SMILES
stringlengths 2
901
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stringlengths 4
1.82k
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CN(C(=O)OC(C)(C)C)c1cc(F)cc2c1[nH]c1nc3nc(c12)NCCCCCCNC(=O)CSc1ncc(cn1)O3
|
tert-butyl N-(10-fluoro-23-oxo-2-oxa-25-thia-4,6,15,22,27,30,31-heptazapentacyclo[24.2.2.13,14.05,13.07,12]hentriaconta-1(29),3,5(13),7(12),8,10,14(31),26(30),27-nonaen-8-yl)-N-methylcarbamate
|
O=C(NCc1ccccc1)c1ccnc(C(=O)Nc2ccc(F)c(Cl)c2)c1
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4-N-benzyl-2-N-(3-chloro-4-fluorophenyl)pyridine-2,4-dicarboxamide
|
NC(=O)Cc1cc[nH]c1-c1ccccc1C(F)(F)F
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2-[2-[2-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]acetamide
|
FC(F)(F)c1ccc(C(F)(F)F)c2c1-c1cc3[nH]c(cc4nc(cc5[nH]c(cc-2n1)c1c(C(F)(F)F)ccc(C(F)(F)F)c51)C1=C4c2cc4c5nc6nc(nc7nc(nc8nc([nH]c([nH]5)c4cc21)-c1c(C(F)(F)F)ccc(C(F)(F)F)c1-8)-c1c(C(F)(F)F)ccc(C(F)(F)F)c1-7)-c1c(C(F)(F)F)ccc(C(F)(F)F)c1-6)c1c(C(F)(F)F)ccc(C(F)(F)F)c31
|
10,13,19,22,28,31,44,47,53,56,62,65-dodecakis(trifluoromethyl)-7,16,25,34,69,70,71,72,73,74,75,76-dodecazaoctadecacyclo[38.28.1.16,35.18,15.117,24.126,33.142,49.151,58.160,67.02,39.03,38.05,36.09,14.018,23.027,32.043,48.052,57.061,66]hexaheptaconta-1(68),2(39),3,5,7,9,11,13,15(76),16,18,20,22,24(75),25,27,29,31,33(74),35,37,40(69),41,43,45,47,49,51(71),52,54,56,58,60,62,64,66-hexatriacontaene
|
CCCS(=O)(=O)N1CCN(c2ncnc3c2nnn3-c2cccc(OC)c2)CC1
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3-(3-methoxyphenyl)-7-(4-propylsulfonylpiperazin-1-yl)triazolo[4,5-d]pyrimidine
|
CCOC(=O)N[C@@H](C)CO[P@@]1(=O)OC[C@H]2O[C@@H](n3cnc4c(OCC)nc(N)nc43)[C@@H](C)[C@@H]2O1
|
ethyl N-[(2S)-1-[[(2S,4aR,6R,7S,7aS)-6-(2-amino-6-ethoxypurin-9-yl)-7-methyl-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]propan-2-yl]carbamate
|
CCOC(=O)C1=C(O)CCN(CC2COc3ccccc3O2)C1.Cl
|
ethyl 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-hydroxy-3,6-dihydro-2H-pyridine-5-carboxylate;hydrochloride
|
Cc1ccc(Oc2ccc([N+](=O)[O-])c(C=O)c2)c(Br)c1
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5-(2-bromo-4-methylphenoxy)-2-nitrobenzaldehyde
|
O=C(CNC(=O)c1ccco1)O[C@@H](C(=O)Nc1cccc(C(F)(F)F)c1)c1ccccc1
|
[(1R)-2-oxo-1-phenyl-2-[3-(trifluoromethyl)anilino]ethyl] 2-(furan-2-carbonylamino)acetate
|
COc1ccc(/C=C(\NC(=O)c2ccccc2)C(=O)Nc2ccc(SCC(=O)Nc3nc(-c4ccccc4)cs3)cc2)cc1
|
