 3,20- dioxopregn- 4- en- 21- yl)oxy]- 4- oxobutanoicacid
Smiles: OC(=O)CCC(=O)OCC(=O)C1(O)CCC2C1(C)CC(O)C1C2CCC2=CC(=O)CCC12C

BBL033642
Synonyms: 3,20- dioxopregn- 4- ene- 17,21- diyldiacetate
Smiles: CC(=O)OC1(CCC2C1(C)CCC1C2CCC2=CC(=O)CCC12C)C(=O)COC(=O)C

BBL033643
Synonyms: 11,17,21- trihydroxypregn- 4- ene- 3,20- dione
Smiles: OCC(=O)C1(O)CCC2C1(C)CC(O)C1C2CCC2=CC(=O)CCC12C

BBL033644
Synonyms: 17- hydroxy- 3- oxoandrost- 4- ene- 17- carbonitrile
Smiles: N#CC1(O)CCC2C1(C)CCC1C2CCC2=CC(=O)CCC12C

BBL033645
Synonyms: 10,13- dimethyl- 7,8,9,10,11,12,13,14,15,16- decahydrospiro[cyclopenta[a]phenanthrene- 17,2'- [1,3]dioxolan]- 3(6H)- one
Smiles: O=C1C=CC2(C(=C1)CCC1C2CCC2(C1CCC12OCCO1)C)C

BBL033646
Synonyms: 17- hydroxy- 3,11,20- trioxopregna- 1,4- dien- 21- ylacetate
Smiles: CC(=O)OCC(=O)C1(O)CCC2C1(C)CC(=O)C1C2CCC2=CC(=O)C=CC12C

BBL033647
Synonyms: 2- methoxy- 4- (5,5,6- trimethylbicyclo[2.2.1]hept- 2- yl)phenol
Smiles: COc1cc(ccc1O)C1CC2CC1C(C2(C)C)C

BBL033648
Synonyms: 7- hydroxy- 4- methyl- 8- [(propan- 2- ylamino)methyl]- 2H- chromen- 2- one
Smiles: CC(NCc1c(O)ccc2c1oc(=O)cc2C)C

BBL033649
Synonyms: estr- 4- ene- 3,17- dione
Smiles: O=C1CCC2C(=C1)CCC1C2CCC2(C1CCC2=O)C

BBL033650
Synonyms: 5- amino- 5- oxo- 2- (1- oxo- 1,3- dihydro- 2H- isoindol- 2- yl)pentanoicacid
Smiles: NC(=O)CCC(N1Cc2c(C1=O)cccc2)C(=O)O

BBL033651
Synonyms: 3- [1- (1,3- benzodioxol- 5- ylmethyl)- 2,5- dioxoimidazolidin- 4- yl]propanoicacid
Smiles: OC(=O)CCC1NC(=O)N(C1=O)Cc1ccc2c(c1)OCO2

BBL033652
Synonyms: N- 9H- purin- 6- ylalanine
Smiles: CC(C(=O)O)Nc1ncnc2c1nc[nH]2

BBL033653
Synonyms: N- 9H- purin- 6- ylvaline
Smiles: CC(C(C(=O)O)Nc1ncnc2c1nc[nH]2)C

BBL033654
Synonyms: N- 9H- purin- 6- ylmethionine
Smiles: CSCCC(C(=O)O)Nc1ncnc2c1nc[nH]2

BBL033655
Synonyms: N- 9H- purin- 6- ylisoleucine
Smiles: CC(C(C(=O)O)Nc1ncnc2c1nc[nH]2)CC

BBL033656
Synonyms: [(2- amino- 9H- purin- 6- yl)amino](phenyl)aceticacid
Smiles: OC(=O)C(c1ccccc1)Nc1nc(N)nc2c1nc[nH]2

BBL033657
Synonyms: [2,5- dioxo- 1- (2- phenylethyl)imidazolidin- 4- yl]aceticacid
Smiles: OC(=O)CC1NC(=O)N(C1=O)CCc1ccccc1

BBL033658
Synonyms: [1- (1,3- benzodioxol- 5- ylmethyl)- 2,5- dioxoimidazolidin- 4- yl]aceticacid
Smiles: OC(=O)CC1NC(=O)N(C1=O)Cc1ccc2c(c1)OCO2

BBL033659
Synonyms: {1- [2- (4- methoxyphenyl)ethyl]- 2,5- dioxoimidazolidin- 4- yl}aceticacid
Smiles: COc1ccc(cc1)CCN1C(=O)NC(C1=O)CC(=O)O

BBL033660
Synonyms: 3- [1- (3,4- dimethoxybenzyl)- 2,5- dioxoimidazolidin- 4- yl]propanoicacid
Smiles: COc1ccc(cc1OC)CN1C(=O)NC(C1=O)CCC(=O)O

BBL033661
Synonyms: 3- {1- [2- (4- methoxyphenyl)ethyl]- 2,5- dioxoimidazolidin- 4- yl}propanoicacid
Smiles: COc1ccc(cc1)CCN1C(=O)NC(C1=O)CCC(=O)O

BBL033662
Synonyms: 7- nitro- 2,3- dihydro- 1H- pyrrolo[2,1- c][1,4]benzodiazepine- 5,11(10H,11aH)- dione
Smiles: O=C1Nc2ccc(cc2C(=O)N2C1CCC2)[N+](=O)[O-]

BBL033663
Synonyms: 2- amino- 6- methyl- 5- (piperazin- 1- yl)pyrimidin- 4(3H)- one
Smiles: Cc1nc(N)[nH]c(=O)c1N1CCNCC1

BBL033664
Synonyms: phenyl(9H- purin- 6- ylamino)aceticacid
Smiles: OC(=O)C(c1ccccc1)Nc1ncnc2c1nc[nH]2

BBL033665
Synonyms: 1- [1- (2- aminoethyl)- 1H- benzimidazol- 2- yl]ethanol
Smiles: NCCn1c(nc2c1cccc2)C(O)C

BBL033666
Synonyms: 1- [3- (2- chlorophenyl)- 1,2,4- oxadiazol- 5- yl]- 3- (methylsulfanyl)propan- 1- amine
Smiles: CSCCC(c1onc(n1)c1ccccc1Cl)N

BBL033667
Synonyms: methyl(4- aminotetrahydro- 2H- thiopyran- 4- yl)acetate
Smiles: COC(=O)CC1(N)CCSCC1

BBL033668
Synonyms: 4- (3,5- dimethyl- 1H- pyrazol- 4- yl)- 3- methoxyaniline
Smiles: COc1cc(N)ccc1c1c(C)n[nH]c1C

BBL033669
Synonyms: 3,5- dichloro- 4- (1H- pyrazol- 1- yl)aniline
Smiles: Nc1cc(Cl)c(c(c1)Cl)n1cccn1

BBL033670
Synonyms: 4- nitrobenzylalaninate
Smiles: CC(C(=O)OCc1ccc(cc1)[N+](=O)[O-])N

BBL033671
Synonyms: 1,5- dimethyl- 3- (3- methylbutyl)- 3,7- diazabicyclo[3.3.1]nonane
Smiles: CC(CCN1CC2(C)CNCC(C1)(C2)C)C

BBL033672
Synonyms: 1,5- dimethyl- 3- (2- methylpropyl)- 3,7- diazabicyclo[3.3.1]nonane
Smiles: CC(CN1CC2(C)CNCC(C1)(C2)C)C

BBL033673
Synonyms: N- [4- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)phenyl]- beta- alaninamide
Smiles: NCCC(=O)Nc1ccc(cc1)C12CC3CC(C2)CC(C1)C3

BBL033676
Synonyms: (4R)- 2- (thiophen- 2- yl)- 1,3- thiazolidine- 4- carboxylicacid
Smiles: OC(=O)[C@@H]1CSC(N1)c1cccs1

BBL033678
Synonyms: 1- [4- (chloromethyl)- 1,3- thiazol- 2- yl]- N,N- dimethylmethanamine
Smiles: OCc1csc(n1)CN(C)C

BBL033679
Synonyms: 7- [(dimethylamino)methyl]- 2,2,4- trimethyl- 1,2,3,4- tetrahydroquinolin- 6- ol
Smiles: CN(Cc1cc2NC(C)(C)CC(c2cc1O)C)C

BBL033681
Synonyms: 6- fluoro- 2- (pyridin- 3- yl)quinoline- 4- carboxylicacid
Smiles: Fc1ccc2c(c1)c(cc(n2)c1cccnc1)C(=O)O

BBL033682
Synonyms: 8- methyl- 8- azabicyclo[3.2.1]octan- 3- one
Smiles: CN1C2CCC1CC(=O)C2

BBL033683
Synonyms: 11,17- dihydroxy- 3,20- dioxopregn- 4- en- 21- ylacetate
Smiles: CC(=O)OCC(=O)C1(O)CCC2C1(C)CC(O)C1C2CCC2=CC(=O)CCC12C

BBL033684
Synonyms: 1- (pyridin- 3- ylmethyl)piperazine
Smiles: N1CCN(CC1)Cc1cccnc1

BBL033685
Synonyms: 1- (1H- benzimidazol- 2- yl)- 2- methylpropan- 1- aminedihydrochloride
Smiles: NC(c1nc2c([nH]1)cccc2)C(C)C.Cl.Cl

BBL033686
Synonyms: (2R)- 2- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)propanoicacid
Smiles: OC(=O)[C@H](n1nnc2c(c1=O)cccc2)C

BBL033687
Synonyms: (3S)- 3- (butan- 2- yl)- 3,4- dihydro- 1H- 1,4- benzodiazepine- 2,5- dione
Smiles: CC[C@@H]([C@@H]1NC(=O)c2c(NC1=O)cccc2)C

BBL033688
Synonyms: 3- {(4S)- 1- [2- (1H- indol- 3- yl)ethyl]- 2,5- dioxoimidazolidin- 4- yl}propanoicacid
Smiles: OC(=O)CC[C@@H]1NC(=O)N(C1=O)CCc1c[nH]c2c1cccc2

BBL033690
Synonyms: (4R)- 2- (2- hydroxy- 3- methoxyphenyl)- 1,3- thiazolidine- 4- carboxylicacid
Smiles: COc1cccc(c1O)C1N[C@@H](CS1)C(=O)O

BBL033691
Synonyms: 2- [(2S)- 2- (pyridin- 3- yl)piperidin- 1- yl]ethanol
Smiles: OCCN1CCCC[C@H]1c1cccnc1

BBL033692
Synonyms: androsta- 1,4- diene- 3,17- dione
Smiles: O=C1C=C[C@]2(C(=C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CCC2=O)C)C

BBL033693
Synonyms: (8R,9S,10R,13S,14S,17R)- 10,13- dimethyl- 1,6,7,8,9,10,11,12,13,14,15,16- dodecahydro- 3'H- spiro[cyclopenta[a]phenanthrene- 17,2'- furan]- 3,5'(2H,4'H)- dione
Smiles: O=C1CC[C@]2(C(=C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@]12CCC(=O)O1)C)C

BBL033694
Synonyms: 4- oxo- 4- {[(5aS,6R,8aS,9R,10S,12R,12aR)- 3,6,9- trimethyldecahydro- 3,12- epoxy[1,2]dioxepino[4,3- i]isochromen- 10- yl]oxy}butanoicacid
Smiles: OC(=O)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@@H]4[C@]2([C@H]([C@H]1C)CC[C@H]4C)OO3

BBL033695
Synonyms: (5R,5aR,8aR,9R)- 9- hydroxy- 5- (3,4,5- trimethoxyphenyl)- 5,8,8a,9- tetrahydrofuro[3',4':6,7]naphtho[2,3- d][1,3]dioxol- 6(5aH)- one
Smiles: COc1cc(cc(c1OC)OC)[C@H]1[C@H]2C(=O)OC[C@@H]2[C@H](c2c1cc1OCOc1c2)O

BBL033696
Synonyms: (6R,7R)- 7- {[(2R)- 2- amino- 2- (4- hydroxyphenyl)acetyl]amino}- 3- methyl- 8- oxo- 5- thia- 1- azabicyclo[4.2.0]oct- 2- ene- 2- carboxylicacid
Smiles: O=C([C@@H](c1ccc(cc1)O)N)N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)O)C

BBL033697
Synonyms: (1S,2S)- 2- amino- 1- (4- aminophenyl)propane- 1,3- diol
Smiles: OC[C@@H]([C@H](c1ccc(cc1)N)O)N

BBL033698
Synonyms: (1S,2S)- 1- (4- aminophenyl)- 2- (dimethylamino)propane- 1,3- diol
Smiles: OC[C@@H]([C@H](c1ccc(cc1)N)O)N(C)C

BBL033699
Synonyms: 9- (2- deoxy- beta- D- glycero- pentofuranosyl)- 1,9- dihydro- 6H- purin- 6- one
Smiles: OCC1OC(CC1O)n1cnc2c1nc[nH]c2=O

BBL033700
Synonyms: (3S)- 6,7- dimethoxy- 1,2,3,4- tetrahydroisoquinoline- 3- carboxamide
Smiles: COc1cc2C[C@H](NCc2cc1OC)C(=O)N

BBL033701
Synonyms: 2- [(2- amino- 6- oxo- 1,6- dihydro- 9H- purin- 9- yl)methoxy]ethylL- valinate
Smiles: CC([C@@H](C(=O)OCCOCn1cnc2c1nc(N)[nH]c2=O)N)C

BBL033702
Synonyms: 3- chlorotricyclo[3.3.1.1~3,7~]decane- 1- carboxylicacid
Smiles: OC(=O)C12CC3CC(C1)CC(C2)(C3)Cl

BBL033703
Synonyms: 5- bromo- 2- (piperidin- 4- yloxy)pyridine
Smiles: Brc1ccc(nc1)OC1CCNCC1

BBL033704
Synonyms: 1- (4- fluoro- 2H- indazol- 3- yl)- 5- oxopyrrolidine- 3- carboxylicacid
Smiles: OC(=O)C1CC(=O)N(C1)c1[nH]nc2c1c(F)ccc2

BBL033705
Synonyms: 1- (2H- indazol- 3- yl)- 5- oxopyrrolidine- 3- carboxylicacid
Smiles: OC(=O)C1CC(=O)N(C1)c1[nH]nc2c1cccc2

BBL033706
Synonyms: 3,5- dimethyl- 1- (4H- 1,2,4- triazol- 3- yl)- 1H- pyrazol- 4- amine
Smiles: Cc1nn(c(c1N)C)c1nnc[nH]1

BBL033707
Synonyms: methyl4- bromo- 5- (4- methylphenyl)- 1H- pyrazole- 3- carboxylate
Smiles: COC(=O)c1n[nH]c(c1Br)c1ccc(cc1)C

BBL033708
Synonyms: (2- aminotricyclo[3.3.1.1~3,7~]dec- 2- yl)aceticacid
Smiles: OC(=O)CC1(N)C2CC3CC1CC(C2)C3

BBL033709
Synonyms: 2- [3- (phenoxymethyl)- 1,2,4- oxadiazol- 5- yl]ethanamine
Smiles: NCCc1onc(n1)COc1ccccc1

