SMILES
stringlengths 2
786
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stringlengths 6
1.27k
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CN(C)c1ccc(/C=C(\NC(=O)c2ccccc2)C(=O)Nc2cccc(SCC(=O)c3ccc(Cl)cc3Cl)c2)cc1
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N-[(Z)-3-[3-[2-(2,4-dichlorophenyl)-2-oxoethyl]sulfanylanilino]-1-[4-(dimethylamino)phenyl]-3-oxoprop-1-en-2-yl]benzamide
|
CC(C(=O)NC1COC1)n1cccn1
|
N-(oxetan-3-yl)-2-pyrazol-1-ylpropanamide
|
N#C/C(=C/c1cccc(F)c1)c1nc(-c2cccs2)cs1
|
(Z)-3-(3-fluorophenyl)-2-(4-thiophen-2-yl-1,3-thiazol-2-yl)prop-2-enenitrile
|
C1=C2Cc3ccc4n3[C@@]35N2C(C1)Cc1ccc(n13)Cc1ccc(n15)C4
|
(1R)-2,22,23,25-tetrazaoctacyclo[11.9.1.11,8.13,21.02,6.016,23.018,22.011,25]pentacosa-3,5,8,10,13,15,18-heptaene
|
COC(=O)c1cc(OC)cc(N2CCC(NC(=O)OCc3ccccc3)C(OC)C2)c1
|
methyl 3-methoxy-5-[3-methoxy-4-(phenylmethoxycarbonylamino)piperidin-1-yl]benzoate
|
CCNC(=NCc1ccc(S(C)(=O)=O)cc1)NCCC(C)C
|
1-ethyl-3-(3-methylbutyl)-2-[(4-methylsulfonylphenyl)methyl]guanidine
|
CC[Si](C)=[Zr+2]
|
[ethyl(methyl)silylidene]zirconium(2+)
|
CCC1CCC2CC(c3ccc(-c4ccc(OCc5ccccc5)cc4)cc3)CCC2C1
|
2-ethyl-6-[4-(4-phenylmethoxyphenyl)phenyl]-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
|
CC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCC/C=C\C/C=C\C/C=C\CCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCC
|
[2-henicosanoyloxy-3-[(8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoyl]oxypropyl] (14Z,17Z,20Z)-octacosa-14,17,20-trienoate
|
Cc1ccc(Oc2ccc(Cl)cc2NCC(=O)N[C@H]2CCS(=O)(=O)C2)cc1
|
2-[5-chloro-2-(4-methylphenoxy)anilino]-N-[(3S)-1,1-dioxothiolan-3-yl]acetamide
|
O=C(OCc1ccccc1)N1c2ccccc2C(=O)C12CCCC2
|
benzyl 3'-oxospiro[cyclopentane-1,2'-indole]-1'-carboxylate
|
CC1CCCN(C(N)=NCCOc2ccc(F)c(F)c2)C1
|
N'-[2-(3,4-difluorophenoxy)ethyl]-3-methylpiperidine-1-carboximidamide
|
Nc1ncccc1Nc1ccccc1
|
3-N-phenylpyridine-2,3-diamine
|
CCN(CC)C(=O)Oc1c(C)cc([S+](c2ccccc2)c2ccccc2)cc1C.[O-]OOSC(F)(F)C(F)(F)OCc1ccc2ccccc2c1
|
[4-(diethylcarbamoyloxy)-3,5-dimethylphenyl]-diphenylsulfanium;2-[(1,1,2,2-tetrafluoro-2-oxidoperoxysulfanylethoxy)methyl]naphthalene
|
CCOc1ccc(NC(C)c2sccc2Br)cc1Cl
|
N-[1-(3-bromothiophen-2-yl)ethyl]-3-chloro-4-ethoxyaniline
|
COC(=O)C(C)NC(=O)c1ccc(OCCCN2CCCCC2)cc1
|