N-[(Z)-1-(4-methoxyphenyl)-3-oxo-3-[4-[2-oxo-2-[(4-phenyl-1,3-thiazol-2-yl)amino]ethyl]sulfanylanilino]prop-1-en-2-yl]benzamide
|
CC/C=C1\[C@@H](C(=O)OC(C)(C)C)N(C(=O)OC(C)(C)C)C[C@@H]1O
|
ditert-butyl (2S,3E,4R)-4-hydroxy-3-propylidenepyrrolidine-1,2-dicarboxylate
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CCC(NS(=O)(=O)C(C)C)c1ncccc1C
|
N-[1-(3-methylpyridin-2-yl)propyl]propane-2-sulfonamide
|
C=C1NCCC/C1=C/N=CC.N=Nc1ccccc1N.c1ccc2scnc2c1
|
1,3-benzothiazole;2-diazenylaniline;N-[(Z)-(2-methylidenepiperidin-3-ylidene)methyl]ethanimine
|
CC(C)(C)OC(=O)N1CC2CN(C(=O)c3c(Nc4ccc(I)cc4F)sc4ncccc34)CC21
|
tert-butyl 3-[2-(2-fluoro-4-iodoanilino)thieno[2,3-b]pyridine-3-carbonyl]-3,6-diazabicyclo[3.2.0]heptane-6-carboxylate
|
CCCC1CC(N)(c2ccc(C(C)(C)C)cc2)C1
|
1-(4-tert-butylphenyl)-3-propylcyclobutan-1-amine
|
COc1ccnc(-n2ccc(N)n2)n1
|
1-(4-methoxypyrimidin-2-yl)pyrazol-3-amine
|
Nc1ccn(COCC2CC2)n1
|
1-(cyclopropylmethoxymethyl)pyrazol-3-amine
|
CCOc1ccc(NC(=O)NCCCl)cc1
|
1-(2-chloroethyl)-3-(4-ethoxyphenyl)urea
|
C[N+](C)=CCc1cccnc1
|
dimethyl(2-pyridin-3-ylethylidene)azanium
|
CS(=O)(=O)c1cccc(-c2ccc(S(=O)(=O)N[C@@H]3CCCc4c(OCC(=O)O)cccc43)cc2)c1
|
2-[[(5R)-5-[[4-(3-methylsulfonylphenyl)phenyl]sulfonylamino]-5,6,7,8-tetrahydronaphthalen-1-yl]oxy]acetic acid
|
C[Si](C)(C)CNC1CCC(C#N)C1
|
3-(trimethylsilylmethylamino)cyclopentane-1-carbonitrile
|
CCC(Sc1nnc(CS(=O)(=O)c2ccccc2)n1C)C(=O)Nc1ccc(OC)cc1OC
|
2-[[5-(benzenesulfonylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4-dimethoxyphenyl)butanamide
|
O=C(CCNc1ccc(F)cc1F)Nc1ccc(N2CCCCC2)cc1
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3-(2,4-difluoroanilino)-N-(4-piperidin-1-ylphenyl)propanamide
|
Cc1ccc2oc(-c3cccc(N=Cc4cc(C)c(C)c(Br)c4O)c3)nc2c1
|
2-bromo-3,4-dimethyl-6-[[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]phenol
|
N#Cc1ccc(C(=O)NC(C(N)=O)c2ccccc2)cc1
|
N-(2-amino-2-oxo-1-phenylethyl)-4-cyanobenzamide
|
COc1ccc(NC(=O)C2(C(=O)Nc3ccccc3Cl)CC2)cc1OC
|
1-N'-(2-chlorophenyl)-1-N-(3,4-dimethoxyphenyl)cyclopropane-1,1-dicarboxamide
|
CC(C)N(c1ccccc1)c1ccc(NC(=O)CN2CCC(N3COC=C4C=CC=CC43)CC2)cc1
|
2-[4-(2,8a-dihydro-3,1-benzoxazin-1-yl)piperidin-1-yl]-N-[4-(N-propan-2-ylanilino)phenyl]acetamide
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CCCCCOC(=O)CCCC(=O)OCc1cccc(Oc2ccccc2)c1
|
1-O-pentyl 5-O-[(3-phenoxyphenyl)methyl] pentanedioate
|
CCCCc1cccc2c(CCCC)cccc12
|
1,5-dibutylnaphthalene