BBL033710
Synonyms: 1- quinolin- 5- ylguanidine
Smiles: NC(=N)Nc1cccc2c1cccn2

BBL033711
Synonyms: 4,6- diamino- 2- {[3- O- (2,6- diamino- 2,6- dideoxyhexopyranosyl)pentofuranosyl]oxy}- 3- hydroxycyclohexyl2,6- diamino- 2,6- dideoxyhexopyranoside
Smiles: OCC1OC(C(C1OC1OC(CN)C(C(C1N)O)O)O)OC1C(O)C(N)CC(C1OC1OC(CN)C(C(C1N)O)O)N

BBL033712
Synonyms: 3- {[2,6- dideoxyhexopyranosyl- (1- >4)- 2,6- dideoxyhexopyranosyl- (1- >4)- 2,6- dideoxyhexopyranosyl]oxy}- 12,14- dihydroxycard- 20(22)- enolide
Smiles: O=C1OCC(=C1)C1CCC2(C1(C)C(O)CC1C2CCC2C1(C)CCC(C2)OC1CC(O)C(C(O1)C)OC1CC(O)C(C(O1)C)OC1CC(O)C(C(O1)C)O)O

BBL033713
Synonyms: 3- oxo- 17- [(trimethylsilyl)oxy]androst- 4- ene- 17- carbonitrile
Smiles: N#CC1(CCC2C1(C)CCC1C2CCC2=CC(=O)CCC12C)O[Si](C)(C)C

BBL033714
Synonyms: pregn- 5- en- 20- yne- 3,17- diol
Smiles: C#CC1(O)CCC2C1(C)CCC1C2CC=C2C1(C)CCC(C2)O

BBL033715
Synonyms: 3- oxopregn- 4- en- 20- yn- 17- ylacetate
Smiles: C#CC1(CCC2C1(C)CCC1C2CCC2=CC(=O)CCC12C)OC(=O)C

BBL033716
Synonyms: 10,13- dimethyl- 17- [(trimethylsilyl)oxy]- 1,2,4,7,8,9,10,11,12,13,14,15,16,17- tetradecahydrospiro[cyclopenta[a]phenanthrene- 3,2'- [1,3]dioxolane]- 17- carbonitrile
Smiles: N#CC1(CCC2C1(C)CCC1C2CC=C2C1(C)CCC1(C2)OCCO1)O[Si](C)(C)C

BBL033717
Synonyms: 28- acetylspirosol- 5- en- 3- ylacetate
Smiles: CC1CCC2(N(C1)C(=O)C)OC1C(C2C)C2(C(C1)C1CC=C3C(C1CC2)(C)CCC(C3)OC(=O)C)C

BBL033718
Synonyms: N- [(2- phenylethyl)carbamoyl]phenylalanine
Smiles: O=C(NC(C(=O)O)Cc1ccccc1)NCCc1ccccc1

BBL033719
Synonyms: 4- (2- {[4- (4- hydroxyphenyl)butan- 2- yl]amino}ethyl)benzene- 1,2- diol
Smiles: CC(CCc1ccc(cc1)O)NCCc1ccc(c(c1)O)O

BBL033720
Synonyms: 7- [(6- methyl- 5,5- dioxido- 6,11- dihydrodibenzo[c,f][1,2]thiazepin- 11- yl)amino]heptanoate
Smiles: [O-]C(=O)CCCCCCNC1c2ccccc2N(S(=O)(=O)c2c1cccc2)C

BBL033721
Synonyms: 1- (3- methylbutyl)- 1H- indol- 4- amine
Smiles: CC(CCn1ccc2c1cccc2N)C

BBL033722
Synonyms: 2- methyl- 4,9- dihydro- 3H- beta- carbolin- 2- ium
Smiles: C[N+]1=Cc2c(CC1)c1c([nH]2)cccc1

BBL033723
Synonyms: octahydro- 2H- quinolizin- 1- ylmethanethiol
Smiles: SCC1CCCN2C1CCCC2

BBL033724
Synonyms: 6- [(8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl)carbonyl]cyclohex- 3- ene- 1- carboxylicacid
Smiles: O=C(C1CC=CCC1C(=O)O)N1CC2CC(C1)c1n(C2)c(=O)ccc1

BBL033725
Synonyms: 2- methyl- 5- {[(8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl)carbonyl]amino}benzoicacid
Smiles: O=C(N1CC2CC(C1)c1n(C2)c(=O)ccc1)Nc1ccc(c(c1)C(=O)O)C

BBL033726
Synonyms: 2- (2,5- dioxo- 2,5- dihydro- 1H- pyrrol- 1- yl)- 4- (methylsulfanyl)butanoicacid
Smiles: CSCCC(N1C(=O)C=CC1=O)C(=O)O

BBL033727
Synonyms: N- (2- amino- 9H- purin- 6- yl)alanine
Smiles: CC(C(=O)O)Nc1nc(N)nc2c1nc[nH]2

BBL033728
Synonyms: N- (2- amino- 9H- purin- 6- yl)valine
Smiles: CC(C(C(=O)O)Nc1nc(N)nc2c1nc[nH]2)C

BBL033729
Synonyms: N- (2- amino- 9H- purin- 6- yl)leucine
Smiles: CC(CC(C(=O)O)Nc1nc(N)nc2c1nc[nH]2)C

BBL033730
Synonyms: N- (2- amino- 9H- purin- 6- yl)methionine
Smiles: CSCCC(C(=O)O)Nc1nc(N)nc2c1nc[nH]2

BBL033731
Synonyms: N- (2- amino- 9H- purin- 6- yl)isoleucine
Smiles: CC(C(C(=O)O)Nc1nc(N)nc2c1nc[nH]2)CC

BBL033732
Synonyms: N- (2- amino- 9H- purin- 6- yl)phenylalanine
Smiles: OC(=O)C(Nc1nc(N)nc2c1nc[nH]2)Cc1ccccc1

BBL033733
Synonyms: [3,5- dimethyl- 1- (4H- 1,2,4- triazol- 3- yl)- 1H- pyrazol- 4- yl]aceticacid
Smiles: OC(=O)Cc1c(C)nn(c1C)c1nnc[nH]1

BBL033734
Synonyms: 4- methyl- 6- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1,3- benzothiazol- 2- amine
Smiles: Nc1nc2c(s1)cc(cc2C)C12CC3CC(C2)CC(C1)C3

BBL033735
Synonyms: 1- [2- (3- chloro- 1H- 1,2,4- triazol- 1- yl)ethyl]piperidine
Smiles: Clc1ncn(n1)CCN1CCCCC1

BBL033736
Synonyms: 4- {[3,5- dimethyl- 1- (4H- 1,2,4- triazol- 3- yl)- 1H- pyrazol- 4- yl]methyl}aniline
Smiles: Nc1ccc(cc1)Cc1c(C)nn(c1C)c1[nH]cnn1

BBL033737
Synonyms: 1,5- dioxo- 9- oxa- 2,4- diazaspiro[5.5]undec- 2- ene- 3- thiolate
Smiles: [S-]C1=NC(=O)C2(C(=O)N1)CCOCC2

BBL033738
Synonyms: N- [2- (3,5- dimethyl- 1H- pyrazol- 1- yl)ethyl]- beta- alanine
Smiles: Cc1cc(nn1CCNCCC(=O)O)C

BBL033739
Synonyms: N- [2- (1H- pyrazol- 1- yl)ethyl]- beta- alanine
Smiles: OC(=O)CCNCCn1cccn1

BBL033740
Synonyms: N- [2- (3- methyl- 1H- pyrazol- 1- yl)ethyl]- beta- alanine
Smiles: Cc1ccn(n1)CCNCCC(=O)O

BBL033741
Synonyms: N- [2- (5- methyl- 1H- pyrazol- 1- yl)ethyl]- beta- alanine
Smiles: OC(=O)CCNCCn1nccc1C

BBL033743
Synonyms: 7H- purine- 6- thiol
Smiles: Sc1ncnc2c1[nH]cn2

BBL033744
Synonyms: 1H- benzimidazol- 2- ylaceticacid
Smiles: OC(=O)Cc1nc2c([nH]1)cccc2

BBL033745
Synonyms: 3- aminotricyclo[3.3.1.1~3,7~]decane- 1- carboxylicacid
Smiles: OC(=O)C12CC3CC(C1)CC(C2)(C3)N

BBL033747
Synonyms: 8- methyl- 8- azabicyclo[3.2.1]oct- 3- yl3- hydroxy- 2- phenylpropanoate
Smiles: OCC(c1ccccc1)C(=O)OC1CC2CCC(C1)N2C

BBL033748
Synonyms: 5- oxo- 1- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)pyrrolidine- 3- carboxylicacid
Smiles: OC(=O)C1CC(=O)N(C1)C12CC3CC(C2)CC(C1)C3

BBL033750
Synonyms: 2- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1H- benzimidazole
Smiles: c1ccc2c(c1)[nH]c(n2)C12CC3CC(C2)CC(C1)C3

BBL033751
Synonyms: 3- methyl- 5- propylcyclohex- 2- en- 1- one
Smiles: CCCC1CC(=CC(=O)C1)C

BBL033752
Synonyms: 4- (1,3- dihydro- 2H- isoindol- 2- yl)benzoicacid
Smiles: OC(=O)c1ccc(cc1)N1Cc2c(C1)cccc2

BBL033753
Synonyms: 1- (1,4- dioxan- 2- yl)methanamine
Smiles: ClCC1COCCO1

BBL033754
Synonyms: (3R)- 3- [2- (methylsulfanyl)ethyl]- 3,4- dihydro- 1H- 1,4- benzodiazepine- 2,5- dione
Smiles: CSCC[C@H]1NC(=O)c2c(NC1=O)cccc2

BBL033755
Synonyms: 5- oxo- 5- [(1S,5S)- 8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl]pentanoicacid
Smiles: OC(=O)CCCC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1

BBL033756
Synonyms: 4- ({[(1S,5R)- 8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl]carbonyl}amino)benzoicacid
Smiles: O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Nc1ccc(cc1)C(=O)O

BBL033757
Synonyms: N- 9H- purin- 6- yl- L- tryptophan
Smiles: OC(=O)[C@@H](Nc1ncnc2c1nc[nH]2)Cc1c[nH]c2c1cccc2

BBL033758
Synonyms: 1,5- dimethyl- 3- (2- methylpropyl)- 3,7- diazabicyclo[3.3.1]nonan- 9- ol
Smiles: CC(CN1CC2(C)CNCC(C1)(C2O)C)C

BBL033759
Synonyms: 4- [(1R,4S)- bicyclo[2.2.1]hept- 2- yl]benzene- 1,2- diol
Smiles: Oc1ccc(cc1O)C1C[C@H]2C[C@@H]1CC2

BBL033760
Synonyms: 2- (1,7,7- trimethylbicyclo[2.2.1]hept- 2- yl)phenol
Smiles: Oc1ccccc1C1CC2C(C1(C)CC2)(C)C

BBL033761
Synonyms: 5,7- dimethyl- 2- (thiophen- 2- yl)- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- amine
Smiles: N[C@@H]1[C@]2(C)CN3C[C@@]1(C)CN(C2)C3c1cccs1

BBL033762
Synonyms: (5alpha)- pregnane- 3,11,20- trione
Smiles: O=C1CC[C@]2([C@H](C1)CC[C@@H]1[C@@H]2C(=O)C[C@]2([C@H]1CC[C@@H]2C(=O)C)C)C

BBL033763
Synonyms: 1- [(2R,5S)- 5- (hydroxymethyl)- 2,5- dihydrofuran- 2- yl]- 5- methylpyrimidine- 2,4(1H,3H)- dione
Smiles: Cc1cn([C@@H]2O[C@@H](C=C2)CO)c(=O)[nH]c1=O

BBL033764
Synonyms: 3'- azido- 3'- deoxythymidine
Smiles: OC[C@H]1O[C@H](C[C@@H]1N=[N+]=[N-])n1cc(C)c(=O)[nH]c1=O

BBL033765
Synonyms: 2'- deoxy- 5- fluorouridine
Smiles: OC[C@H]1O[C@H](C[C@@H]1O)n1cc(F)c(=O)[nH]c1=O

BBL033766
Synonyms: (3aS,6R)- 2- (3- methoxyphenyl)- 1- oxo- 1,2,3,6,7,7a- hexahydro- 3a,6- epoxyisoindole- 7- carboxylicacid
Smiles: COc1cccc(c1)N1C[C@@]23C(C1=O)C([C@@H](O3)C=C2)C(=O)O

BBL033767
Synonyms: N- 9H- purin- 6- yl- L- leucine
Smiles: CC(C[C@@H](C(=O)O)Nc1ncnc2c1nc[nH]2)C

BBL033768
Synonyms: N- 9H- purin- 6- yl- L- phenylalanine
Smiles: OC(=O)[C@@H](Nc1ncnc2c1nc[nH]2)Cc1ccccc1

BBL033769
Synonyms: 2- (2- iodo- 6- methoxyquinolin- 3- yl)- 5,7- dimethyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: COc1ccc2c(c1)cc(c(n2)I)C1N2CC3(CN1CC(C2)(C3=O)C)C

BBL033770
Synonyms: 2- (2- iodo- 7- methoxyquinolin- 3- yl)- 5,7- dimethyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- ol
Smiles: COc1ccc2c(c1)nc(c(c2)C1N2CC3(CN1CC(C2)(C3O)C)C)I

BBL033771
Synonyms: 2- (2- iodo- 7- methoxyquinolin- 3- yl)- 5,7- dimethyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decane
Smiles: COc1ccc2c(c1)nc(c(c2)C1N2CC3(CN1CC(C2)(C3)C)C)I

BBL033772
Synonyms: 2- (2- iodo- 6- methoxyquinolin- 3- yl)- 5,7- dimethyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decane
Smiles: COc1ccc2c(c1)cc(c(n2)I)C1N2CC3(CN1CC(C2)(C3)C)C

BBL033773
Synonyms: 2- (2- iodo- 7- methoxyquinolin- 3- yl)- 5,7- dimethyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: COc1ccc2c(c1)nc(c(c2)C1N2CC3(CN1CC(C2)(C3=O)C)C)I

BBL033774
Synonyms: 1- (3- hydroxyspirosol- 5- en- 28- yl)ethanone
Smiles: CC1CCC2(N(C1)C(=O)C)OC1C(C2C)C2(C(C1)C1CC=C3C(C1CC2)(C)CCC(C3)O)C

BBL033775
Synonyms: androstan- 17- one
Smiles: O=C1CCC2C1(C)CCC1C2CCC2C1(C)CCCC2

BBL033776
Synonyms: 17- oxoandrostan- 3- ylacetate
Smiles: CC(=O)OC1CCC2(C(C1)CCC1C2CCC2(C1CCC2=O)C)C

BBL033777
Synonyms: 17- hydroxy- 3,11,20- trioxopregnan- 21- ylacetate
Smiles: O=C1CCC2(C(C1)CCC1C2C(=O)CC2(C1CCC2(O)C(=O)COC(=O)C)C)C

BBL033778
Synonyms: (19E)- 3,5,14- trihydroxy- 19- (hydroxyimino)card- 20(22)- enolide
Smiles: O/N=C/C12CCC(CC2(O)CCC2C1CCC1(C2(O)CCC1C1=CC(=O)OC1)C)O

BBL033779
Synonyms: 1,1'- [4- ({5- deoxy- 2- O- [2- deoxy- 2- (methylamino)hexopyranosyl]- 3- C- (hydroxymethyl)pentofuranosyl}oxy)- 2,5,6- trihydroxycyclohexane- 1,3- diyl]diguanidine
Smiles: OCC1OC(OC2C(OC3C(O)C(O)C(C(C3NC(=N)N)O)NC(=N)N)OC(C2(O)CO)C)C(C(C1O)O)NC

