AdrianM0/SMILES-to-IUPAC-BOOTSTRAP-ROUND-0

SMILES stringlengths 2 1.04k	IUPAC stringlengths 4 1.09k
CC(=O)C(NC(=O)CN(CCC(=O)O)C(C)(C)C)C(C)C	3-[tert-butyl-[2-[(2-methyl-4-oxopentan-3-yl)amino]-2-oxoethyl]amino]propanoic acid
NCCCN(CCCc1ccccc1)Cc1ccccc1	N'-benzyl-N'-(3-phenylpropyl)propane-1,3-diamine
COc1ccc(CNC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1OC	1-[(3,4-dimethoxyphenyl)methyl]-3-(4-nitrophenyl)thiourea
NC1(N2CCCC2)CCc2cc(Cl)ccc21	5-chloro-1-pyrrolidin-1-yl-2,3-dihydroinden-1-amine
Cc1ccc(-c2ccc(-c3ccc4c(c3)COC(C(F)(F)F)C4)cc2)cc1	7-[4-(4-methylphenyl)phenyl]-3-(trifluoromethyl)-3,4-dihydro-1H-isochromene
COc1cccc(C(=O)OC2CCC(O)(c3ccc4ccccc4c3)C(CN3CCN(C)CC3)C2)c1	[4-hydroxy-3-[(4-methylpiperazin-1-yl)methyl]-4-naphthalen-2-ylcyclohexyl] 3-methoxybenzoate
CCC1=Cc2ccccc2Cc2nnc(OC)n21	5-ethyl-3-methoxy-11H-[1,2,4]triazolo[3,4-b][3]benzazepine
CCOC(=O)C1CC12CCC(F)(F)[C@@H](c1ccc(OC)nc1)C2	ethyl (7R)-6,6-difluoro-7-(6-methoxypyridin-3-yl)spiro[2.5]octane-2-carboxylate
CCN1CCN(Cc2ccc(OC)c([N+](=O)[O-])c2)CC1	1-ethyl-4-[(4-methoxy-3-nitrophenyl)methyl]piperazine
Cc1nc(C(=O)N(C)Cc2cnn(C)c2C)nc(N2CC[C@@H](N(C)C)C2)c1C	4-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-N-[(1,5-dimethylpyrazol-4-yl)methyl]-N,5,6-trimethylpyrimidine-2-carboxamide
O=C(c1ccc(-c2ccccc2)cc1)N1CCN(C2CN(C(=O)c3cccc(F)c3)C2)CC1	[4-[1-(3-fluorobenzoyl)azetidin-3-yl]piperazin-1-yl]-(4-phenylphenyl)methanone
O=C(COc1cc(Cl)cc(Cl)c1)c1ccc(Cl)c(Cl)c1	2-(3,5-dichlorophenoxy)-1-(3,4-dichlorophenyl)ethanone
CCc1cc(CCC(=O)OCCO)cc(C(C)(C)CC)c1OC	2-hydroxyethyl 3-[3-ethyl-4-methoxy-5-(2-methylbutan-2-yl)phenyl]propanoate
[2H]c1c([2H])c(OC(=O)CCCC(=O)O)c([2H])c([2H])c1N=Nc1ccc(OC)cc1	5-oxo-5-[2,3,5,6-tetradeuterio-4-[(4-methoxyphenyl)diazenyl]phenoxy]pentanoic acid
CCOC(=O)c1cc(-c2ccnc(C=Cc3cccnc3)c2)[nH]c1N	ethyl 2-amino-5-[2-(2-pyridin-3-ylethenyl)pyridin-4-yl]-1H-pyrrole-3-carboxylate
CC(C)N(C(=O)CN1C(=O)N[C@](C)(c2ccccc2)C1=O)c1ccccc1	2-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-phenyl-N-propan-2-ylacetamide
CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)cc(-c4ccc(O)c(CO)c4)nc3c2)C[C@@H]1C.S	propyl (2S)-4-[4-chloro-2-[4-hydroxy-3-(hydroxymethyl)phenyl]quinoline-7-carbonyl]-2-methylpiperazine-1-carboxylate;sulfane