|
CCN(C)c1noc(C2CC3CCC2N3)n1
|
5-(7-azabicyclo[2.2.1]heptan-2-yl)-N-ethyl-N-methyl-1,2,4-oxadiazol-3-amine
|
CC(=NC#N)N(C)Cc1ccc(Cl)nc1.CC[C@H]1CCC[C@H](O[C@H]2CC[C@H](N(C)C)[C@@H](C)O2)[C@@H](C)C(=O)C2=C[C@@H]3[C@@H](C=C(C)[C@@H]4C[C@@H](O[C@@H]5O[C@@H](C)[C@H](OC)[C@@H](OC)[C@H]5OC)C[C@@H]34)[C@@H]2CC(=O)O1.CC[C@H]1CCC[C@H](O[C@H]2CC[C@H](N(C)C)[C@@H](C)O2)[C@@H](C)C(=O)C2=C[C@@H]3[C@@H](C=C[C@@H]4C[C@@H](O[C@@H]5O[C@@H](C)[C@H](OC)[C@@H](OC)[C@H]5OC)C[C@@H]34)[C@@H]2CC(=O)O1
|
N-[(6-chloropyridin-3-yl)methyl]-N'-cyano-N-methylethanimidamide;(1S,2S,5R,7S,9S,10S,14R,15S,19S)-15-[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy-19-ethyl-4,14-dimethyl-7-[(2R,3R,4R,5S,6S)-3,4,5-trimethoxy-6-methyloxan-2-yl]oxy-20-oxatetracyclo[10.10.0.02,10.05,9]docosa-3,11-diene-13,21-dione;(1S,2R,5S,7R,9R,10S,14R,15S,19S)-15-[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy-19-ethyl-14-methyl-7-[(2R,3R,4R,5S,6S)-3,4,5-trimethoxy-6-methyloxan-2-yl]oxy-20-oxatetracyclo[10.10.0.02,10.05,9]docosa-3,11-diene-13,21-dione
|
COc1cccc(COC2CC(Br)C2OC)c1
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1-[(3-bromo-2-methoxycyclobutyl)oxymethyl]-3-methoxybenzene
|
CCOCCCNCC(C)N(C)Cc1scnc1C
|
1-N-(3-ethoxypropyl)-2-N-methyl-2-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propane-1,2-diamine
|
C=C(NC)c1ccc(NCc2cc(Cl)ccc2CC)cc1
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N-[(5-chloro-2-ethylphenyl)methyl]-4-[1-(methylamino)ethenyl]aniline
|
Cc1cnc2c(N)c(C3CC3)nn2c1
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2-cyclopropyl-6-methylpyrazolo[1,5-a]pyrimidin-3-amine
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CC(=O)N1C=C(C(C)(C)C)Oc2ccc([N+](=O)[O-])cc21
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1-(2-tert-butyl-6-nitro-1,4-benzoxazin-4-yl)ethanone
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C=C(CCC1CO1)C(=O)OCC1CO1
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oxiran-2-ylmethyl 2-methylidene-4-(oxiran-2-yl)butanoate
|
CCC(C)(C)c1nnc2ccc(C#N)cn12
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3-(2-methylbutan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
|
O=C1CCCCN1CCN1CCCC1Cn1nc2c(cc1=O)CCC2
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2-[[1-[2-(2-oxopiperidin-1-yl)ethyl]pyrrolidin-2-yl]methyl]-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-one
|