methyl 2-[[4-(3-piperidin-1-ylpropoxy)benzoyl]amino]propanoate
|
COC(=O)c1ccc(-c2cc(F)cc(OCC(C)C)c2)nc1Cl
|
methyl 2-chloro-6-[3-fluoro-5-(2-methylpropoxy)phenyl]pyridine-3-carboxylate
|
C.C.C.C1CSCCN1.CC(=O)N1CCCNCC1.CC(C)N1CCNCC1.CC(F)(F)c1cccc(N2CCNCC2)n1.COC(=O)N1CCNCC1.CS(=O)(=O)C1CCNCC1.Cc1cc(Cl)cc(N2CCNCC2)c1.Fc1cccc(OC2CCNCC2)c1.O=C(NC1CCCC1)c1ccccc1.c1ccc(C2CCCCC2)cc1.c1ccc(OCN2CCCCC2)cc1.c1ccc2c(c1)CCC2
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1-(3-chloro-5-methylphenyl)piperazine;cyclohexylbenzene;N-cyclopentylbenzamide;1-(1,4-diazepan-1-yl)ethanone;1-[6-(1,1-difluoroethyl)pyridin-2-yl]piperazine;2,3-dihydro-1H-indene;4-(3-fluorophenoxy)piperidine;methane;methyl piperazine-1-carboxylate;4-methylsulfonylpiperidine;1-(phenoxymethyl)piperidine;1-propan-2-ylpiperazine;thiomorpholine
|
O=C(Nc1c(-c2ccccc2)nc2sccn12)c1ccc(Br)o1
|
5-bromo-N-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)furan-2-carboxamide
|
CC(C)(C)[C@H]1Cc2ccccc2CCN1C(=O)c1ccc2c(c1)CC(=O)N2
|
5-[(4R)-4-tert-butyl-1,2,4,5-tetrahydro-3-benzazepine-3-carbonyl]-1,3-dihydroindol-2-one
|
CC(C)CCCCCCCCCCCCCCCOC(=O)c1ccc(O)cc1C=O
|
16-methylheptadecyl 2-formyl-4-hydroxybenzoate
|
O=PC(O)(O)O
|
phosphorosomethanetriol
|
CC1(C)OB(/C(=C/N)C(=N)Cl)OC1(C)C
|
(Z)-3-amino-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enimidoyl chloride
|
C/C(Cl)=C/Cn1c(N/N=C/c2cc(Br)ccc2O)nc2c1c(=O)n(C)c(=O)n2C
|
8-[(2E)-2-[(5-bromo-2-hydroxyphenyl)methylidene]hydrazinyl]-7-[(Z)-3-chlorobut-2-enyl]-1,3-dimethylpurine-2,6-dione
|
COc1cc(Nc2ncc(-c3n[nH]c(C)c3C)c(N)n2)cc(S(C)(=O)=O)c1
|
5-(4,5-dimethyl-1H-pyrazol-3-yl)-2-N-(3-methoxy-5-methylsulfonylphenyl)pyrimidine-2,4-diamine
|
S=C(NC1CCCCC1)N1CCSCC1
|
N-cyclohexylthiomorpholine-4-carbothioamide
|
COC(=O)CCCCCCCCCCCN(C)C(=O)COC(C)C(C)OCC(=O)N(C)CCCCCCCCCCCC(=O)OC
|
methyl 12-[[2-[3-[2-[(12-methoxy-12-oxododecyl)-methylamino]-2-oxoethoxy]butan-2-yloxy]acetyl]-methylamino]dodecanoate
|
CCOC(=O)c1c(CC)n(Cc2ccccc2)c(=O)n2c1cc1ccccc12
|
ethyl 2-benzyl-3-ethyl-1-oxopyrimido[1,6-a]indole-4-carboxylate
|
OC(Cn1cncn1)(c1ccc(F)cc1)C1CC1c1ccccc1Cl
|
1-[2-(2-chlorophenyl)cyclopropyl]-1-(4-fluorophenyl)-2-(1,2,4-triazol-1-yl)ethanol
|
CC(C)c1ccc(C=C2SC(=O)N(CC(=O)NC3C=CS(=O)(=O)C3)C2=O)cc1
|
N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-2-[2,4-dioxo-5-[(4-propan-2-ylphenyl)methylidene]-1,3-thiazolidin-3-yl]acetamide