BBL033780
Synonyms: 2- methyl- 4- (1,7,7- trimethylbicyclo[2.2.1]hept- 2- yl)phenol
Smiles: Oc1ccc(cc1C)C1CC2C(C1(C)CC2)(C)C

BBL033781
Synonyms: 6,7- dimethoxy- 2- (2- methoxy- 2- oxoethyl)- 3,4- dihydroisoquinolinium
Smiles: COC(=O)C[N+]1=Cc2c(CC1)cc(c(c2)OC)OC

BBL033782
Synonyms: 4- (methylsulfanyl)- 2- (1- oxo- 1,3- dihydro- 2H- isoindol- 2- yl)butanoicacid
Smiles: CSCCC(N1Cc2c(C1=O)cccc2)C(=O)O

BBL033783
Synonyms: 3- [(methylamino)acetyl]- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: CNCC(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1

BBL033784
Synonyms: methyl{[(8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl)carbonyl]amino}(phenyl)acetate
Smiles: COC(=O)C(c1ccccc1)NC(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1

BBL033785
Synonyms: 2- (2- iodoquinolin- 3- yl)- 5,7- dimethyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: O=C1C2(C)CN3CC1(C)CN(C2)C3c1cc2ccccc2nc1I

BBL033786
Synonyms: 2- (2- iodoquinolin- 3- yl)- 5,7- dimethyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decane
Smiles: Ic1nc2ccccc2cc1C1N2CC3(CN1CC(C2)(C3)C)C

BBL033787
Synonyms: 4- oxo- 4- [2- (pyridin- 3- yl)piperidin- 1- yl]butanoicacid
Smiles: OC(=O)CCC(=O)N1CCCCC1c1cccnc1

BBL033788
Synonyms: 4- (1H- benzimidazol- 2- yl)phenol
Smiles: Oc1ccc(cc1)c1nc2c([nH]1)cccc2

BBL033790
Synonyms: 1- (bicyclo[2.2.1]hept- 5- en- 2- yl)ethanone
Smiles: CC(=O)C1CC2CC1C=C2

BBL033791
Synonyms: 2- (hydroxymethyl)phenylhexopyranoside
Smiles: OCC1OC(Oc2ccccc2CO)C(C(C1O)O)O

BBL033793
Synonyms: L- prolyl- L- leucylglycinamide
Smiles: CC(C[C@@H](C(=O)NCC(=O)N)NC(=O)[C@@H]1CCCN1)C

BBL033794
Synonyms: 1- [N- (tert- butoxycarbonyl)- L- leucyl]piperidine- 4- carboxylicacid
Smiles: CC(C[C@@H](C(=O)N1CCC(CC1)C(=O)O)NC(=O)OC(C)(C)C)C

BBL033795
Synonyms: 2- ({[(1S,5R)- 8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl]carbonyl}amino)benzoicacid
Smiles: O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Nc1ccccc1C(=O)O

BBL033796
Synonyms: N- {[(1S,5R)- 8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl]carbonyl}- L- alanine
Smiles: C[C@@H](C(=O)O)NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1

BBL033797
Synonyms: sodium[(4- methyl- 2- oxo- 2H- chromen- 7- yl)amino]methanesulfonate
Smiles: O=c1cc(C)c2c(o1)cc(cc2)NCS(=O)(=O)[O-].[Na+]

BBL033798
Synonyms: N- ({1- [(4- methoxyphenyl)sulfonyl]piperidin- 3- yl}carbonyl)- L- alanine
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)N[C@H](C(=O)O)C

BBL033799
Synonyms: (6R,6aR,13S,13aS)- 1,3,4,6,6a,7,8,9,10,12,13,13a- dodecahydro- 2H- 6,13- methanodipyrido[1,2- a:3',2'- e]azocine
Smiles: C1CC[C@H]2N(C1)C[C@@H]1C[C@H]2C=C2[C@H]1NCCC2

BBL033800
Synonyms: [6'- hydroxy- 5,5'- bis(hydroxymethyl)- 2',5',8a'- trimethyldecahydro- 2'H,3H- spiro[furan- 2,1'- naphthalen]- 5- yl]acetate
Smiles: OCC1(CCC2(O1)C(C)CCC1C2(C)CCC(C1(C)CO)O)CC(=O)[O-]

BBL033801
Synonyms: 3- (1H- 1,2,4- triazol- 1- yl)tricyclo[3.3.1.1~3,7~]decan- 1- amine
Smiles: NC12CC3CC(C1)CC(C2)(C3)n1cncn1

BBL033802
Synonyms: 1- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1H- 1,2,4- triazol- 3- amine
Smiles: Nc1ncn(n1)C12CC3CC(C2)CC(C1)C3

BBL033803
Synonyms: 3- (5- methyl- 2H- tetrazol- 2- yl)tricyclo[3.3.1.1~3,7~]decan- 1- amine
Smiles: Cc1nnn(n1)C12CC3CC(C1)CC(C2)(C3)N

BBL033804
Synonyms: 3- (3- chloro- 1H- 1,2,4- triazol- 1- yl)tricyclo[3.3.1.1~3,7~]decan- 1- amine
Smiles: Clc1ncn(n1)C12CC3CC(C1)CC(C2)(C3)N

BBL033805
Synonyms: 5''- (hydroxymethyl)- 2'',5'',8a''- trimethyldodecahydro- 2''H- dispiro[furan- 3,2'- furan- 5',1''- naphthalen]- 6''- ol
Smiles: OCC1(C)C(O)CCC2(C1CCC(C12CCC2(O1)CCOC2)C)C

BBL033806
Synonyms: 4- [(3,20- dioxopregnan- 21- yl)oxy]- 4- oxobutanoicacid
Smiles: OC(=O)CCC(=O)OCC(=O)C1CCC2C1(C)CCC1C2CCC2C1(C)CCC(=O)C2

BBL033807
Synonyms: 1,4a,9a,10- tetrahydroanthracen- 9(4H)- one
Smiles: O=C1C2CC=CCC2Cc2c1cccc2

BBL033808
Synonyms: ethyl3- (4- chlorophenyl)- 2- methyloxirane- 2- carboxylate
Smiles: CCOC(=O)C1(C)OC1c1ccc(cc1)Cl

BBL033809
Synonyms: 6,6- dibromo- 3,3- dimethyl- 7- oxo- 4- thia- 1- azabicyclo[3.2.0]heptane- 2- carboxylate4- oxide
Smiles: [O-]C(=O)C1N2C(=O)C(C2S(=O)C1(C)C)(Br)Br

BBL033810
Synonyms: (2E,8E,10E,12E,14E)- 16- [(3- amino- 3,6- dideoxyhexopyranosyl)oxy]- 18,20,24- trihydroxy- 6- methyl- 4,22- dioxo- 5,27- dioxabicyclo[24.1.0]heptacosa- 2,8,10,12,14- pentaene- 19- carboxylicacid
Smiles: OC1CC(=O)CC(O)C(C(=O)O)C(O)CC(/C=C/C=C/C=C/C=C/CC(OC(=O)/C=C/C2C(C1)O2)C)OC1OC(C)C(C(C1O)N)O

BBL033811
Synonyms: (16Z,18E,28E)- 5,6,21,23- tetrahydroxy- 27- methoxy- 2,4,11,16,20,22,24,26- octamethyl- 1,15- dioxo- 1,2- dihydro- 2,7- (epoxypentadeca[1,11,13]trienoimino)furo[2'',3'':7',8']naphtho[1',2':4,5]imidazo[1,2- a]pyrid
Smiles: COC1/C=C/OC2(C)Oc3c(C2=O)c2c(c(c3C)O)c(O)c(c3c2nc2n3ccc(c2)C)NC(=O)/C(=C\C=C\C(C(C(C(C(C(C1C)OC(=O)C)C)O)C)O)C)/C

BBL033812
Synonyms: 4- amino- 2- (4,5- dimethyl- 3- oxido- 1H- imidazol- 1- yl)- 4- oxobutanoicacid
Smiles: [O-][n+]1cn(c(c1C)C)C(C(=O)O)CC(=O)N

BBL033813
Synonyms: 4- (2,3,4- trimethoxyphenyl)- 4,5,6,7- tetrahydro- 3H- imidazo[4,5- c]pyridine
Smiles: COc1c(OC)c(OC)ccc1C1NCCc2c1[nH]cn2

BBL033814
Synonyms: 5- hydroxy- 2- (3- hydroxy- 5- methoxyphenyl)- 4- oxo- 3,4- dihydro- 2H- chromen- 7- yl2- O- (6- deoxyhexopyranosyl)hexopyranoside
Smiles: OCC1OC(Oc2cc(O)c3c(c2)OC(CC3=O)c2cc(O)cc(c2)OC)C(C(C1O)O)OC1OC(C)C(C(C1O)O)O

BBL033815
Synonyms: 9- hydroxy- 5- (4- hydroxy- 3,5- dimethoxyphenyl)- 5,8,8a,9- tetrahydrofuro[3',4':6,7]naphtho[2,3- d][1,3]dioxol- 6(5aH)- one
Smiles: COc1cc(cc(c1O)OC)C1C2C(=O)OCC2C(c2c1cc1OCOc1c2)O

BBL033816
Synonyms: 5,7- dihydroxy- 2- (3,4,5- trihydroxyphenyl)- 3,4- dihydro- 2H- chromen- 3- yl3,4,5- trihydroxybenzoate
Smiles: Oc1cc(O)c2c(c1)OC(C(C2)OC(=O)c1cc(O)c(c(c1)O)O)c1cc(O)c(c(c1)O)O

BBL033817
Synonyms: 3- {[(8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl)carbonyl]amino}benzoicacid
Smiles: O=C(N1CC2CC(C1)c1n(C2)c(=O)ccc1)Nc1cccc(c1)C(=O)O

BBL033818
Synonyms: N- [(8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl)carbonyl]leucine
Smiles: CC(CC(C(=O)O)NC(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1)C

BBL033819
Synonyms: methyl1- {[(8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl)carbonyl]amino}cyclohexanecarboxylate
Smiles: COC(=O)C1(CCCCC1)NC(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1

BBL033820
Synonyms: methyl[(3,4,6,7,8,9,10,12,13,13a- decahydro- 2H- 6,13- methanodipyrido[1,2- a:3',2'- e]azocin- 1(6aH)- ylcarbonyl)amino](phenyl)acetate
Smiles: COC(=O)C(c1ccccc1)NC(=O)N1CCCC2=CC3CC(C12)CN1CCCCC31

BBL033821
Synonyms: methyl1- [(3,4,6,7,8,9,10,12,13,13a- decahydro- 2H- 6,13- methanodipyrido[1,2- a:3',2'- e]azocin- 1(6aH)- ylcarbonyl)amino]cyclohexanecarboxylate
Smiles: COC(=O)C1(CCCCC1)NC(=O)N1CCCC2=CC3CC(C12)CN1CCCCC31

BBL033822
Synonyms: {[(8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl)carbonyl]amino}(phenyl)aceticacid
Smiles: O=C(N1CC2CC(C1)c1n(C2)c(=O)ccc1)NC(c1ccccc1)C(=O)O

BBL033823
Synonyms: 1- {[(8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl)carbonyl]amino}cyclohexanecarboxylicacid
Smiles: O=C(N1CC2CC(C1)c1n(C2)c(=O)ccc1)NC1(CCCCC1)C(=O)O

BBL033824
Synonyms: methyl2- fluoro- 5- {[(8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl)carbonyl]amino}benzoate
Smiles: COC(=O)c1cc(ccc1F)NC(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1

BBL033825
Synonyms: N- [(5- ethyl- 8- oxo- 5,8- dihydro[1,3]dioxolo[4,5- g]quinolin- 7- yl)carbonyl]methionine
Smiles: CSCCC(C(=O)O)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1

BBL033826
Synonyms: 3- bromotricyclo[3.3.1.1~3,7~]decane- 1- carboxylicacid
Smiles: OC(=O)C12CC3CC(C1)CC(C2)(C3)Br

BBL033827
Synonyms: 6,8- dioxabicyclo[3.2.1]oct- 2- en- 4- one
Smiles: O=C1C=CC2OC1OC2

BBL033828
Synonyms: 1- cyclododecylethanone
Smiles: CC(=O)C1CCCCCCCCCCC1

BBL033829
Synonyms: N- ({1- [(4- fluorophenyl)sulfonyl]piperidin- 3- yl}carbonyl)- L- valine
Smiles: CC([C@@H](C(=O)O)NC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)F)C

BBL033830
Synonyms: 1- [1- (tert- butoxycarbonyl)- L- prolyl]piperidine- 4- carboxylicacid
Smiles: OC(=O)C1CCN(CC1)C(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C

BBL033831
Synonyms: 2,2,5,7- tetramethyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: O=C1C2(C)CN3CC1(C)CN(C2)C3(C)C

BBL033832
Synonyms: 1- acetyl- 2,3- dihydro- 1H- indole- 2- sulfonate
Smiles: CC(=O)N1c2ccccc2CC1S(=O)(=O)[O-]

BBL033833
Synonyms: (13bS)- 14- methyl- 8,13,13b,14- tetrahydroindolo[2',3':3,4]pyrido[2,1- b]quinazolin- 5(7H)- one
Smiles: O=C1c2ccccc2N([C@H]2N1CCc1c2[nH]c2c1cccc2)C

BBL033834
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NC(=O)C1CCCN(C1)S(=O)(=O)c1ccccc1)C

BBL033835
Synonyms: [(6- methoxy- 2- methylquinolin- 4- yl)sulfanyl]acetate
Smiles: COc1ccc2c(c1)c(SCC(=O)[O-])cc(n2)C

BBL033836
Synonyms: tert- butyl[(1S)- 1- {5- [(3- chlorobenzyl)sulfanyl]- 1,3,4- oxadiazol- 2- yl}- 2- phenylethyl]carbamate
Smiles: Clc1cccc(c1)CSc1nnc(o1)[C@@H](NC(=O)OC(C)(C)C)Cc1ccccc1

BBL033837
Synonyms: androst- 5- ene- 3,17- diol
Smiles: OC1CCC2(C(=CCC3C2CCC2(C3CCC2O)C)C1)C

BBL033838
Synonyms: 20- hydroxy- 6- oxocevan- 3- ylhexopyranoside
Smiles: OCC1OC(OC2CCC3(C(C2)C(=O)CC2C3CC3C2CCC2C3CN3CC(C)CCC3C2(C)O)C)C(C(C1O)O)O

BBL033839
Synonyms: ethyl5,5- dimethyl- 1,6- dioxaspiro[2.5]octane- 2- carboxylate
Smiles: CCOC(=O)C1OC21CCOC(C2)(C)C

BBL033840
Synonyms: 5- chloro- 17- [(4E)- 6,6- diphenylhex- 4- en- 2- yl]- 10,13- dimethylhexadecahydro- 1H- cyclopenta[a]phenanthren- 3- ylacetate(non- preferredname)
Smiles: CC(=O)OC1CCC2(C(C1)(Cl)CCC1C2CCC2(C1CCC2C(C/C=C/C(c1ccccc1)c1ccccc1)C)C)C