c1ccc(-c2ccc(-n3c4ccccc4c4c5c(c6ccccc6c43)c3ccccc3c3c5c4ccccc4n3-c3ccc4oc5ccccc5c4c3)cc2)cc1
|
9-dibenzofuran-2-yl-25-(4-phenylphenyl)-9,25-diazaoctacyclo[15.15.0.02,10.03,8.011,16.018,23.024,32.026,31]dotriaconta-1(17),2(10),3,5,7,11,13,15,18,20,22,24(32),26,28,30-pentadecaene
|
CCNC(=O)c1nccc2c1CN(C(C)c1ccc(OC(F)(F)F)c(C)c1)C2=O
|
N-ethyl-2-[1-[3-methyl-4-(trifluoromethoxy)phenyl]ethyl]-1-oxo-3H-pyrrolo[3,4-c]pyridine-4-carboxamide
|
C[C@H](OC(=O)c1cc(=O)[nH]c2ccccc12)C(=O)N1[C@H](C)CCC[C@H]1C
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[(2S)-1-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1-oxopropan-2-yl] 2-oxo-1H-quinoline-4-carboxylate
|
CC(C)(CCCl)NC(=O)c1cccc(C#N)c1
|
N-(4-chloro-2-methylbutan-2-yl)-3-cyanobenzamide
|
CCOc1ccc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1COc1cccc(OC)c1
|
[4-ethoxy-3-[(3-methoxyphenoxy)methyl]phenyl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone
|
O=C(NCCc1ncc[nH]1)c1c(Cl)cccc1[N+](=O)[O-]
|
2-chloro-N-[2-(1H-imidazol-2-yl)ethyl]-6-nitrobenzamide
|
C[C@@H](O)CN1CCC(CNCc2ccc(OC(F)(F)F)cc2)CC1
|
(2R)-1-[4-[[[4-(trifluoromethoxy)phenyl]methylamino]methyl]piperidin-1-yl]propan-2-ol
|
CCOc1cc(C2C3=C(CC(C)(C)CC3=O)N(CCCOC)C3=C2C(=O)CC(C)(C)C3)cc(I)c1OCc1ccc(C)cc1
|
9-[3-ethoxy-5-iodo-4-[(4-methylphenyl)methoxy]phenyl]-10-(3-methoxypropyl)-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-acridine-1,8-dione
|
CC[N+](C)(OCc1ccccc1)C1C=Cc2ccccc2O1
|
2H-chromen-2-yl-ethyl-methyl-phenylmethoxyazanium
|
CC(=O)Nc1sc(C)c(C)c1C(=O)OCC(=O)N[C@H](Cc1ccccc1)C(C)=O
|
[2-oxo-2-[[(2R)-3-oxo-1-phenylbutan-2-yl]amino]ethyl] 2-acetamido-4,5-dimethylthiophene-3-carboxylate
|
O=C1CC(C2=c3c(oc4cnccc34)=C(OC(F)F)CC2)CN1Cc1c(F)cc(Br)cc1F
|
1-[(4-bromo-2,6-difluorophenyl)methyl]-4-[8-(difluoromethoxy)-6,7-dihydro-[1]benzofuro[2,3-c]pyridin-5-yl]pyrrolidin-2-one
|
N/C([S-])=N/N=C/c1ccccc1[O-].[Pt+2]
|
N'-[(E)-(2-oxidophenyl)methylideneamino]carbamimidothioate;platinum(2+)
|
Cc1c(C(=O)N2CCN(C)CC2)oc2c1/C(=N\N=C(N)N)CC(C)(C)C2
|
2-[(Z)-[3,6,6-trimethyl-2-(4-methylpiperazine-1-carbonyl)-5,7-dihydro-1-benzofuran-4-ylidene]amino]guanidine
|
COCCNC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)C(F)F)cc1
|
[(2R)-1-(2-methoxyethylamino)-1-oxopropan-2-yl] 4-(difluoromethylsulfonyl)benzoate
|
Nc1cc(C(=O)N/N=C/c2cccc3c2ccn3Cc2ccc(OC(F)(F)F)cc2)ccc1O
|
3-amino-4-hydroxy-N-[(E)-[1-[[4-(trifluoromethoxy)phenyl]methyl]indol-4-yl]methylideneamino]benzamide
|