|
COc1ccc(C2c3ccsc3CCN2C(C)=O)cc1
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1-[4-(4-methoxyphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethanone
|
CCCNC(=S)Nc1nn(Cc2cccc(F)c2)cc1Cl
|
1-[4-chloro-1-[(3-fluorophenyl)methyl]pyrazol-3-yl]-3-propylthiourea
|
CC(C)c1cnn2c(NCc3ccccc3-c3ccc4c(c3)CC(=O)N4)nc(N3CCC(N)CC3)nc12
|
5-[2-[[[2-(4-aminopiperidin-1-yl)-8-propan-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-yl]amino]methyl]phenyl]-1,3-dihydroindol-2-one
|
Cc1cnc(N)nc1NCC[C@H]1CCC(=O)N1CCN(C)C
|
(5R)-5-[2-[(2-amino-5-methylpyrimidin-4-yl)amino]ethyl]-1-[2-(dimethylamino)ethyl]pyrrolidin-2-one
|
CCOC(=O)C1CCCCN1S(=O)(=O)Cc1cc(C)on1
|
ethyl 1-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]piperidine-2-carboxylate
|
CNc1cc(C2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)nc(-c2cccnc2)n1
|
6-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-N-methyl-2-pyridin-3-ylpyrimidin-4-amine
|
O=C1C=C(Nc2ccccc2O)C(=O)N1CCO
|
3-(2-hydroxyanilino)-1-(2-hydroxyethyl)pyrrole-2,5-dione
|
c1ccc(-c2ccc3c(c2)oc2cccc(-c4nc(-c5ccccc5)nc(-c5ccccc5-c5ccc6ccc7c8ccccc8ccc7c6c5)n4)c23)cc1
|
2-(2-chrysen-3-ylphenyl)-4-phenyl-6-(7-phenyldibenzofuran-1-yl)-1,3,5-triazine
|
O=C(c1ccc(=O)[nH]c1)N1C[C@H]2COc3ccccc3C[C@@]2(C(=O)O)C1
|
(3aS,10aS)-2-(6-oxo-1H-pyridine-3-carbonyl)-3,3a,4,10-tetrahydro-1H-[1]benzoxepino[3,4-c]pyrrole-10a-carboxylic acid
|
Cn1nnc(CC(N)c2cccc(C(F)(F)F)c2)n1
|
2-(2-methyltetrazol-5-yl)-1-[3-(trifluoromethyl)phenyl]ethanamine
|
CN(CC(F)F)C(=O)Nc1ccc(C2(C(=O)O)CC2)cc1
|
1-[4-[[2,2-difluoroethyl(methyl)carbamoyl]amino]phenyl]cyclopropane-1-carboxylic acid
|
Cc1cc2c(cc1Br)N1C(=NN(COCC[Si](C)(C)C)C(=O)C1C)CO2.Cc1cc2c(cc1CC1CCC1)N1C(=NN(COCC[Si](C)(C)C)C(=O)C1C)CO2
|
9-bromo-1,8-dimethyl-3-(2-trimethylsilylethoxymethyl)-1,5-dihydro-[1,2,4]triazino[3,4-c][1,4]benzoxazin-2-one;9-(cyclobutylmethyl)-1,8-dimethyl-3-(2-trimethylsilylethoxymethyl)-1,5-dihydro-[1,2,4]triazino[3,4-c][1,4]benzoxazin-2-one
|
COc1cc(C)c(C)c(C2(CN)CC2)c1O
|
2-[1-(aminomethyl)cyclopropyl]-6-methoxy-3,4-dimethylphenol
|
CCCCCCCCCCCCCCCC(=O)[C@@H](C)CCCCCCCCCCCCCC
|
(15S)-15-methylhentriacontan-16-one
|
Cc1cc(N(Cc2cccnc2)S(=O)(=O)C(F)(F)F)c(Cl)cc1Oc1ccccc1
|
N-(2-chloro-5-methyl-4-phenoxyphenyl)-1,1,1-trifluoro-N-(pyridin-3-ylmethyl)methanesulfonamide