BBL033841
Synonyms: 3,20- dioxo- 16,17- epoxypregn- 4- en- 21- ylacetate
Smiles: CC(=O)OCC(=O)C12OC1CC1C2(C)CCC2C1CCC1=CC(=O)CCC21C

BBL033842
Synonyms: 6- chloro- 3,20- dioxopregna- 4,6- dien- 17- ylacetate
Smiles: O=C1CCC2(C(=C1)C(=CC1C2CCC2(C1CCC2(OC(=O)C)C(=O)C)C)Cl)C

BBL033843
Synonyms: 3,20- dioxopregna- 4,6- dien- 17- ylacetate
Smiles: O=C1CCC2(C(=C1)C=CC1C2CCC2(C1CCC2(OC(=O)C)C(=O)C)C)C

BBL033844
Synonyms: 3,12,14- trihydroxycard- 20(22)- enolide
Smiles: OC1CCC2(C(C1)CCC1C2CC(O)C2(C1(O)CCC2C1=CC(=O)OC1)C)C

BBL033845
Synonyms: 3- (aminoacetyl)- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: NCC(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1

BBL033846
Synonyms:
Smiles: CCCCCC(=O)OC1CC=[C]2(C(=CCC3C2CCC2(C3CC3C2C(C)C2(O3)CCC(CO2)C)C)C1)C

BBL033847
Synonyms: 8,9- dimethoxy- 2- (prop- 1- en- 2- yl)- 1,2,12,12a- tetrahydrochromeno[3,4- b]furo[2,3- h]chromen- 6(6aH)- one
Smiles: COc1cc2c(cc1OC)OCC1C2C(=O)c2c(O1)c1CC(Oc1cc2)C(=C)C

BBL033848
Synonyms: 4- amino- 3- {[3- amino- 6- (aminomethyl)- 3,4- dihydro- 2H- pyran- 2- yl]oxy}- 6- (ethylamino)- 2- hydroxycyclohexyl3- deoxy- 4- C- methyl- 3- (methylamino)pentopyranoside
Smiles: CCNC1CC(N)C(C(C1OC1OCC(C(C1O)NC)(C)O)O)OC1OC(=CCC1N)CN

BBL033849
Synonyms: (2aE,4E,8E)- 6'- (butan- 2- yl)- 20,20b- dihydroxy- 5',6,8,19- tetramethyl- 17- oxo- 5',6,6',10,11,14,15,17,17a,20,20a,20b- dodecahydro- 2H,7H- spiro[11,15- methanofuro[4,3,2- pq][2,6]benzodioxacyclooctadecine- 13,2'-
Smiles: CCC(C1OC2(C=CC1C)OC1C/C=C(\C)/C(OC3CC(OC)C(C(O3)C)OC3CC(OC)C(C(O3)C)NC(=O)C)C(C)/C=C/C=C\3/C4(C(C(=O)OC(C2)C1)C=C(C)C(C4OC3)O)O)C

BBL033850
Synonyms: estra- 1(10),2,4- triene- 3,16,17- triyltriacetate
Smiles: CC(=O)Oc1ccc2c(c1)CCC1C2CCC2(C1CC(C2OC(=O)C)OC(=O)C)C

BBL033851
Synonyms: 17- ethynyl- 17- hydroxyestr- 5(10)- en- 3- one
Smiles: C#CC1(O)CCC2C1(C)CCC1C2CCC2=C1CCC(=O)C2

BBL033852
Synonyms: 14- hydroxy- 21- oxo- 3,14,15,16,17,18,19,20- octadehydroyohimban- 5- carboxylicacid
Smiles: OC(=O)C1Cc2c3ccccc3[nH]c2c2n1c(=O)c1ccccc1c2O

BBL033853
Synonyms: 2,2- diphenyl- 2- (pyrrolidin- 3- yl)acetamide
Smiles: NC(=O)C(c1ccccc1)(c1ccccc1)C1CNCC1

BBL033854
Synonyms: 3- [(octahydro- 2H- quinolizin- 1- ylmethyl)sulfanyl]propanoicacid
Smiles: OC(=O)CCSCC1CCCN2C1CCCC2

BBL033855
Synonyms: N- (octahydro- 2H- quinolizin- 1- ylmethyl)propan- 2- amine
Smiles: CC(NCC1CCCN2C1CCCC2)C

BBL033856
Synonyms: 2- (cyclohex- 1- en- 1- yl)- 1,7,7- trimethylbicyclo[2.2.1]heptane
Smiles: CC1(C)C2CCC1(C)C(C2)C1=CCCCC1

BBL033857
Synonyms: N- [(1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydropyrimidin- 4- yl)methyl]alaninamide
Smiles: CC(C(=O)NCc1cc(=O)n(c(=O)n1C)C)N

BBL033858
Synonyms: lup- 20(29)- ene- 3,28- diol
Smiles: OCC12CCC(C2C2C(CC1)(C)C1(C)CCC3C(C1CC2)(C)CCC(C3(C)C)O)C(=C)C

BBL033859
Synonyms: 3- oxoandrost- 4- en- 17- yl4- methylpentanoate
Smiles: CC(CCC(=O)OC1CCC2C1(C)CCC1C2CCC2=CC(=O)CCC12C)C

BBL033860
Synonyms: N- acetyl- D- valine
Smiles: CC(=O)N[C@@H](C(=O)O)C(C)C

BBL033861
Synonyms: 2,2- dimethyl- 3- methylidenebicyclo[2.2.1]heptane
Smiles: C=C1C2CCC(C1(C)C)C2

BBL033862
Synonyms: PHBB_SC- 4793
Smiles: [O-]=[S+]1(=O)CCCC1

BBL033863
Synonyms: chromium(3+)tripyridine- 2- carboxylate
Smiles: [O-]C(=O)c1ccccn1.[O-]C(=O)c1ccccn1.[O-]C(=O)c1ccccn1.[Cr+3]

BBL033866
Synonyms:
Smiles: CCC([C@@H](C(=O)OC)NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)C

BBL033867
Synonyms: methyl3- ({[(1S,5S)- 8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl]carbonyl}amino)benzoate
Smiles: COC(=O)c1cccc(c1)NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1

BBL033868
Synonyms: methylN- {[(1S,5S)- 8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl]carbonyl}- L- alaninate
Smiles: COC(=O)[C@@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)C

BBL033869
Synonyms: ethyl(17E)- 3- (acetyloxy)- 20- cyanopregna- 5,17- dien- 21- oate
Smiles: CCOC(=O)/C(=C/1\CCC2C1(C)CCC1C2CC=C2C1(C)CCC(C2)OC(=O)C)/C#N

BBL033870
Synonyms: (2S)- 2- (4- hydroxyphthalazin- 1- yl)propanoicacid
Smiles: OC(=O)[C@H](c1nnc(c2c1cccc2)O)C

BBL033871
Synonyms: 4- amino- 1- [(2R,5S)- 2- (hydroxymethyl)- 1,3- oxathiolan- 5- yl]pyrimidin- 2(1H)- one
Smiles: Nc1ccn(c(=O)n1)[C@@H]1CS[C@@H](O1)CO

BBL033872
Synonyms: 7- [2- (4- fluorophenyl)- 3- phenyl- 4- (phenylcarbamoyl)- 5- (propan- 2- yl)- 1H- pyrrol- 1- yl]- 3,5- dihydroxyheptanoate
Smiles: OC(CC(CC(=O)[O-])O)CCn1c(C(C)C)c(c(c1c1ccc(cc1)F)c1ccccc1)C(=O)Nc1ccccc1

BBL033873
Synonyms: 3,19- dihydroxyandrost- 5- en- 17- one
Smiles: OCC12CCC(CC1=CCC1C2CCC2(C1CCC2=O)C)O

BBL033874
Synonyms: lanosta- 8,24- dien- 3- ol
Smiles: CC(=CCCC(C1CCC2(C1(C)CCC1=C2CCC2C1(C)CCC(C2(C)C)O)C)C)C

BBL033875
Synonyms: 3- (2- amino- 3- methylbutanoyl)- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: CC(C(C(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1)N)C

BBL033876
Synonyms: hexopyranosyl- (1- >3)hex- 2- ulofuranosylhexopyranoside
Smiles: OCC1OC(OC2C(O)C(OC2(CO)OC2OC(CO)C(C(C2O)O)O)CO)C(C(C1O)O)O

BBL033877
Synonyms: 3- methoxy- 17- methylmorphinan
Smiles: COc1ccc2c(c1)C13CCCCC3C(C2)N(CC1)C

BBL033878
Synonyms: 7,8,18,28,29,35,55,56,58- nonahydroxy- 30,54- bis(hydroxymethyl)- 13,18,37,41,48,48,53,54- octamethyl- 57- [(3,4,5- trihydroxytetrahydro- 2H- pyran- 2- yl)oxy]- 3,5,10,12,15,21,24,26,31,33- decaoxadecacyclo[39.9.3.
Smiles: OCC1OC2OC3C(O)CC4(C(C3(C)CO)CCC3(C4CC=C4C3(C)CCC3(C4CC(C)(C)CC3)C(=O)OC3OCC(C(C3OC3OC(C(OC(=O)CC(CC(=O)OC4COC(OC2C(C1O)O)C(O)C4O)(C)O)C(OC1OCC(C(C1O)O)O)C3O)C)O)O)C)C

BBL033879
Synonyms: 3- (2- chloropyrimidin- 4- yl)- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: Clc1nccc(n1)N1CC2CC(C1)c1n(C2)c(=O)ccc1

BBL033880
Synonyms: 2- [(octahydro- 2H- quinolizin- 1- ylmethyl)amino]ethanol
Smiles: OCCNCC1CCCN2C1CCCC2

BBL033881
Synonyms: 1- (piperazin- 1- ylmethyl)octahydro- 2H- quinolizine
Smiles: N1CCN(CC1)CC1CCCN2C1CCCC2

BBL033882
Synonyms: methyl4- [(3,4,6,7,8,9,10,12,13,13a- decahydro- 2H- 6,13- methanodipyrido[1,2- a:3',2'- e]azocin- 1(6aH)- ylcarbonyl)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)N1CCCC2=CC3CC(C12)CN1CCCCC31

BBL033883
Synonyms: methyl2- [(3,4,6,7,8,9,10,12,13,13a- decahydro- 2H- 6,13- methanodipyrido[1,2- a:3',2'- e]azocin- 1(6aH)- ylcarbonyl)amino]benzoate
Smiles: COC(=O)c1ccccc1NC(=O)N1CCCC2=CC3CC(C12)CN1CCCCC31

BBL033884
Synonyms: methylN- (3,4,6,7,8,9,10,12,13,13a- decahydro- 2H- 6,13- methanodipyrido[1,2- a:3',2'- e]azocin- 1(6aH)- ylcarbonyl)phenylalaninate
Smiles: COC(=O)C(NC(=O)N1CCCC2=CC3CC(C12)CN1CCCCC31)Cc1ccccc1

BBL033885
Synonyms: methyl4- {[(8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl)carbonyl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1

BBL033886
Synonyms: methyl2- {[(8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl)carbonyl]amino}benzoate
Smiles: COC(=O)c1ccccc1NC(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1

BBL033887
Synonyms: methylN- [(8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl)carbonyl]glycinate
Smiles: COC(=O)CNC(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1

BBL033888
Synonyms: methylN- [(8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl)carbonyl]leucinate
Smiles: COC(=O)C(NC(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1)CC(C)C

BBL033889
Synonyms: methylN- [(8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl)carbonyl]phenylalaninate
Smiles: COC(=O)C(NC(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1)Cc1ccccc1

BBL033890
Synonyms: methyl3- [(3,4,6,7,8,9,10,12,13,13a- decahydro- 2H- 6,13- methanodipyrido[1,2- a:3',2'- e]azocin- 1(6aH)- ylcarbonyl)amino]benzoate
Smiles: COC(=O)c1cccc(c1)NC(=O)N1CCCC2=CC3CC(C12)CN1CCCCC31

BBL033891
Synonyms: methylN- (3,4,6,7,8,9,10,12,13,13a- decahydro- 2H- 6,13- methanodipyrido[1,2- a:3',2'- e]azocin- 1(6aH)- ylcarbonyl)glycinate
Smiles: COC(=O)CNC(=O)N1CCCC2=CC3CC(C12)CN1CCCCC31

BBL033892
Synonyms: 7- methyloctahydro- 1,4- methanonaphthalen- 6(2H)- one
Smiles: CC1CC2C3CCC(C2CC1=O)C3

BBL033893
Synonyms: 8- methyl- 8- azabicyclo[3.2.1]octan- 3- ol
Smiles: OC1CC2CCC(C1)N2C

BBL033894
Synonyms: 9- methyl- 3- oxa- 9- azatricyclo[3.3.1.0~2,4~]non- 7- yl3- hydroxy- 2- phenylpropanoate
Smiles: OCC(c1ccccc1)C(=O)O[C@@H]1CC2N(C(C1)C1C2O1)C

BBL033895
Synonyms: methyl(5E)- 5- [(3S,4S)- 3- hydroxy- 4- [(phenylcarbonyl)amino]dihydrothiophen- 2(3H)- ylidene]pentanoate
Smiles: COC(=O)CCC/C=C\1/SC[C@H]([C@@H]1O)NC(=O)c1ccccc1

BBL033896
Synonyms: (1R,5S)- 3- (4- aminobutanoyl)- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: NCCCC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1

BBL033897
Synonyms: N- [(5- ethyl- 8- oxo- 5,8- dihydro[1,3]dioxolo[4,5- g]quinolin- 7- yl)carbonyl]- L- phenylalanine
Smiles: CCn1cc(C(=O)N[C@H](C(=O)O)Cc2ccccc2)c(=O)c2c1cc1OCOc1c2

BBL033898
Synonyms: N- [(5- ethyl- 8- oxo- 5,8- dihydro[1,3]dioxolo[4,5- g]quinolin- 7- yl)carbonyl]- L- alanine
Smiles: CCn1cc(C(=O)N[C@H](C(=O)O)C)c(=O)c2c1cc1OCOc1c2

BBL033899
Synonyms: N- [(5- ethyl- 8- oxo- 5,8- dihydro[1,3]dioxolo[4,5- g]quinolin- 7- yl)carbonyl]- L- leucine
Smiles: CCn1cc(C(=O)N[C@H](C(=O)O)CC(C)C)c(=O)c2c1cc1OCOc1c2

BBL033900
Synonyms: N- [(5- ethyl- 8- oxo- 5,8- dihydro[1,3]dioxolo[4,5- g]quinolin- 7- yl)carbonyl]- L- valine
Smiles: CCn1cc(C(=O)N[C@H](C(=O)O)C(C)C)c(=O)c2c1cc1OCOc1c2

BBL033901
Synonyms: (1R,5S)- 3- (piperidin- 4- ylcarbonyl)- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)C1CCNCC1

BBL033902
Synonyms: tert- butyl(2S)- 2- (5- sulfanyl- 1,3,4- oxadiazol- 2- yl)pyrrolidine- 1- carboxylate
Smiles: O=C(N1CCC[C@H]1c1nnc(o1)S)OC(C)(C)C

BBL033903
Synonyms: N- {[(1S,5R)- 8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl]carbonyl}- L- isoleucine
Smiles: CC[C@@H]([C@@H](C(=O)O)NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)C