C.CC(C)(C)C.CCC(CC)CC1ON(C(=O)/C=C/c2cnc3ccccc3n2)C2CNC(=O)CN2C1=O.OP(O)OCCCCN1CCCC1
|
2,2-dimethylpropane;3-(2-ethylbutyl)-1-[(E)-3-quinoxalin-2-ylprop-2-enoyl]-6,8,9,9a-tetrahydropyrazino[2,1-c][1,2,4]oxadiazine-4,7-dione;methane;4-pyrrolidin-1-ylbutyl dihydrogen phosphite
|
CC/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)OC(CCCCCCCC)CCCCCC(=O)O
|
7-[(11Z,14Z,17Z)-icosa-11,14,17-trienoyl]oxypentadecanoic acid
|
O[C@H]1[C@H](OCc2ccccc2)[C@@H](COCc2ccccc2)OC1(COCc1ccccc1)OC1O[C@H](COCc2ccccc2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1
|
(3S,4S,5R)-4-phenylmethoxy-2,5-bis(phenylmethoxymethyl)-2-[(3R,4S,5R,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxyoxolan-3-ol
|
O=C(O)c1ccc(NS(=O)(=O)c2ccc(Br)c(C(=O)Nc3ccccc3)c2)cc1
|
4-[[4-bromo-3-(phenylcarbamoyl)phenyl]sulfonylamino]benzoic acid
|
CCCC(CC(=O)N1CCCC1)(N=C(N)N)c1ccccc1
|
2-(1-oxo-3-phenyl-1-pyrrolidin-1-ylhexan-3-yl)guanidine
|
CC1CCCC(C)C1Nc1ccc(-n2ccnc2)nc1
|
N-(2,6-dimethylcyclohexyl)-6-imidazol-1-ylpyridin-3-amine
|
COc1ccc(CCN(Cc2ccco2)C(=O)CN(CC(C)C)C(=O)c2cccc(C(F)(F)F)c2)cc1OC
|
N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(furan-2-ylmethyl)amino]-2-oxoethyl]-N-(2-methylpropyl)-3-(trifluoromethyl)benzamide
|
CCOC(C)CNC(=O)C1CNC1
|
N-(2-ethoxypropyl)azetidine-3-carboxamide
|
O=C(N1CC2(CCN(c3ccccn3)C2)C1)N1CCc2cc(Cl)ccc21
|
(5-chloro-2,3-dihydroindol-1-yl)-(7-pyridin-2-yl-2,7-diazaspiro[3.4]octan-2-yl)methanone
|
CCOCCS(=O)(=O)Nc1ccc(C(=O)O)s1
|
5-(2-ethoxyethylsulfonylamino)thiophene-2-carboxylic acid
|
CCc1noc(-c2ccnc(-n3cnc(C(=O)NCc4ccco4)c3)c2)n1
|
1-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-N-(furan-2-ylmethyl)imidazole-4-carboxamide
|
OCC(F)(F)CNC1CCCC1C1CCCN1
|
2,2-difluoro-3-[(2-pyrrolidin-2-ylcyclopentyl)amino]propan-1-ol
|
CCc1ccccc1N1C(=O)CSC1c1cccc(NC(=O)C(C)(C)C)c1
|
N-[3-[3-(2-ethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]-2,2-dimethylpropanamide
|
CCNC(=NCCn1cccn1)NCCOc1ccccc1
|
1-ethyl-3-(2-phenoxyethyl)-2-(2-pyrazol-1-ylethyl)guanidine
|
CCCCCCCCCc1ccc(CC(C)CCC[C@@H](C)[C@H]2CC[C@H]3[C@@H]4CC=C5C[C@@H](OC(=O)O)CC[C@]5(C)[C@H]4CC[C@]23C)cc1
|
[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methyl-7-(4-nonylphenyl)heptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hydrogen carbonate
|
CC(=O)NNC(=O)c1sccc1Br
|
N'-acetyl-3-bromothiophene-2-carbohydrazide
|
CC(C)(C)[C@H](NC(=O)CCN1CCC(n2cc(-c3cc(-c4ccccc4O)nnc3N)cn2)CC1)C(=O)N1CC[C@@H](O)C1