|
CCOC(=O)Cc1nc(N2CCN(C)CC2)no1
|
ethyl 2-[3-(4-methylpiperazin-1-yl)-1,2,4-oxadiazol-5-yl]acetate
|
NC(=O)c1cn2c(-c3cccc(N4CCCC(CO)C4)n3)cnc2cn1
|
3-[6-[3-(hydroxymethyl)piperidin-1-yl]pyridin-2-yl]imidazo[1,2-a]pyrazine-6-carboxamide
|
CCC(=O)NC(CCC(N)=O)C(=O)O
|
5-amino-5-oxo-2-(propanoylamino)pentanoic acid
|
C1=CC(c2nc(-c3ccccc3)nc(-c3cc(-c4ccccc4)cc(-c4cccc(-n5c6c(c7ccc8c9ccccc9sc8c75)C=CCC6)c4)c3)n2)=CCC1
|
12-[3-[3-(4-cyclohexa-1,5-dien-1-yl-6-phenyl-1,3,5-triazin-2-yl)-5-phenylphenyl]phenyl]-1,2-dihydro-[1]benzothiolo[2,3-a]carbazole
|
CC(=O)OC1C(O)CC(OC(=O)c2ccc(-c3ccccc3)cc2)C1/C=C/C(=O)CCCCC#N
|
[3-acetyloxy-2-[(E)-7-cyano-3-oxohept-1-enyl]-4-hydroxycyclopentyl] 4-phenylbenzoate
|
COc1ccc(OC)c(NC(=O)N[C@@H]2CCCc3ccccc32)c1
|
1-(2,5-dimethoxyphenyl)-3-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]urea
|
C=CCN1CCN(C(=O)C2CCCO2)CC(Cc2ccc(-c3ccccc3)cc2)C1=O
|
1-(oxolane-2-carbonyl)-6-[(4-phenylphenyl)methyl]-4-prop-2-enyl-1,4-diazepan-5-one
|
Cc1noc(C)c1C(=O)N1C[C@@H](O)[C@](O)(CNS(C)(=O)=O)C1
|
N-[[(3R,4R)-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-3,4-dihydroxypyrrolidin-3-yl]methyl]methanesulfonamide
|
CC1CCCN1C(=O)c1cc(N)c2ccccc2n1
|
(4-aminoquinolin-2-yl)-(2-methylpyrrolidin-1-yl)methanone
|
N=C1/C(=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)C(=O)N=C2SC(Cc3cccs3)=NN12
|
4-[5-[(E)-[5-imino-7-oxo-2-(thiophen-2-ylmethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene]methyl]furan-2-yl]benzoic acid
|
CC1(C)CCC(Nc2cc(N)nc(N)n2)C1
|
4-N-(3,3-dimethylcyclopentyl)pyrimidine-2,4,6-triamine
|
C=CC[N+]1=C(C=C2SC(c3ccccc3)=C(c3ccccc3)N2CC)SC(=C(C=C2Sc3ccccc3N2CC)c2ccccc2)C1=O
|
5-[2-(3-ethyl-1,3-benzothiazol-2-ylidene)-1-phenylethylidene]-2-[(3-ethyl-4,5-diphenyl-1,3-thiazol-2-ylidene)methyl]-3-prop-2-enyl-1,3-thiazol-3-ium-4-one
|
[N-]=[N+]=Nc1c(F)c(F)c(C=NOCCCCOC2(N)C=CN([C@H]3C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O3)C(=O)N2)c(F)c1F
|
[[(2R,3S,5R)-5-[6-amino-6-[4-[(4-azido-2,3,5,6-tetrafluorophenyl)methylideneamino]oxybutoxy]-2-oxo-1H-pyrimidin-3-yl]-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
|
CON(C)S(=O)(=O)c1cccc(C(=O)NCCCN2CCN(c3cccc(C)c3)CC2)c1
|
3-[methoxy(methyl)sulfamoyl]-N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]benzamide
|