BBL033904
Synonyms: 2- {N- [(2S)- 1- ethoxy- 1- oxo- 4- phenylbutan- 2- yl]alanyl}- 1,2,3,4- tetrahydroisoquinoline- 3- carboxylicacid
Smiles: CCOC(=O)[C@@H](NC(C(=O)N1Cc2ccccc2CC1C(=O)O)C)CCc1ccccc1

BBL033905
Synonyms: (1S,5S)- 3- [(2- aminoethyl)sulfonyl]- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: NCCS(=O)(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1

BBL033906
Synonyms: (1R,9aR)- octahydro- 2H- quinolizine- 1- carboxylicacid
Smiles: OC(=O)[C@@H]1CCCN2[C@@H]1CCCC2

BBL033907
Synonyms: tert- butyl2- [5- (methylsulfanyl)- 1,3,4- oxadiazol- 2- yl]pyrrolidine- 1- carboxylate
Smiles: CSc1nnc(o1)C1CCCN1C(=O)OC(C)(C)C

BBL033908
Synonyms: methyl3- hydroxychol- 5- en- 24- oate
Smiles: COC(=O)CCC(C1CCC2C1(C)CCC1C2CC=C2C1(C)CCC(C2)O)C

BBL033909
Synonyms: 4- methoxy- 3- {[2- (pyridin- 3- yl)piperidin- 1- yl]methyl}benzaldehyde
Smiles: O=Cc1ccc(c(c1)CN1CCCCC1c1cccnc1)OC

BBL033910
Synonyms: 3,17- dihydroxyandrostane- 17- carbonitrile
Smiles: N#CC1(O)CCC2C1(C)CCC1C2CCC2C1(C)CCC(C2)O

BBL033911
Synonyms: 17- cyano- 17- hydroxyandrostan- 3- ylacetate
Smiles: N#CC1(O)CCC2C1(C)CCC1C2CCC2C1(C)CCC(C2)OC(=O)C

BBL033912
Synonyms: cevane- 3,6,14- triol
Smiles: OC1CCC2(C(C1)C(O)CC1C2CC2C1(O)CCC1C2CN2CC(C)CCC2C1C)C

BBL033913
Synonyms: 17- hydroxyyohimban- 16- carboxylicacid
Smiles: OC(=O)C1C(O)CCC2C1CC1N(C2)CCc2c1[nH]c1c2cccc1

BBL033914
Synonyms: spirostan- 3,5- diol
Smiles: CC1CCC2(OC1)OC1C(C2C)C2(C(C1)C1CCC3(C(C1CC2)(C)CCC(C3)O)O)C

BBL033915
Synonyms: 3- [2- amino- 4- (methylsulfanyl)butanoyl]- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: CSCCC(C(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1)N

BBL033916
Synonyms: 5- [2- (furan- 3- yl)ethyl]- 1,4a- dimethyl- 6- methylidenedecahydronaphthalene- 1- carboxylicacid
Smiles: C=C1CCC2C(C1CCc1cocc1)(C)CCCC2(C)C(=O)O

BBL033917
Synonyms: 3,20- dihydroxycevan- 6- one
Smiles: OC1CCC2(C(C1)C(=O)CC1C2CC2C1CCC1C2CN2CC(C)CCC2C1(C)O)C

BBL033918
Synonyms: 2- (hydroxymethyl)- 6- imino- 2,3,3a,9a- tetrahydro- 6H- furo[2',3':4,5][1,3]oxazolo[3,2- a]pyrimidin- 3- ol
Smiles: OCC1OC2C(C1O)Oc1n2ccc(=N)n1

BBL033919
Synonyms: (1R,7aS)- hexahydro- 1H- pyrrolizin- 1- ylmethyl2,3- dihydroxy- 2- (propan- 2- yl)butanoate
Smiles: CC(C(C(=O)OC[C@@H]1CCN2[C@H]1CCC2)(C(O)C)O)C

BBL033920
Synonyms: 2- {(E)- [(4- chlorophenyl)imino]methyl}phenol
Smiles: Clc1ccc(cc1)/N=C/c1ccccc1O

BBL033922
Synonyms: (2S)- 5- hydroxy- 2- (3- hydroxy- 4- methoxyphenyl)- 4- oxo- 3,4- dihydro- 2H- chromen- 7- yl6- O- (6- deoxyhexopyranosyl)hexopyranoside
Smiles: COc1ccc(cc1O)[C@@H]1CC(=O)c2c(O1)cc(cc2O)OC1OC(COC2OC(C)C(C(C2O)O)O)C(C(C1O)O)O

BBL033923
Synonyms: 5,7- dibromoquinolin- 8- ol
Smiles: Brc1cc(Br)c2c(c1O)nccc2

BBL033925
Synonyms: guanosine
Smiles: OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1[nH]c(=N)[nH]c2=O

BBL033926
Synonyms: [2- (1,3- dioxolan- 2- yl)ethyl](triphenyl)phosphonium
Smiles: C1COC(O1)CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1

BBL033927
Synonyms: 5- (1,2- dihydroxyethyl)- 3,4- dihydroxydihydrofuran- 2(3H)- one(non- preferredname)
Smiles: OCC(C1OC(=O)C(C1O)O)O

BBL033928
Synonyms: cyclohexylcarbamodithioate
Smiles: [S-]C(=S)NC1CCCCC1

BBL033929
Synonyms: 2- sulfanylethanesulfonate
Smiles: SCCS(=O)(=O)[O-]

BBL033930
Synonyms: (4- methylphenyl)carbamodithioate
Smiles: [S-]C(=S)Nc1ccc(cc1)C

BBL033931
Synonyms: 1- chlorotricyclo[3.3.1.1~3,7~]decane
Smiles: ClC12CC3CC(C2)CC(C1)C3

BBL033932
Synonyms: 1,7,7- trimethylbicyclo[2.2.1]hept- 2- ylacetate
Smiles: CC(=O)OC1CC2C(C1(C)CC2)(C)C

BBL033933
Synonyms: 1H- benzimidazol- 2- amine
Smiles: Nc1nc2c([nH]1)cccc2

BBL033938
Synonyms: 5- nitropyrimidine- 2,4(1H,3H)- dione
Smiles: [O-][N+](=O)c1c[nH]c(=O)[nH]c1=O

BBL033940
Synonyms: tricyclo[3.3.1.1~3,7~]decan- 1- ol
Smiles: OC12CC3CC(C2)CC(C1)C3

BBL033941
Synonyms: bicyclo[2.2.1]hept- 2- ylaceticacid
Smiles: OC(=O)CC1CC2CC1CC2

BBL033942
Synonyms: 7- chloro- 4- (dimethylamino)- 3,6,10,12,12a- pentahydroxy- 6- methyl- 1,11- dioxo- 1,4,4a,5,5a,6,11,12a- octahydrotetracene- 2- carboxamide
Smiles: CN(C1C(=C(C(=O)N)C(=O)C2(C1CC1C(=C2O)C(=O)c2c(C1(C)O)c(Cl)ccc2O)O)O)C

BBL033943
Synonyms: (1R)- 3- [(2S)- 2- amino- 3- methylpentanoyl]- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: CC[C@@H]([C@@H](C(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)N)C

BBL033944
Synonyms: (1R,5R)- 3- [(2S)- 2- amino- 4- methylpentanoyl]- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: CC(C[C@@H](C(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)N)C

BBL033945
Synonyms: (1R,5S)- 3- [(2S)- 2- amino- 3- phenylpropanoyl]- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: N[C@H](C(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Cc1ccccc1

BBL033946
Synonyms: (1S,5S)- 3- (6- aminohexanoyl)- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: NCCCCCC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1

BBL033947
Synonyms: (1R,5S)- 3- (3- aminopropanoyl)- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: NCCC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1

BBL033948
Synonyms: (1S,5S)- 3- [(2S)- 2- aminopropanoyl]- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)[C@@H](N)C

BBL033949
Synonyms: tert- butyl[(1S)- 1- (5- sulfanyl- 1,3,4- oxadiazol- 2- yl)ethyl]carbamate
Smiles: C[C@@H](c1nnc(o1)S)NC(=O)OC(C)(C)C

BBL033950
Synonyms: 2- {[5- ({2- ({4,5- dihydroxy- 2- (hydroxymethyl)- 6- [(4a,5',6a,7- tetramethyldocosahydrospiro[naphtho[2',1':4,5]indeno[2,1- b]furan- 8,2'- pyran]- 2- yl)oxy]tetrahydro- 2H- pyran- 3- yl}oxy)- 5- hydroxy- 6- (hydroxymethy
Smiles: OCC1OC(OC2CCC3(C(C2)CCC2C3CCC3(C2CC2C3C(C)C3(O2)CCC(CO3)C)C)C)C(C(C1OC1OC(CO)C(C(C1OC1COC(C(C1OC1OC(CO)C(C(C1O)O)O)O)CO)OC1OCC(C(C1O)O)O)O)O)O

BBL033951
Synonyms: 1- (12a- bromo- 12- fluoro- 2- hydroxy- 4a,6a,8,8- tetramethylhexadecahydro- 6bH- naphtho[2',1':4,5]indeno[1,2- d][1,3]dioxol- 6b- yl)ethanone
Smiles: OC1CCC2(C(C1)(Br)C(F)CC1C2CCC2(C1CC1C2(OC(O1)(C)C)C(=O)C)C)C

BBL033952
Synonyms: 17- cyanoandrost- 5- en- 3- ylacetate
Smiles: N#CC1CCC2C1(C)CCC1C2CC=C2C1(C)CCC(C2)OC(=O)C

BBL033953
Synonyms: 1- (bromomethyl)octahydro- 2H- quinolizine
Smiles: BrCC1CCCN2C1CCCC2

BBL033954
Synonyms: ethyl2- methyl- 8- (1- methylpyrrolidin- 2- yl)imidazo[1,2- a]pyridine- 3- carboxylate
Smiles: CCOC(=O)c1c(C)nc2n1cccc2C1CCCN1C

BBL033955
Synonyms: 11,17,21- trihydroxy- 6- methylpregna- 1,4- diene- 3,20- dione
Smiles: OCC(=O)C1(O)CCC2C1(C)CC(O)C1C2CC(C2=CC(=O)C=CC12C)C

BBL033956
Synonyms: spirost- 5- en- 3,12- diol
Smiles: CC1CCC2(OC1)OC1C(C2C)C2(C(C1)C1CC=C3C(C1CC2O)(C)CCC(C3)O)C

BBL033957
Synonyms: 6,6- dimethyl- 2,3,6,7,12,12a- hexahydropyrazino[1',2':1,6]pyrido[3,4- b]indole- 1,4- dione
Smiles: O=C1NCC(=O)N2C1Cc1c3ccccc3[nH]c1C2(C)C

BBL033958
Synonyms: alanylphenylalanylleucylarginine
Smiles: CC(CC(C(=O)NC(C(=O)O)CCCNC(=N)N)NC(=O)C(Cc1ccccc1)NC(=O)C(N)C)C

BBL033959
Synonyms: 2- [(octahydro- 2H- quinolizin- 1- ylmethyl)sulfanyl]aniline
Smiles: Nc1ccccc1SCC1CCCN2C1CCCC2

BBL033960
Synonyms: 1,10- dimethoxy- 6- methyl- 5,6,6a,7- tetrahydro- 4H- dibenzo[de,g]quinoline- 2,9- diol
Smiles: COc1cc2c(cc1O)CC1c3c2c(OC)c(O)cc3CCN1C

BBL033961
Synonyms: 3,5,14,19- tetrahydroxycard- 20(22)- enolide
Smiles: OCC12CCC(CC2(O)CCC2C1CCC1(C2(O)CCC1C1=CC(=O)OC1)C)O

BBL033962
Synonyms: (3R,4R,5R,13aR,13bR)- 4,5- dihydroxy- 4,5- dimethyl- 3- (propan- 2- yl)- 4,5,8,10,12,13,13a,13b- octahydro- 2H- [1,6]dioxacycloundecino[2,3,4- gh]pyrrolizine- 2,6(3H)- dione
Smiles: CC([C@H]1C(=O)O[C@@H]2CCN3[C@@H]2C(=CC3)COC(=O)[C@]([C@]1(C)O)(C)O)C

BBL033963
Synonyms: (4S)- 4- ethyl- 4- hydroxy- 1H- pyrano[3',4':6,7]indolizino[1,2- b]quinoline- 3,14(4H,12H)- dione
Smiles: CC[C@@]1(O)C(=O)OCc2c1cc1c3nc4ccccc4cc3Cn1c2=O

BBL033964
Synonyms: (2S,3aS,6aS)- 1- [(2S)- 2- {[(2S)- 1- ethoxy- 1- oxo- 4- phenylbutan- 2- yl]amino}propanoyl]octahydrocyclopenta[b]pyrrole- 2- carboxylicacid(non- preferredname)
Smiles: CCOC(=O)[C@@H](N[C@H](C(=O)N1[C@H]2CCC[C@H]2C[C@H]1C(=O)O)C)CCc1ccccc1

BBL033965
Synonyms: 3- methoxy- 17- methyl- 7,8- didehydro- 4,5- epoxymorphinan- 6- ol
Smiles: COc1ccc2c3c1OC1C43CCN(C(C2)C4C=CC1O)C

BBL033966
Synonyms: 4- (hydroxymethyl)phenylhexopyranoside
Smiles: OCC1OC(Oc2ccc(cc2)CO)C(C(C1O)O)O

BBL033967
Synonyms: 1- (5- deoxypentofuranosyl)- 5- fluoropyrimidine- 2,4(1H,3H)- dione
Smiles: CC1OC(C(C1O)O)n1cc(F)c(=O)[nH]c1=O

BBL033968
Synonyms: 5- (4'- {[2- butyl- 4- chloro- 5- (hydroxymethyl)- 1H- imidazol- 1- yl]methyl}biphenyl- 2- yl)tetrazol- 1- ide
Smiles: CCCCc1nc(c(n1Cc1ccc(cc1)c1ccccc1c1[n-]nnn1)CO)Cl

BBL033969
Synonyms: (8xi,9xi,10xi,13xi,14xi)- 6- methyl- 3,20- dioxopregna- 4,6- dien- 17- ylacetate
Smiles: O=C1CCC2(C(=C1)C(=CC1C2CCC2(C1CC[C@]2(OC(=O)C)C(=O)C)C)C)C

BBL033970
Synonyms: tris(acetato- kappaO)(hydrido)borate(1- )
Smiles: CC(=O)O[B-](OC(=O)C)OC(=O)C

BBL033971
Synonyms: N- [(4- chlorophenyl)sulfonyl]- L- alanine
Smiles: C[C@@H](C(=O)O)NS(=O)(=O)c1ccc(cc1)Cl

BBL033972
Synonyms: N- [(4- fluorophenyl)sulfonyl]- L- valine
Smiles: CC([C@@H](C(=O)O)NS(=O)(=O)c1ccc(cc1)F)C

BBL033973
Synonyms: N~2~- [(benzyloxy)carbonyl]- L- asparagine
Smiles: O=C(N[C@H](C(=O)O)CC(=O)N)OCc1ccccc1

BBL033974
Synonyms: 2- (4- methoxyphenyl)hydrazinesulfonate
Smiles: COc1ccc(cc1)NNS(=O)(=O)[O-]

BBL033975
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NS(=O)(=O)c1ccccc1)C

BBL033976
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NS(=O)(=O)c1ccc(cc1)F)C