|
3-[4-[4-[3-amino-6-(2-hydroxyphenyl)pyridazin-4-yl]pyrazol-1-yl]piperidin-1-yl]-N-[(2S)-1-[(3R)-3-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]propanamide
|
Cc1ccc(C(=O)O)c(Nc2ccc3ncccc3c2)c1
|
4-methyl-2-(quinolin-6-ylamino)benzoic acid
|
COc1ccc(NS(=O)(=O)c2cccc(C(=O)N3CCN(Cc4c(C)noc4C)CC3)c2)cc1
|
3-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazine-1-carbonyl]-N-(4-methoxyphenyl)benzenesulfonamide
|
COCCOc1cc(C(=O)NCCCc2ccccc2)ccn1
|
2-(2-methoxyethoxy)-N-(3-phenylpropyl)pyridine-4-carboxamide
|
Nc1nnc(SCC(=O)NCCN2CCCOC2=O)s1
|
2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]acetamide
|
CC[C@@H](C)NC(=O)[C@@H](Cc1ccccc1)N(Cc1cccc(Br)c1)C(=O)CN(c1ccc(C(C)C)cc1)S(C)(=O)=O
|
(2R)-2-[(3-bromophenyl)methyl-[2-(N-methylsulfonyl-4-propan-2-ylanilino)acetyl]amino]-N-[(2R)-butan-2-yl]-3-phenylpropanamide
|
CC(/C=C/[C@@H]1C[C@]2(CO2)C[C@@H](CC(=O)On2nnc3cccnc32)O1)=C\C[C@@H]1O[C@H](C)[C@H](NC(=O)/C=C\C(C)C)C[C@@H]1C
|
triazolo[4,5-b]pyridin-3-yl 2-[(3S,5S,7S)-5-[(1E,3E)-5-[(2S,3S,5R,6R)-3,6-dimethyl-5-[[(Z)-4-methylpent-2-enoyl]amino]oxan-2-yl]-3-methylpenta-1,3-dienyl]-1,6-dioxaspiro[2.5]octan-7-yl]acetate
|
CCCCNC(=NC)NCC1CCN(CC)C1.I
|
1-butyl-3-[(1-ethylpyrrolidin-3-yl)methyl]-2-methylguanidine;hydroiodide
|
CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)COC(=O)NS(=O)(=O)c4ccc(C)cc4)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12
|
[(2S)-2-[(3R,5S,6R,7R,8S,9S,10S,13R,14S,17R)-6-ethyl-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]propyl] N-(4-methylphenyl)sulfonylcarbamate
|
COC(=O)c1ccc2c(c1)N(C[C@@H]1CC[C@H]1[C@@H](OC)[C@H]1CCC[C@@H](OS(C)(=O)=O)C1)CC1(CCCc3cc(Cl)ccc31)CO2
|
methyl 7-chloro-5'-[[(1R,2R)-2-[(S)-methoxy-[(1S,3R)-3-methylsulfonyloxycyclohexyl]methyl]cyclobutyl]methyl]spiro[2,3-dihydro-1H-naphthalene-4,3'-2,4-dihydro-1,5-benzoxazepine]-7'-carboxylate
|
COc1cc(Cl)cc(-c2nc(SC)[nH]c(=O)c2C#N)c1OC(C)C
|
4-(5-chloro-3-methoxy-2-propan-2-yloxyphenyl)-2-methylsulfanyl-6-oxo-1H-pyrimidine-5-carbonitrile
|
CC[C@@H]1[C@@H](NC(=O)c2cccnc2)[C@H](Cc2ccccc2)C(=O)N1c1ccc2c(cnn2-c2ccc(F)cc2)c1
|
N-[(2R,3S,4S)-4-benzyl-2-ethyl-1-[1-(4-fluorophenyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]pyridine-3-carboxamide
|
O=C(C1CCCCC1)N(CC[N+]1(c2nccc3ccccc23)CCNCC1)c1ccccn1
|
N-[2-(1-isoquinolin-1-ylpiperazin-1-ium-1-yl)ethyl]-N-pyridin-2-ylcyclohexanecarboxamide
|
CCOC(=O)C1=C(C)N=c2s/c(=C/c3cc([N+](=O)[O-])ccc3O)c(=O)n2C1c1ccc(Br)cc1