CN(C)C[C@H]1C[C@@H]2CN(Cc3ccoc3)C[C@@H]2O1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F
|
1-[(2R,3aR,6aR)-5-(furan-3-ylmethyl)-2,3,3a,4,6,6a-hexahydrofuro[2,3-c]pyrrol-2-yl]-N,N-dimethylmethanamine;2,2,2-trifluoroacetic acid
|
C/C=C/CCc1ccc(OC(=O)C2CCC(C3CCC(C[C@H](C)c4ccccc4)CC3)CC2)cc1F.CCCc1ccc(OC(=O)C2CCC(C3CCC(C[C@H](C)c4ccccc4)CC3)CC2)cc1F.CCOc1ccc(OC(=O)C2CCC(C3CCC(C[C@H](C)c4ccccc4)CC3)CC2)cc1F.C[C@@H](CC1CCC(C2CCC(C(=O)Oc3ccc(C#N)c(F)c3)CC2)CC1)c1ccccc1.C[C@@H](CC1CCC(C2CCC(C(=O)Oc3ccc(Cl)c(F)c3)CC2)CC1)c1ccccc1.C[C@@H](CC1CCC(C2CCC(C(=O)Oc3ccc(F)c(F)c3)CC2)CC1)c1ccccc1
|
(4-chloro-3-fluorophenyl) 4-[4-[(2S)-2-phenylpropyl]cyclohexyl]cyclohexane-1-carboxylate;(4-cyano-3-fluorophenyl) 4-[4-[(2S)-2-phenylpropyl]cyclohexyl]cyclohexane-1-carboxylate;(3,4-difluorophenyl) 4-[4-[(2S)-2-phenylpropyl]cyclohexyl]cyclohexane-1-carboxylate;(4-ethoxy-3-fluorophenyl) 4-[4-[(2S)-2-phenylpropyl]cyclohexyl]cyclohexane-1-carboxylate;[3-fluoro-4-[(E)-pent-3-enyl]phenyl] 4-[4-[(2S)-2-phenylpropyl]cyclohexyl]cyclohexane-1-carboxylate;(3-fluoro-4-propylphenyl) 4-[4-[(2S)-2-phenylpropyl]cyclohexyl]cyclohexane-1-carboxylate
|
COc1cc(CN2CCc3nc(-c4ccc(Cl)cc4)ncc3C2)cc(O)c1O
|
5-[[2-(4-chlorophenyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]methyl]-3-methoxybenzene-1,2-diol
|
CC[C@@]1(C)N=C(Nc2ccccc2Cl)OC1=O
|
(4R)-2-(2-chloroanilino)-4-ethyl-4-methyl-1,3-oxazol-5-one
|
Nc1ccc(S(=O)(=O)NC2CCCOC2)c2ncccc12
|
5-amino-N-(oxan-3-yl)quinoline-8-sulfonamide
|
CCOc1cc(N=NC(C(C)=O)C(=O)N(Cl)c2cccc(OCC)c2OCC)c(Cl)c(OCC)c1
|
N-chloro-2-[(2-chloro-3,5-diethoxyphenyl)diazenyl]-N-(2,3-diethoxyphenyl)-3-oxobutanamide
|
CCC1CCCC(Oc2cc(CNC3CC3)ccn2)C1
|
N-[[2-(3-ethylcyclohexyl)oxypyridin-4-yl]methyl]cyclopropanamine
|
CC(C)CCNc1cc2c(cc1[N+](=O)[O-])CC(=O)N2
|
6-(3-methylbutylamino)-5-nitro-1,3-dihydroindol-2-one
|
Cc1ccc([N+](=O)[O-])c(-c2cc(N)c(C(=O)O)s2)c1
|
3-amino-5-(5-methyl-2-nitrophenyl)thiophene-2-carboxylic acid
|
COCc1c(C(=O)NC(C)C)ncc2[nH]c3cccc(Oc4ccccc4)c3c12
|
4-(methoxymethyl)-5-phenoxy-N-propan-2-yl-9H-pyrido[3,4-b]indole-3-carboxamide
|
CC[C@H]1O[C@@H](CCCCCCC[C@H](NC(=O)OCc2ccccc2)C(=O)N[C@@H](C)C(=O)C[C@@H](C)C(=O)OCc2ccccc2)[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@H]1C.C[C@H](CC(=O)[C@H](C)NC(=O)[C@@H]([NH3+])CCCCCCC[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)C(=O)O.[Cl-]