BBL033977
Synonyms: (1S,2S,4R)- 1,3,3- trimethylbicyclo[2.2.1]heptan- 2- ol
Smiles: O[C@H]1[C@@]2(C)CC[C@H](C1(C)C)C2

BBL033978
Synonyms: (4S)- 4- (prop- 1- en- 2- yl)cyclohex- 1- ene- 1- carbaldehyde
Smiles: O=CC1=CC[C@H](CC1)C(=C)C

BBL033979
Synonyms: 4,6,6- trimethylbicyclo[3.1.1]hept- 3- en- 2- one
Smiles: CC1=CC(=O)C2CC1C2(C)C

BBL033980
Synonyms: 5- formylfuran- 2- sulfonate
Smiles: O=Cc1ccc(o1)S(=O)(=O)[O-]

BBL033981
Synonyms: 3- [(2- O- hexopyranuronosylhexopyranuronosyl)oxy]- 11- oxoolean- 12- en- 29- oate
Smiles: OC1C(OC2OC(C(=O)O)C(C(C2O)O)O)C(OC(C1O)C(=O)O)OC1CCC2(C(C1(C)C)CCC1(C2C(=O)C=C2C1(C)CCC1(C2CC(C)(CC1)C(=O)[O-])C)C)C

BBL033982
Synonyms: cholest- 5- en- 3- ylchloroacetate
Smiles: ClCC(=O)OC1CCC2(C(=CCC3C2CCC2(C3CCC2C(CCCC(C)C)C)C)C1)C

BBL033983
Synonyms: strychnidin- 10- one
Smiles: O=C1CC2OCC=C3C4C2C2N1c1ccccc1C12CCN(C1C4)C3

BBL033984
Synonyms: 9- (5- O- phosphonopentofuranosyl)- 9H- purin- 6- amine
Smiles: OC1C(O)C(OC1n1cnc2c1ncnc2N)COP(=O)(O)O

BBL033985
Synonyms: pyrrolidine- 1- carbodithioate
Smiles: [S-]C(=S)N1CCCC1

BBL033986
Synonyms: 2- [(4S)- bicyclo[2.2.1]hept- 5- en- 2- yl]but- 3- yn- 2- ol
Smiles: CC(C#C)(C1CC2CC1C=C2)O

BBL033987
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NS(=O)(=O)c1ccc(cc1)Cl)C

BBL033989
Synonyms: 2,4,5,7,12b,12c- hexahydro- 1H- [1,3]dioxolo[4,5- j]pyrrolo[3,2,1- de]phenanthridine- 1,2- diol
Smiles: OC1C=C2CCN3C2C(C1O)c1cc2OCOc2cc1C3

BBL033990
Synonyms: 9- chloro- 5- (3,4,5- trimethoxyphenyl)- 5,8,8a,9- tetrahydrofuro[3',4':6,7]naphtho[2,3- d][1,3]dioxol- 6(5aH)- one
Smiles: COc1cc(cc(c1OC)OC)C1C2C(=O)OCC2C(c2c1cc1OCOc1c2)Cl

BBL033991
Synonyms: 8- methyl- 8- azabicyclo[3.2.1]oct- 3- yl1H- indole- 3- carboxylate
Smiles: CN1C2CCC1CC(C2)OC(=O)c1c[nH]c2c1cccc2

BBL033992
Synonyms: N- (phenylsulfonyl)- L- valine
Smiles: CC([C@@H](C(=O)O)NS(=O)(=O)c1ccccc1)C

BBL033993
Synonyms: N- [(4- methoxyphenyl)sulfonyl]- L- isoleucine
Smiles: CC[C@H]([C@@H](C(=O)O)NS(=O)(=O)c1ccc(cc1)OC)C

BBL033994
Synonyms: 2- (acetylamino)- 2- deoxy- D- glucose
Smiles: O=C[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)NC(=O)C

BBL033995
Synonyms: (5R)- 5- methyl- 2- (propan- 2- ylidene)cyclohexanone
Smiles: C[C@@H]1CCC(=C(C)C)C(=O)C1

BBL033996
Synonyms: (3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)- 6- {[(2S,3R,4S,6R)- 4- (dimethylamino)- 3- hydroxy- 6- methyltetrahydro- 2H- pyran- 2- yl]oxy}- 14- ethyl- 12,13- dihydroxy- 4- {[(2R,4R,5S,6S)- 5- hydroxy- 4- methoxy- 4,6- dimethyltetra
Smiles: CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(C(O2)C)O)C(C)C(OC2OC(C)CC(C2O)N(C)C)C(CC(C(=O)C(C(C1(C)O)O)C)C)(C)OC

BBL033997
Synonyms: (2S,5S)- 2- methyl- 5- (prop- 1- en- 2- yl)cyclohexanone
Smiles: CC(=C)[C@H]1CC[C@@H](C(=O)C1)C

BBL033998
Synonyms: (2Z)- 3- (propylsulfanyl)prop- 2- enoate
Smiles: [O-]C(=O)/C=C\SCCC

BBL033999
Synonyms: 2- (2,4,5,7- tetrabromo- 6- oxido- 3- oxo- 3H- xanthen- 9- yl)benzoate
Smiles: [O-]C(=O)c1ccccc1c1c2cc(Br)c(c(c2oc2c1cc(Br)c(=O)c2Br)Br)[O-]

BBL034000
Synonyms: 4- methylpiperazine- 1- carbodithioate
Smiles: CN1CCN(CC1)C(=S)[S-]

BBL034001
Synonyms: 2- [4- (dimethylamino)phenyl]- 3,6- dimethyl- 1,3- benzothiazol- 3- ium
Smiles: Cc1ccc2c(c1)sc([n+]2C)c1ccc(cc1)N(C)C

BBL034002
Synonyms: 1- (17- hydroxy- 10,13- dimethyl- 1,2,4,7,8,9,10,11,12,13,14,15,16,17- tetradecahydrospiro[cyclopenta[a]phenanthrene- 3,2'- [1,3]dioxolan]- 17- yl)ethanone
Smiles: CC(=O)C1(O)CCC2C1(C)CCC1C2CC=C2C1(C)CCC1(C2)OCCO1

BBL034003
Synonyms: 4,12,12- trimethyl- 9- methylidene- 5- oxatricyclo[8.2.0.0~4,6~]dodecane
Smiles: C=C1CCC2OC2(CCC2C1CC2(C)C)C

BBL034004
Synonyms: 3a,4,5,6,7,7a- hexahydro- 1H- 4,7- methanoinden- 6- ylpropanoate
Smiles: CCC(=O)OC1CC2CC1C1C2C=CC1

BBL034007
Synonyms: 5- (2,2- dimethyl- 1,3- dioxolan- 4- yl)- 2,2- dimethyltetrahydrofuro[2,3- d][1,3]dioxol- 6- ol(non- preferredname)
Smiles: OC1C(OC2C1OC(O2)(C)C)C1COC(O1)(C)C

BBL034008
Synonyms: 5- nitro- 2,6- dioxo- 1,2,3,6- tetrahydropyrimidine- 4- carboxylate
Smiles: [O-]C(=O)c1[nH]c(=O)[nH]c(=O)c1[N+](=O)[O-]

BBL034009
Synonyms: 4,5- dihydroxy- 1- phenylimidazolidine- 2- thione
Smiles: OC1C(O)NC(=S)N1c1ccccc1

BBL034010
Synonyms: 6- fluoro- 1- methyl- 7- {4- [(5- methyl- 2- oxo- 1,3- dioxol- 4- yl)methyl]piperazin- 1- yl}- 4- oxo- 4H- [1,3]thiazeto[3,2- a]quinoline- 3- carboxylicacid
Smiles: O=c1oc(c(o1)CN1CCN(CC1)c1cc2c(cc1F)c(=O)c(c1n2C(C)S1)C(=O)O)C

BBL034011
Synonyms: [(3S)- 3- {[(2S)- 1- ethoxy- 1- oxo- 4- phenylbutan- 2- yl]amino}- 2- oxo- 2,3,4,5- tetrahydro- 1H- 1- benzazepin- 1- yl]aceticacid
Smiles: CCOC(=O)[C@@H](N[C@H]1CCc2c(N(C1=O)CC(=O)O)cccc2)CCc1ccccc1

BBL034012
Synonyms: 20- ethyl- 16- methoxy- 4- methylaconitane- 1,8,14- triol
Smiles: CCN1CC2(C)CCC(C34C1C(CC23)C1(O)CC(C2CC4C1C2O)OC)O

BBL034013
Synonyms: 3,5- dihydroxy- 2- (4- hydroxyphenyl)- 8- (3- methylbut- 2- en- 1- yl)- 4- oxo- 3,4- dihydro- 2H- chromen- 7- ylhexopyranoside
Smiles: OCC1OC(Oc2cc(O)c3c(c2CC=C(C)C)OC(C(C3=O)O)c2ccc(cc2)O)C(C(C1O)O)O

BBL034014
Synonyms: N- [7- (acetylamino)- 1,2,3- trimethoxy- 9- oxo- 5,6,7,9- tetrahydrobenzo[a]heptalen- 10- yl]glycine
Smiles: COc1c2c(CCC(c3c2ccc(c(=O)c3)NCC(=O)O)NC(=O)C)cc(c1OC)OC

BBL034015
Synonyms: N- [7- (acetylamino)- 1,2,3- trimethoxy- 9- oxo- 5,6,7,9- tetrahydrobenzo[a]heptalen- 10- yl]alanine
Smiles: COc1c2c(CCC(c3c2ccc(c(=O)c3)NC(C(=O)O)C)NC(=O)C)cc(c1OC)OC

BBL034016
Synonyms: N- [7- (acetylamino)- 1,2,3- trimethoxy- 9- oxo- 5,6,7,9- tetrahydrobenzo[a]heptalen- 10- yl]valine
Smiles: COc1c2c(CCC(c3c2ccc(c(=O)c3)NC(C(=O)O)C(C)C)NC(=O)C)cc(c1OC)OC

BBL034017
Synonyms: N- [7- (acetylamino)- 1,2,3- trimethoxy- 9- oxo- 5,6,7,9- tetrahydrobenzo[a]heptalen- 10- yl]isoleucine
Smiles: CCC(C(C(=O)O)Nc1ccc2c(cc1=O)C(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C

BBL034018
Synonyms: N- [7- (acetylamino)- 1,2,3- trimethoxy- 9- oxo- 5,6,7,9- tetrahydrobenzo[a]heptalen- 10- yl]norleucine
Smiles: CCCCC(C(=O)O)Nc1ccc2c(cc1=O)C(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C

BBL034019
Synonyms: N- [7- (acetylamino)- 1,2,3- trimethoxy- 9- oxo- 5,6,7,9- tetrahydrobenzo[a]heptalen- 10- yl]methionine
Smiles: CSCCC(C(=O)O)Nc1ccc2c(cc1=O)C(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C

BBL034020
Synonyms: 2- {[7- (acetylamino)- 1,2,3- trimethoxy- 9- oxo- 5,6,7,9- tetrahydrobenzo[a]heptalen- 10- yl]amino}butanoicacid
Smiles: CCC(C(=O)O)Nc1ccc2c(cc1=O)C(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C

BBL034021
Synonyms: N- [7- (acetylamino)- 1,2,3- trimethoxy- 9- oxo- 5,6,7,9- tetrahydrobenzo[a]heptalen- 10- yl]norvaline
Smiles: CCCC(C(=O)O)Nc1ccc2c(cc1=O)C(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C

BBL034022
Synonyms: 4- {[7- (acetylamino)- 1,2,3- trimethoxy- 9- oxo- 5,6,7,9- tetrahydrobenzo[a]heptalen- 10- yl]amino}butanoicacid
Smiles: COc1cc2CCC(c3c(c2c(c1OC)OC)ccc(c(=O)c3)NCCCC(=O)O)NC(=O)C

BBL034023
Synonyms: 6- {[7- (acetylamino)- 1,2,3- trimethoxy- 9- oxo- 5,6,7,9- tetrahydrobenzo[a]heptalen- 10- yl]amino}hexanoicacid
Smiles: COc1c2c(CCC(c3c2ccc(c(=O)c3)NCCCCCC(=O)O)NC(=O)C)cc(c1OC)OC

BBL034024
Synonyms: N- [7- (acetylamino)- 1,2,3- trimethoxy- 9- oxo- 5,6,7,9- tetrahydrobenzo[a]heptalen- 10- yl]leucine
Smiles: COc1c2c(CCC(c3c2ccc(c(=O)c3)NC(C(=O)O)CC(C)C)NC(=O)C)cc(c1OC)OC

BBL034025
Synonyms: {[7- (acetylamino)- 1,2,3- trimethoxy- 9- oxo- 5,6,7,9- tetrahydrobenzo[a]heptalen- 10- yl]amino}(phenyl)aceticacid
Smiles: COc1cc2CCC(c3c(c2c(c1OC)OC)ccc(c(=O)c3)NC(c1ccccc1)C(=O)O)NC(=O)C

BBL034026
Synonyms: [1- ({[7- (acetylamino)- 1,2,3- trimethoxy- 9- oxo- 5,6,7,9- tetrahydrobenzo[a]heptalen- 10- yl]amino}methyl)cyclohexyl]aceticacid
Smiles: COc1cc2CCC(c3c(c2c(c1OC)OC)ccc(c(=O)c3)NCC1(CCCCC1)CC(=O)O)NC(=O)C

BBL034027
Synonyms: N- (10- hydroxy- 1,2,3- trimethoxy- 9- oxo- 5,6,7,9- tetrahydrobenzo[a]heptalen- 7- yl)acetamide
Smiles: COc1c(OC)cc2c(c1OC)c1ccc(c(=O)cc1C(CC2)NC(=O)C)O

BBL034028
Synonyms: (3aS,5aR,9R,9aS,9bS)- 9- hydroxy- 3,5a,9- trimethyl- 3a,5,5a,9,9a,9b- hexahydronaphtho[1,2- b]furan- 2,6(3H,4H)- dione
Smiles: C[C@@H]1C(=O)O[C@H]2[C@H]1CC[C@@]1([C@@H]2[C@](C)(O)C=CC1=O)C

BBL034029
Synonyms: 7- [(2- hydroxybenzyl)(methyl)amino]- 1,2,3,10- tetramethoxy- 6,7- dihydrobenzo[a]heptalen- 9(5H)- one
Smiles: COc1ccc2c(cc1=O)C(CCc1c2c(OC)c(c(c1)OC)OC)N(Cc1ccccc1O)C

BBL034030
Synonyms: 11- ethyl- 7,16- dihydroxy- 13- methyl- 6- methylidene- 11- azahexacyclo[7.7.2.1~5,8~.0~1,10~.0~2,8~.0~13,17~]nonadecan- 4- one(non- preferredname)
Smiles: CCN1CC2(C)CCC(C34C1C(CC23)C12C4CC(=O)C(C1)C(=C)C2O)O

BBL034031
Synonyms: 11- ethyl- 13- methyl- 6- methylidene- 11- azahexacyclo[7.7.2.1~5,8~.0~1,10~.0~2,8~.0~13,17~]nonadecane- 4,7,16- triol(non- preferredname)
Smiles: CCN1CC2(C)CCC(C34C1C(CC23)C12C4CC(C(C1)C(=C)C2O)O)O