|
ethyl (2E)-5-(4-bromophenyl)-2-[(2-hydroxy-5-nitrophenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
|
Cc1ccc(C(=O)N2CCC(F)(F)CC2)cc1
|
(4,4-difluoropiperidin-1-yl)-(4-methylphenyl)methanone
|
COC1CC(C[C@@H](C)[C@@H]2CC(=O)C(C)=CC(C)C(O)[C@@H](OC)C(=O)C(C)C[C@H](C)C=CC=CC=C(C)[C@@H](OC)C[C@@H]3CCC(C)C(O)(O3)C(C)C(=O)N3CCCCC3C(=O)O2)CC[C@H]1O
|
(12S,19R,23S,30S,32S)-1,18-dihydroxy-12-[(2R)-1-[(4R)-4-hydroxy-3-methoxycyclohexyl]propan-2-yl]-19,30-dimethoxy-2,15,17,21,23,29,35-heptamethyl-11,36-dioxa-4-azatricyclo[30.3.1.04,9]hexatriaconta-15,24,26,28-tetraene-3,10,14,20-tetrone
|
FCc1ccc(C(F)F)c(Br)n1
|
2-bromo-3-(difluoromethyl)-6-(fluoromethyl)pyridine
|
O=c1[nH]c2cc(Cl)c(Cl)c3c2n(c1=O)CCO3
|
6,7-dichloro-4-oxa-1,10-diazatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene-11,12-dione
|
Cc1ccc(N2C(=O)[C@@](C)(c3ccc4c(c3)CCC(C)(C)O4)c3cc(Cl)ccc32)cc1F
|
(3S)-5-chloro-3-(2,2-dimethyl-3,4-dihydrochromen-6-yl)-1-(3-fluoro-4-methylphenyl)-3-methylindol-2-one
|
C=C(CC1CCC(N(CCC2CCCC2)CC2CCCCC2)C(c2ccc(C(F)(F)F)cc2)C1)OCC
|
N-(cyclohexylmethyl)-N-(2-cyclopentylethyl)-4-(2-ethoxyprop-2-enyl)-2-[4-(trifluoromethyl)phenyl]cyclohexan-1-amine
|
O=C1CCN(C(=O)C2CC3C=CC2C3)CCN1
|
1-(bicyclo[2.2.1]hept-5-ene-2-carbonyl)-1,4-diazepan-5-one
|
COCc1cc(C(=O)N2C[C@H](O)C[C@@H]2c2ccc(F)cc2)no1
|
[(2R,4R)-2-(4-fluorophenyl)-4-hydroxypyrrolidin-1-yl]-[5-(methoxymethyl)-1,2-oxazol-3-yl]methanone
|
COc1cnc(-c2nn(Cc3c(F)cc(C4CC4)cc3F)c3ccccc23)nc1Nc1ccncc1
|
2-[1-[(4-cyclopropyl-2,6-difluorophenyl)methyl]indazol-3-yl]-5-methoxy-N-pyridin-4-ylpyrimidin-4-amine
|
Cc1ccccc1/C=N\NC(=O)COc1ccc(F)cc1
|
2-(4-fluorophenoxy)-N-[(Z)-(2-methylphenyl)methylideneamino]acetamide
|
CC(C)(C)c1cc(=O)nc2c3ccnc(-c4ccccc4)c3ccn12
|
4-tert-butyl-8-phenylpyrimido[2,1-a][2,6]naphthyridin-2-one
|
Cc1cc(C)c2nc(CCC(N)=O)cc(C)c2c1
|
3-(4,6,8-trimethylquinolin-2-yl)propanamide
|
O=C(Nc1ccccc1)OCC1COc2ccccc2O1
|
2,3-dihydro-1,4-benzodioxin-3-ylmethyl N-phenylcarbamate
|
CN1CCOc2cc(COc3nc4ccncc4cc3NS(=O)(=O)c3ccccc3C(F)(F)F)ccc21
|
N-[2-[(4-methyl-2,3-dihydro-1,4-benzoxazin-7-yl)methoxy]-1,6-naphthyridin-3-yl]-2-(trifluoromethyl)benzenesulfonamide
|
c1cn2ncnc2cn1
|
[1,2,4]triazolo[1,5-a]pyrazine
|
CN(CCC(=O)Nc1ccc(C#N)c(Cl)c1)Cc1ccc(Cl)cc1
|
N-(3-chloro-4-cyanophenyl)-3-[(4-chlorophenyl)methyl-methylamino]propanamide
|
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