|
benzyl (2R,5S)-5-[[(2S)-9-[(2S,3S,4S,5S,6R)-6-ethyl-5-methyl-3,4-bis(phenylmethoxy)oxan-2-yl]-2-(phenylmethoxycarbonylamino)nonanoyl]amino]-2-methyl-4-oxohexanoate;[(2S)-1-[[(2S,5R)-5-carboxy-3-oxohexan-2-yl]amino]-1-oxo-9-[(2S,3R,4R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]nonan-2-yl]azanium;chloride
|
CCCC(N)C(=O)NC1CC2CCC(C1)N2Cc1ccccc1
|
2-amino-N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)pentanamide
|
Cc1ccccc1COc1ccc(/C=N/NC(=O)CSc2n[nH]c(=O)[nH]c2=O)cc1
|
2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)sulfanyl]-N-[(E)-[4-[(2-methylphenyl)methoxy]phenyl]methylideneamino]acetamide
|
O=c1[nH]c2cc(S(=O)(=O)N3CCC(Cn4cnccc4=O)CC3)ccc2o1
|
5-[4-[(6-oxopyrimidin-1-yl)methyl]piperidin-1-yl]sulfonyl-3H-1,3-benzoxazol-2-one
|
Cc1cccc(S(=O)(=O)NC(C)(C)c2cccc(-c3ccncc3F)c2)c1
|
N-[2-[3-(3-fluoropyridin-4-yl)phenyl]propan-2-yl]-3-methylbenzenesulfonamide
|
CCCCOCCNCc1ccc(C)o1
|
2-butoxy-N-[(5-methylfuran-2-yl)methyl]ethanamine
|
CN1CCCC2(CCN(c3ncc(C(=O)NCc4ncccn4)c(NCc4ccc(CO)c(Cl)c4)n3)C2)C1.CS(=O)c1ncc(C(=O)NCc2ncccn2)c(NCc2ccc(CO)c(Cl)c2)n1
|
4-[[3-chloro-4-(hydroxymethyl)phenyl]methylamino]-2-(9-methyl-2,9-diazaspiro[4.5]decan-2-yl)-N-(pyrimidin-2-ylmethyl)pyrimidine-5-carboxamide;4-[[3-chloro-4-(hydroxymethyl)phenyl]methylamino]-2-methylsulfinyl-N-(pyrimidin-2-ylmethyl)pyrimidine-5-carboxamide
|
CC(C)CC(CN)NC(=O)CCSCc1ccccn1
|
N-(1-amino-4-methylpentan-2-yl)-3-(pyridin-2-ylmethylsulfanyl)propanamide
|
Cc1cnc(C(C)Nc2ccc(N)cc2C(F)F)o1
|
2-(difluoromethyl)-1-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]benzene-1,4-diamine
|
CCNc1nc(OCC)nc(-c2cc(C)ccc2C)n1
|
4-(2,5-dimethylphenyl)-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine
|
C#C/C=C\C1=C(C)C2(C/C1=C\C=C/CCC)c1ccccc1-c1ccc(CNCc3ccccc3)cc12
|
N-[[(5E)-1-[(Z)-but-1-en-3-ynyl]-5-[(Z)-hex-2-enylidene]-2-methylspiro[cyclopentene-3,9'-fluorene]-2'-yl]methyl]-1-phenylmethanamine
|
CCCNC(=O)c1ccc(=O)n(Cc2ccc(C)cc2)n1
|
1-[(4-methylphenyl)methyl]-6-oxo-N-propylpyridazine-3-carboxamide
|
CCCCCCCCCCCCCCCCNCc1cccc(OCCCCCC)c1
|
N-[(3-hexoxyphenyl)methyl]hexadecan-1-amine
|
Nc1cccc(CN2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)c1
|
[4-[(3-aminophenyl)methyl]piperazin-1-yl]-(1,3-benzodioxol-5-yl)methanone
|