BBL034032
Synonyms: 7,9a- dimethyl- 4- methylidenedecahydro- 3H- oxireno[7,8]naphtho[8a,1- b]furan- 3- one
Smiles: O=C1OC23C(C1=C)CCC(C2CCC1(C3O1)C)C

BBL034033
Synonyms: 6- [2- (furan- 3- yl)ethyl]- 6- hydroxy- 2a,5a,7- trimethyldecahydro- 2H- naphtho[1,8- bc]furan- 2- one
Smiles: CC1CC2OC(=O)C3(C2C(C1(O)CCc1cocc1)(C)CCC3)C

BBL034034
Synonyms: N- [4- (4- acetylpiperazin- 1- yl)phenyl]- 2- chloroacetamide
Smiles: ClCC(=O)Nc1ccc(cc1)N1CCN(CC1)C(=O)C

BBL034035
Synonyms: methyl2- (3- formyl- 2,5- dimethyl- 1H- pyrrol- 1- yl)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COC(=O)c1c(sc2c1CCCC2)n1c(C)cc(c1C)C=O

BBL034036
Synonyms: 2- {[(1- formylnaphthalen- 2- yl)oxy]methyl}benzonitrile
Smiles: N#Cc1ccccc1COc1ccc2c(c1C=O)cccc2

BBL034037
Synonyms: 1- (3- chloro- 4- methoxyphenyl)- 2,5- dimethyl- 1H- pyrrole- 3- carbaldehyde
Smiles: COc1ccc(cc1Cl)n1c(C)cc(c1C)C=O

BBL034038
Synonyms: 5- amino- 1- (4,6- dimethylpyrimidin- 2- yl)- 1H- pyrazole- 4- carboxamide
Smiles: Cc1cc(C)nc(n1)n1ncc(c1N)C(=O)N

BBL034039
Synonyms: 7- methyl- 7H- pyrazolo[3,4- d][1,2,3]triazin- 4- ol
Smiles: Cn1ncc2c1nnnc2O

BBL034040
Synonyms: 7- (4- methylphenyl)- 5- phenyl- 7H- pyrrolo[2,3- d][1,2,3]triazin- 4- ol
Smiles: Cc1ccc(cc1)n1cc(c2c1nnnc2O)c1ccccc1

BBL034041
Synonyms: N'- (2- chloropyrimidin- 4- yl)- 4- methylbenzohydrazide
Smiles: Cc1ccc(cc1)C(=O)NNc1ccnc(n1)Cl

BBL034042
Synonyms: 4- amino- 5- [(4- chloro- 3- methylphenoxy)methyl]- 4H- 1,2,4- triazole- 3- thiol
Smiles: Clc1ccc(cc1C)OCc1nnc(n1N)S

BBL034043
Synonyms: 2- {[4- formyl- 2- methoxy- 6- (prop- 2- en- 1- yl)phenoxy]methyl}benzonitrile
Smiles: C=CCc1cc(C=O)cc(c1OCc1ccccc1C#N)OC

BBL034044
Synonyms: 2- (hydroxymethyl)- 4,6- diiodophenol
Smiles: OCc1cc(I)cc(c1O)I

BBL034045
Synonyms: methyl2- (3- formyl- 2,5- dimethyl- 1H- pyrrol- 1- yl)- 4,5- dimethylthiophene- 3- carboxylate
Smiles: COC(=O)c1c(C)c(sc1n1c(C)cc(c1C)C=O)C

BBL034046
Synonyms: ethyl2- chloro- 5- [(chloroacetyl)amino]benzoate
Smiles: CCOC(=O)c1cc(ccc1Cl)NC(=O)CCl

BBL034047
Synonyms: methyl2- chloro- 5- [(chloroacetyl)amino]benzoate
Smiles: ClCC(=O)Nc1ccc(c(c1)C(=O)OC)Cl

BBL034048
Synonyms: N- (4- bromonaphthalen- 1- yl)- 2- chloroacetamide
Smiles: ClCC(=O)Nc1ccc(c2c1cccc2)Br

BBL034049
Synonyms: 5- (4- hydroxy- 3- nitrophenyl)furan- 2- carbaldehyde
Smiles: O=Cc1ccc(o1)c1ccc(c(c1)[N+](=O)[O-])O

BBL034050
Synonyms: 2- cyano- N- (pyrazin- 2- yl)acetamide
Smiles: C(C(=O)Nc1cnccn1)C#N

BBL034051
Synonyms: 3- oxo- 3- (10H- phenothiazin- 10- yl)propanenitrile
Smiles: N#CCC(=O)N1c2ccccc2Sc2c1cccc2

BBL034052
Synonyms: N'- (2- cyanoacetyl)naphthalene- 1- carbohydrazide
Smiles: N#CCC(=O)NNC(=O)c1cccc2c1cccc2

BBL034053
Synonyms: 2- (hydroxymethyl)- 4- iodo- 6- methylphenol
Smiles: OCc1cc(I)cc(c1O)C

BBL034054
Synonyms: 5- ethoxy- 2- hydroxy- 3- nitrobenzaldehyde
Smiles: CCOc1cc(C=O)c(c(c1)[N+](=O)[O-])O

BBL034055
Synonyms: 2- chloro- 1- {4- [2- nitro- 4- (trifluoromethyl)phenyl]piperazin- 1- yl}ethanone
Smiles: ClCC(=O)N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(F)F

BBL034056
Synonyms: (3- chloro- 4- nitrophenyl)(phenyl)methanone
Smiles: O=C(c1ccc(c(c1)Cl)[N+](=O)[O-])c1ccccc1

BBL034057
Synonyms: 2- (3,4- dihydro- 2H- 1,5- benzodioxepin- 7- yl)acetohydrazide
Smiles: NNC(=O)Cc1ccc2c(c1)OCCCO2

BBL034058
Synonyms: 2- (8- methyl- 3,4- dihydro- 2H- 1,5- benzodioxepin- 7- yl)acetohydrazide
Smiles: NNC(=O)Cc1cc2OCCCOc2cc1C

BBL034059
Synonyms: 4- (benzyloxy)- 3- methoxy- 5- nitrobenzaldehyde
Smiles: O=Cc1cc(OC)c(c(c1)[N+](=O)[O-])OCc1ccccc1

BBL034060
Synonyms: 3- methoxy- 4- [(2- methylnaphthalen- 1- yl)methoxy]benzaldehyde
Smiles: COc1cc(C=O)ccc1OCc1c(C)ccc2c1cccc2

BBL034061
Synonyms: 2- (benzyloxy)- 5- bromo- 3- methoxybenzaldehyde
Smiles: COc1cc(Br)cc(c1OCc1ccccc1)C=O

BBL034062
Synonyms: 4- formylphenyl3,4- dichlorobenzoate
Smiles: O=Cc1ccc(cc1)OC(=O)c1ccc(c(c1)Cl)Cl

BBL034063
Synonyms: 2,6- dichloro- 4- formylphenylbenzoate
Smiles: O=Cc1cc(Cl)c(c(c1)Cl)OC(=O)c1ccccc1

BBL034064
Synonyms: 4- ethoxy- 3- (prop- 2- en- 1- yloxy)benzaldehyde
Smiles: C=CCOc1cc(C=O)ccc1OCC

BBL034065
Synonyms: 4- methoxy- 2- (2- methoxyethoxy)benzaldehyde
Smiles: COCCOc1cc(OC)ccc1C=O

BBL034066
Synonyms: 4- (5- formylfuran- 2- yl)- 2- methylbenzoicacid
Smiles: O=Cc1ccc(o1)c1ccc(c(c1)C)C(=O)O

BBL034067
Synonyms: N- {[4- (5- formylfuran- 2- yl)phenyl]sulfonyl}acetamide
Smiles: O=Cc1ccc(o1)c1ccc(cc1)S(=O)(=O)NC(=O)C

BBL034068
Synonyms: 5- (2- hydroxy- 4- nitrophenyl)furan- 2- carbaldehyde
Smiles: O=Cc1ccc(o1)c1ccc(cc1O)[N+](=O)[O-]

BBL034069
Synonyms: 3,4- dimethyl- 5- nitroaniline
Smiles: Nc1cc(C)c(c(c1)[N+](=O)[O-])C

BBL034070
Synonyms: 2- chloro- N- (2- hydroxynaphthalen- 1- yl)acetamide
Smiles: ClCC(=O)Nc1c(O)ccc2c1cccc2

BBL034071
Synonyms: 2- chloro- N- (5,6,7,8- tetrahydronaphthalen- 2- yl)acetamide
Smiles: ClCC(=O)Nc1ccc2c(c1)CCCC2

BBL034072
Synonyms: 2- chloro- N- [2- (4- methylpiperazin- 1- yl)phenyl]acetamide
Smiles: ClCC(=O)Nc1ccccc1N1CCN(CC1)C

BBL034073
Synonyms: 3- {methyl[(4- methylphenyl)sulfonyl]amino}benzoicacid
Smiles: Cc1ccc(cc1)S(=O)(=O)N(c1cccc(c1)C(=O)O)C

BBL034074
Synonyms: N- (3- chloro- 4- methoxyphenyl)- N- (methylsulfonyl)alanine
Smiles: COc1ccc(cc1Cl)N(S(=O)(=O)C)C(C(=O)O)C

BBL034075
Synonyms: methyl5- nitro- 2- (prop- 2- en- 1- yloxy)benzoate
Smiles: C=CCOc1ccc(cc1C(=O)OC)[N+](=O)[O-]

BBL034076
Synonyms: 2,6- dibromo- 3- hydroxy- 4- methoxybenzaldehyde
Smiles: COc1cc(Br)c(c(c1O)Br)C=O

BBL034077
Synonyms: 2- {[(4- methylphenyl)sulfonyl]oxy}hexahydro- 1H- 4,7- epoxyisoindole- 1,3(2H)- dione
Smiles: O=C1C2C3CCC(C2C(=O)N1OS(=O)(=O)c1ccc(cc1)C)O3

BBL034078
Synonyms: methyl(2- ethoxy- 6- formylphenoxy)acetate
Smiles: CCOc1cccc(c1OCC(=O)OC)C=O

BBL034079
Synonyms: 2,3- dibromo- 4,5- dimethoxybenzaldehyde
Smiles: COc1cc(C=O)c(c(c1OC)Br)Br

BBL034080
Synonyms: 5- bromo- 4- (diethylamino)- 2- methoxybenzaldehyde
Smiles: CCN(c1cc(OC)c(cc1Br)C=O)CC

BBL034081
Synonyms: 2- cyano- N- [(3s,5s,7s)- tricyclo[3.3.1.1~3,7~]dec- 1- yl]acetamide
Smiles: N#CCC(=O)NC12C[C@@H]3C[C@H](C2)C[C@H](C1)C3

BBL034082
Synonyms: 1- {2- bromo- 4- [(3s,5s,7s)- tricyclo[3.3.1.1~3,7~]dec- 1- yl]phenyl}- 2,5- dimethyl- 1H- pyrrole- 3- carbaldehyde
Smiles: O=Cc1cc(n(c1C)c1ccc(cc1Br)C12C[C@@H]3C[C@H](C2)C[C@H](C1)C3)C

BBL034083
Synonyms: 2- (3- formyl- 2,5- dimethyl- 1H- pyrrol- 1- yl)- 4- methyl- 5- propylthiophene- 3- carbonitrile
Smiles: CCCc1sc(c(c1C)C#N)n1c(C)cc(c1C)C=O

BBL034084
Synonyms: 4- [(4- formyl- 2,6- diiodophenoxy)methyl]benzonitrile
Smiles: O=Cc1cc(I)c(c(c1)I)OCc1ccc(cc1)C#N

BBL034085
Synonyms: 2- [(2,4- dinitrobenzyl)oxy]- 3- methoxybenzaldehyde
Smiles: COc1cccc(c1OCc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])C=O

BBL034086
Synonyms: 4- [(chloroacetyl)amino]- 2- hydroxybenzoicacid
Smiles: ClCC(=O)Nc1ccc(c(c1)O)C(=O)O

BBL034087
Synonyms: 2- (chloroacetyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: ClCC(=O)N1C(=O)c2c(C1=O)cccc2

BBL034088
Synonyms: 2- bromo- 4- [(4- iodobenzyl)oxy]- 5- methoxybenzaldehyde
Smiles: COc1cc(C=O)c(cc1OCc1ccc(cc1)I)Br

BBL034089
Synonyms: 4- (diethylamino)- 2- [(4- iodobenzyl)oxy]benzaldehyde
Smiles: O=Cc1ccc(cc1OCc1ccc(cc1)I)N(CC)CC

BBL034090
Synonyms: (5E)- 5- [(dimethylamino)methylidene]- 1,4- dimethyl- 2,6- dioxo- 1,2,5,6- tetrahydropyridine- 3- carbonitrile
Smiles: N#CC1=C(C)/C(=C\N(C)C)/C(=O)N(C1=O)C

BBL034091
Synonyms: 3- (4- benzylpiperazin- 1- yl)- 3- oxopropanenitrile
Smiles: N#CCC(=O)N1CCN(CC1)Cc1ccccc1

BBL034092
Synonyms: 2- [(2- methyl- 5- nitrophenyl)amino]- 2- oxoethylthiocyanate
Smiles: [O-][N+](=O)c1cc(NC(=O)CSC#N)c(cc1)C

BBL034093
Synonyms: 2- [(3,5- difluorophenyl)amino]- 2- oxoethylthiocyanate
Smiles: N#CSCC(=O)Nc1cc(F)cc(c1)F

BBL034094
Synonyms: 5- (4- bromo- 3- chlorophenyl)furan- 2- carboxylicacid
Smiles: OC(=O)c1ccc(o1)c1ccc(c(c1)Cl)Br

BBL034095
Synonyms: 3- {[(3- chlorophenyl)carbamoyl]amino}benzoicacid
Smiles: O=C(Nc1cccc(c1)Cl)Nc1cccc(c1)C(=O)O

BBL034096
Synonyms: 1,3- dibromo- 2- chloro- 5- nitrobenzene
Smiles: [O-][N+](=O)c1cc(Br)c(c(c1)Br)Cl

BBL034097
Synonyms: 1- ({[(E)- 3,4- dihydro- 2H- chromen- 6- ylmethylidene]amino}oxy)ethanone
Smiles: CC(=O)O/N=C/c1ccc2c(c1)CCCO2

BBL034098
Synonyms: 2- (5- bromo- 2,3- dihydro- 1H- indol- 1- yl)- 2- oxoethylthiocyanate
Smiles: N#CSCC(=O)N1CCc2c1ccc(c2)Br

BBL034099
Synonyms: 4- (2,6- dibromo- 4- nitrophenyl)morpholine
Smiles: Brc1cc(cc(c1N1CCOCC1)Br)[N+](=O)[O-]

BBL034100
Synonyms: 4- (2- chlorobenzyl)- 2- (hydroxymethyl)- 6- nitrophenol
Smiles: OCc1cc(Cc2ccccc2Cl)cc(c1O)[N+](=O)[O-]

BBL034101
Synonyms: 3- [(2- chloro- 4- fluorobenzyl)sulfanyl]- 5- methyl- 4H- 1,2,4- triazol- 4- amine
Smiles: Fc1ccc(c(c1)Cl)CSc1nnc(n1N)C

BBL034102
Synonyms: 2- {4- [2- nitro- 4- (trifluoromethyl)phenyl]piperazin- 1- yl}- 2- oxoethylthiocyanate
Smiles: N#CSCC(=O)N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(F)F