C=COCCCNC1CCN(C(N)=O)CC1
|
4-(3-ethenoxypropylamino)piperidine-1-carboxamide
|
N#Cc1nc(-c2ccc(F)cc2)c(-c2ccc(F)cc2)nc1N1CCN(C(=O)c2ncc(F)cc2F)CC1
|
3-[4-(3,5-difluoropyridine-2-carbonyl)piperazin-1-yl]-5,6-bis(4-fluorophenyl)pyrazine-2-carbonitrile
|
COc1cccc(Cc2ccc([N+](=O)[O-])cc2C(=O)O)c1
|
2-[(3-methoxyphenyl)methyl]-5-nitrobenzoic acid
|
COCCN(CCOC)Cc1cc(C(C)N)ccc1OC
|
1-[3-[[bis(2-methoxyethyl)amino]methyl]-4-methoxyphenyl]ethanamine
|
CC(Cc1cccc(NS(C)(=O)=O)c1)C1c2ccccc2CCc2ccc(S(=O)(=O)O)cc21
|
2-[1-[3-(methanesulfonamido)phenyl]propan-2-yl]tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaene-5-sulfonic acid
|
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)c(Br)cc1O[C@@H](C)CC
|
(5E)-5-[[2-bromo-4-[(2S)-butan-2-yl]oxy-5-ethoxyphenyl]methylidene]-1-(3,5-dimethylphenyl)-1,3-diazinane-2,4,6-trione
|
CCC(=O)OCCCCCCc1ccc(C(=O)Oc2ccc([N+](=O)[O-])cc2)cc1
|
(4-nitrophenyl) 4-(6-propanoyloxyhexyl)benzoate
|
O=C(CCC(=O)OCc1ccc(Cl)cc1)Nc1ccccc1
|
(4-chlorophenyl)methyl 4-anilino-4-oxobutanoate
|
[N-]=[N+]=Nc1c(F)c(F)c(C(=O)NS(=O)(=O)C(F)(F)F)c(F)c1F
|
4-azido-2,3,5,6-tetrafluoro-N-(trifluoromethylsulfonyl)benzamide
|
CCOC(=O)c1coc2cc(N)c(Br)cc12
|
ethyl 6-amino-5-bromo-1-benzofuran-3-carboxylate
|
CCCC(C)(NC(=O)NCc1cnc(C)cn1)C(=O)O
|
2-methyl-2-[(5-methylpyrazin-2-yl)methylcarbamoylamino]pentanoic acid
|
COCCN(CC(=O)N(CCc1c[nH]c2ccccc12)Cc1ccc(F)cc1)C(=O)c1ccc(Cl)cc1Cl
|
2,4-dichloro-N-[2-[(4-fluorophenyl)methyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]-N-(2-methoxyethyl)benzamide
|
CCOC(=O)c1c(O)c(O)c(C(=O)OCC)n1-c1ccc(OCCOCCOCCOC)cc1
|
diethyl 3,4-dihydroxy-1-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]pyrrole-2,5-dicarboxylate
|
Cc1ccccc1OCCCC(=O)N1CCCN(C(=O)C2CC(=O)N(C(C)(C)C)C2)CC1
|
1-tert-butyl-4-[4-[4-(2-methylphenoxy)butanoyl]-1,4-diazepane-1-carbonyl]pyrrolidin-2-one
|
COCCOc1ccc(C(F)(F)F)cc1NC(=O)CSc1nnc(-c2ccoc2C)n1Cc1ccccc1
|
2-[[4-benzyl-5-(2-methylfuran-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]acetamide
|
NC(=S)c1ccc(-c2cccs2)n2nc(-c3cccc(Cl)c3)nc12
|
2-(3-chlorophenyl)-5-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carbothioamide
|
CCC(C)N(CC(=O)O)C(CC)c1cccc([N+](=O)[O-])c1
|
2-[butan-2-yl-[1-(3-nitrophenyl)propyl]amino]acetic acid
|
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