BBL034103
Synonyms: 2,4- dibromo- 6- methoxyphenol
Smiles: COc1cc(Br)cc(c1O)Br

BBL034104
Synonyms: 2- [(9- ethyl- 9H- carbazol- 3- yl)amino]- 2- oxoethylthiocyanate
Smiles: N#CSCC(=O)Nc1ccc2c(c1)c1ccccc1n2CC

BBL034105
Synonyms: methyl4- [(thiocyanatoacetyl)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSC#N

BBL034106
Synonyms: 3- chloro- 6- hydroxy- 2,4- dimethyl- 5- nitrobenzaldehyde
Smiles: O=Cc1c(C)c(Cl)c(c(c1O)[N+](=O)[O-])C

BBL034107
Synonyms: 3- chloro- 5- (2- chlorobenzyl)- 2- hydroxybenzaldehyde
Smiles: O=Cc1cc(Cc2ccccc2Cl)cc(c1O)Cl

BBL034108
Synonyms: 5- [(dimethylamino)methylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)C(=CN(C)C)C(=O)N1

BBL034109
Synonyms: N- (3- cyano- 4,5,6,7,8,9- hexahydrocycloocta[b]thiophen- 2- yl)- 2- methylfuran- 3- carboxamide
Smiles: N#Cc1c(sc2c1CCCCCC2)NC(=O)c1ccoc1C

BBL034110
Synonyms: 5- (4- fluoro- 3- nitrophenyl)furan- 2- carbaldehyde
Smiles: O=Cc1ccc(o1)c1ccc(c(c1)[N+](=O)[O-])F

BBL034111
Synonyms: N- (2- bromo- 4,5- dimethylphenyl)- 2- (2- bromo- 6- ethoxy- 4- formylphenoxy)acetamide
Smiles: CCOc1cc(C=O)cc(c1OCC(=O)Nc1cc(C)c(cc1Br)C)Br

BBL034112
Synonyms: 2- (2- ethoxy- 4- formylphenoxy)- N- [3- (methylsulfanyl)phenyl]acetamide
Smiles: CCOc1cc(C=O)ccc1OCC(=O)Nc1cccc(c1)SC

BBL034113
Synonyms: 2- [(2- formyl- 4,6- diiodophenoxy)methyl]benzonitrile
Smiles: O=Cc1cc(I)cc(c1OCc1ccccc1C#N)I

BBL034114
Synonyms: N- (bicyclo[2.2.1]hept- 2- yl)- 2- chloroacetamide
Smiles: ClCC(=O)NC1CC2CC1CC2

BBL034115
Synonyms: ethyl(7- methyl- 4- oxo- 4,7- dihydro- 3H- pyrazolo[3,4- d][1,2,3]triazin- 3- yl)acetate
Smiles: CCOC(=O)Cn1nnc2c(c1=O)cnn2C

BBL034116
Synonyms: ethyl(4- oxo- 7- phenyl- 4,7- dihydro- 3H- pyrazolo[3,4- d][1,2,3]triazin- 3- yl)acetate
Smiles: CCOC(=O)Cn1nnc2c(c1=O)cnn2c1ccccc1

BBL034117
Synonyms: ethyl4- hydroxy- 5- methylthieno[2,3- d][1,2,3]triazine- 6- carboxylate
Smiles: CCOC(=O)c1sc2c(c1C)c(O)nnn2

BBL034118
Synonyms: 3- (3- benzyl[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl)aniline
Smiles: Nc1cccc(c1)c1sc2n(n1)c(nn2)Cc1ccccc1

BBL034119
Synonyms: 4- chloro- 2- {[(4- methylphenyl)sulfonyl]methyl}aniline
Smiles: Cc1ccc(cc1)S(=O)(=O)Cc1cc(Cl)ccc1N

BBL034120
Synonyms: 4- amino- 3- {[(4- methylphenyl)sulfonyl]methyl}phenol
Smiles: Cc1ccc(cc1)S(=O)(=O)Cc1cc(O)ccc1N

BBL034121
Synonyms: 3- amino- 2,3- dihydroquinazolin- 4(1H)- one
Smiles: NN1CNc2c(C1=O)cccc2

BBL034122
Synonyms: 5- (9,10- dioxo- 9,10- dihydroanthracen- 1- yl)furan- 2- carbaldehyde
Smiles: O=Cc1ccc(o1)c1cccc2c1C(=O)c1ccccc1C2=O

BBL034123
Synonyms: (3,4- dihydro- 2H- 1,5- benzodioxepin- 7- yloxy)aceticacid
Smiles: OC(=O)COc1ccc2c(c1)OCCCO2

BBL034124
Synonyms: N- (3- acetylphenyl)- 2- (2- ethoxy- 4- formylphenoxy)acetamide
Smiles: CCOc1cc(C=O)ccc1OCC(=O)Nc1cccc(c1)C(=O)C

BBL034125
Synonyms: (2E)- 2- (1H- benzimidazol- 2- yl)- 3- [2- (2- methylpropoxy)phenyl]prop- 2- enenitrile
Smiles: N#C/C(=C\c1ccccc1OCC(C)C)/c1nc2c([nH]1)cccc2

BBL034126
Synonyms: 2- chloro- N- (2- hydroxy- 3,4- dimethylphenyl)acetamide
Smiles: Cc1c(O)c(NC(=O)CCl)ccc1C

BBL034127
Synonyms: 2- chloro- N- (3- chloro- 2- hydroxyphenyl)acetamide
Smiles: ClCC(=O)Nc1cccc(c1O)Cl

BBL034128
Synonyms: 2- chloro- 1- (1- ethyl- 2- methyl- 1H- indol- 3- yl)ethanone
Smiles: ClCC(=O)c1c(C)n(c2c1cccc2)CC

BBL034129
Synonyms: 2- {[(6- methyl- 3- oxo- 2,3- dihydro- 4H- 1,4- benzoxazin- 4- yl)acetyl]amino}benzoicacid
Smiles: O=C(CN1C(=O)COc2c1cc(C)cc2)Nc1ccccc1C(=O)O

BBL034130
Synonyms: 3- methyl- 4- nitro- 1- phenyl- 1H- pyrazol- 5- ol
Smiles: [O-][N+](=O)c1c(C)nn(c1O)c1ccccc1

BBL034131
Synonyms: 2- {[(3- aminothieno[2,3- b]pyridin- 2- yl)carbonyl]amino}benzoicacid
Smiles: O=C(c1sc2c(c1N)cccn2)Nc1ccccc1C(=O)O

BBL034132
Synonyms: 3- {[(8- methoxy- 2- oxo- 2H- chromen- 3- yl)carbonyl]amino}benzoicacid
Smiles: COc1cccc2c1oc(=O)c(c2)C(=O)Nc1cccc(c1)C(=O)O

BBL034133
Synonyms: 2- [(2- ethoxyphenyl)carbonyl]hydrazinecarbothioamide
Smiles: CCOc1ccccc1C(=O)NNC(=S)N

BBL034134
Synonyms: N- (2- bromo- 5- methylphenyl)- 2- chloroacetamide
Smiles: Cc1cc(NC(=O)CCl)c(cc1)Br

BBL034135
Synonyms: 2- [(E)- (3- methyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]benzoicacid
Smiles: S=C1S/C(=C/c2ccccc2C(=O)O)/C(=O)N1C

BBL034136
Synonyms: 2- [(E)- (3- ethyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]benzoicacid
Smiles: CCN1C(=S)S/C(=C/c2ccccc2C(=O)O)/C1=O

BBL034137
Synonyms: 2- {(E)- [3- (carboxymethyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}benzoicacid
Smiles: OC(=O)CN1C(=S)S/C(=C/c2ccccc2C(=O)O)/C1=O

BBL034138
Synonyms: 4- {5- [(E)- (5- oxo- 2- thioxoimidazolidin- 4- ylidene)methyl]furan- 2- yl}benzoicacid
Smiles: S=C1NC(=O)/C(=C\c2ccc(o2)c2ccc(cc2)C(=O)O)/N1

BBL034139
Synonyms: 2- [(cyclopentylcarbonyl)amino]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylicacid
Smiles: O=C(C1CCCC1)Nc1sc2c(c1C(=O)O)CCCC2

BBL034140
Synonyms: (4- chloro- 1- oxophthalazin- 2(1H)- yl)aceticacid
Smiles: OC(=O)Cn1nc(Cl)c2c(c1=O)cccc2

BBL034141
Synonyms: 5- [(Z)- (2,4- dichlorophenyl)diazenyl]- 2- hydroxybenzaldehyde
Smiles: O=Cc1cc(/N=N\c2ccc(cc2Cl)Cl)ccc1O

BBL034142
Synonyms: (5E)- 5- (3,4- dihydro- 2H- chromen- 6- ylmethylidene)imidazolidine- 2,4- dione
Smiles: O=C1NC(=O)/C(=C\c2ccc3c(c2)CCCO3)/N1

BBL034143
Synonyms: (2E)- 2- (1H- benzimidazol- 2- yl)- 3- (3,4- dihydro- 2H- chromen- 6- yl)prop- 2- enenitrile
Smiles: N#C/C(=C\c1ccc2c(c1)CCCO2)/c1nc2c([nH]1)cccc2

BBL034144
Synonyms: 2- [(4- fluorobenzyl)oxy]- 4,6- dimethylpyridine- 3- carbonitrile
Smiles: N#Cc1c(C)cc(nc1OCc1ccc(cc1)F)C

BBL034145
Synonyms: 4- amino- 5- methylthieno[2,3- d]pyrimidine- 6- carbohydrazide
Smiles: NNC(=O)c1sc2c(c1C)c(N)ncn2

BBL034146
Synonyms: 1- [2- (7- fluoro- 3- methyl- 3,4- dihydroquinolin- 1(2H)- yl)- 2- oxoethyl]- 1H- indole- 3- carbaldehyde
Smiles: O=Cc1cn(c2c1cccc2)CC(=O)N1CC(C)Cc2c1cc(F)cc2

BBL034147
Synonyms: 1- (2- methoxyethyl)- 1H- indole- 2,3- dione
Smiles: COCCN1c2ccccc2C(=O)C1=O

BBL034148
Synonyms: (2E)- 1- (4- methylphenyl)- 3- [3- (prop- 2- en- 1- yloxy)phenyl]prop- 2- en- 1- one
Smiles: C=CCOc1cccc(c1)/C=C/C(=O)c1ccc(cc1)C

BBL034149
Synonyms: 3- {5- [(Z)- (2,5- dioxoimidazolidin- 4- ylidene)methyl]furan- 2- yl}benzoicacid
Smiles: O=C1N/C(=C\c2ccc(o2)c2cccc(c2)C(=O)O)/C(=O)N1

BBL034150
Synonyms: 4- {[(4- fluorophenyl)sulfanyl]methyl}benzonitrile
Smiles: N#Cc1ccc(cc1)CSc1ccc(cc1)F

BBL034151
Synonyms: 1- [2- (2- methyl- 2,3- dihydro- 1H- indol- 1- yl)- 2- oxoethyl]- 1H- indole- 3- carbaldehyde
Smiles: O=Cc1cn(c2c1cccc2)CC(=O)N1C(C)Cc2c1cccc2

BBL034152
Synonyms: (2E)- 1- (4- chlorophenyl)- 3- (2,5- dimethoxyphenyl)prop- 2- en- 1- one
Smiles: COc1ccc(cc1/C=C/C(=O)c1ccc(cc1)Cl)OC

BBL034153
Synonyms: (2E)- 3- [2- (benzyloxy)phenyl]- 1- (4- chlorophenyl)prop- 2- en- 1- one
Smiles: Clc1ccc(cc1)C(=O)/C=C/c1ccccc1OCc1ccccc1

BBL034154
Synonyms: (2E)- 1- (4- chlorophenyl)- 3- [4- (prop- 2- en- 1- yloxy)phenyl]prop- 2- en- 1- one
Smiles: C=CCOc1ccc(cc1)/C=C/C(=O)c1ccc(cc1)Cl

BBL034155
Synonyms: (2E)- 1- (4- chlorophenyl)- 3- [3- methoxy- 4- (prop- 2- en- 1- yloxy)phenyl]prop- 2- en- 1- one
Smiles: C=CCOc1ccc(cc1OC)/C=C/C(=O)c1ccc(cc1)Cl

BBL034156
Synonyms: methyl4- [(1E)- 3- (4- chlorophenyl)- 3- oxoprop- 1- en- 1- yl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=C/C(=O)c1ccc(cc1)Cl

BBL034157
Synonyms: (2E)- 3- (2,3- dimethoxyphenyl)- 1- (3- nitrophenyl)prop- 2- en- 1- one
Smiles: COc1c(cccc1OC)/C=C/C(=O)c1cccc(c1)[N+](=O)[O-]

BBL034158
Synonyms: (2E)- 3- (2,4- dimethoxyphenyl)- 1- (3- nitrophenyl)prop- 2- en- 1- one
Smiles: COc1ccc(c(c1)OC)/C=C/C(=O)c1cccc(c1)[N+](=O)[O-]

BBL034159
Synonyms: (2E)- 3- (2,3- dimethoxyphenyl)- 1- (4- fluorophenyl)prop- 2- en- 1- one
Smiles: COc1cccc(c1OC)/C=C/C(=O)c1ccc(cc1)F

BBL034160
Synonyms: (2E)- 1- (4- fluorophenyl)- 3- (3- methoxyphenyl)prop- 2- en- 1- one
Smiles: COc1cccc(c1)/C=C/C(=O)c1ccc(cc1)F

BBL034161
Synonyms: (2E)- 3- (2,5- dimethoxyphenyl)- 1- (4- fluorophenyl)prop- 2- en- 1- one
Smiles: COc1ccc(cc1/C=C/C(=O)c1ccc(cc1)F)OC

BBL034162
Synonyms: (2E)- 1- (4- fluorophenyl)- 3- [4- (prop- 2- en- 1- yloxy)phenyl]prop- 2- en- 1- one
Smiles: C=CCOc1ccc(cc1)/C=C/C(=O)c1ccc(cc1)F

BBL034163
Synonyms: (2E)- 1- (4- fluorophenyl)- 3- [3- methoxy- 4- (prop- 2- en- 1- yloxy)phenyl]prop- 2- en- 1- one
Smiles: C=CCOc1ccc(cc1OC)/C=C/C(=O)c1ccc(cc1)F

BBL034164
Synonyms: 2- {5- [(E)- (4H- 1,2,4- triazol- 4- ylimino)methyl]furan- 2- yl}benzoicacid
Smiles: OC(=O)c1ccccc1c1ccc(o1)/C=N/n1cnnc1

BBL034165
Synonyms: N- (2- chlorobenzyl)- 2- (3- formyl- 2- methyl- 1H- indol- 1- yl)acetamide
Smiles: O=Cc1c2ccccc2n(c1C)CC(=O)NCc1ccccc1Cl

BBL034166
Synonyms: N- tert- butyl- 2- (3- formyl- 2- methyl- 1H- indol- 1- yl)acetamide
Smiles: O=Cc1c(C)n(c2c1cccc2)CC(=O)NC(C)(C)C

BBL034167
Synonyms: N- (2,5- dimethoxyphenyl)- 2- (3- formyl- 1H- indol- 1- yl)acetamide
Smiles: COc1ccc(cc1NC(=O)Cn1cc(c2c1cccc2)C=O)OC