C#CCOc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2ccc(O)cc2)C1=O	(5E)-1-(4-hydroxyphenyl)-5-[(2-prop-2-ynoxynaphthalen-1-yl)methylidene]-1,3-diazinane-2,4,6-trione
C=C.C=O.CC.CNc1ccc(NC(=O)c2n[nH]c3ccc(-c4cncc(CN5CCOCC5)c4)cc23)cn1	ethane;ethene;formaldehyde;N-[6-(methylamino)pyridin-3-yl]-5-[5-(morpholin-4-ylmethyl)pyridin-3-yl]-1H-indazole-3-carboxamide
COC(=O)c1cc(NC(=O)Nc2ccc(C#N)cc2)ccc1OC(c1ccccc1)c1ccccc1	methyl 2-benzhydryloxy-5-[(4-cyanophenyl)carbamoylamino]benzoate
C=CCSCCNC(C)CC1COCCN1C(=O)OC(C)(C)C	tert-butyl 3-[2-(2-prop-2-enylsulfanylethylamino)propyl]morpholine-4-carboxylate
C[C@@H]1CC[C@@H]1COc1ccc(I)cc1	1-iodo-4-[[(1S,2R)-2-methylcyclobutyl]methoxy]benzene
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1cccc(Br)c1	N-[2-[[(3-bromobenzoyl)amino]carbamoyl]phenyl]thiophene-2-sulfonamide
CC(C)(CCBr)NS(=O)(=O)C1CCCCC1	N-(4-bromo-2-methylbutan-2-yl)cyclohexanesulfonamide
O=C(Cc1ccc(Br)s1)Nc1cnccc1CO	2-(5-bromothiophen-2-yl)-N-[4-(hydroxymethyl)pyridin-3-yl]acetamide
CC(OCCOC(=O)c1ccccc1)Oc1ccc(C(C)C(C)C)cc1	2-[1-[4-(3-methylbutan-2-yl)phenoxy]ethoxy]ethyl benzoate
O=C(OCOC(=O)c1c(OC2CCc3cc(Cl)c(Cl)cc3C2)nnn1C(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1	benzoyloxymethyl 5-[(6,7-dichloro-1,2,3,4-tetrahydronaphthalen-2-yl)oxy]-3-trityltriazole-4-carboxylate
C/C=C/C1CCC(C2CCC(=C3CCC(CCC)CC3)CC2)CC1.C/C=C/CC1CCC(C2CCC(=C3CCC(CC)CC3)CC2)CC1.C=CC1CCC(C2CCC(=C3CCC(CCC)CC3)CC2)CC1.C=CCC1CCC(C2CCC(=C3CCC(CC)CC3)CC2)CC1.CCC1CCC(=C2CCC(C3CCC(C)CC3)CC2)CC1.CCCC1CCC(=C2CCC(C3CCC(C)CC3)CC2)CC1.CCCC1CCC(=C2CCC(C3CCC(CC)CC3)CC2)CC1.CCCC1CCC(=C2CCC(C3CCC(CC)CC3)CC2)CC1.CCCC1CCC(C2CCC(=C3CCC(C4CCC(CC)CC4)CC3)CC2)CC1.CCCC1CCC(C2CCC(=C3CCC(C4CCC(CCC)CC4)CC3)CC2)CC1	1-[4-[(E)-but-2-enyl]cyclohexyl]-4-(4-ethylcyclohexylidene)cyclohexane;1-(4-ethenylcyclohexyl)-4-(4-propylcyclohexylidene)cyclohexane;1-(4-ethylcyclohexyl)-4-[4-(4-propylcyclohexyl)cyclohexylidene]cyclohexane;1-(4-ethylcyclohexyl)-4-(4-propylcyclohexylidene)cyclohexane;1-ethyl-4-[4-(4-methylcyclohexyl)cyclohexylidene]cyclohexane;1-ethyl-4-[4-(4-prop-2-enylcyclohexyl)cyclohexylidene]cyclohexane;1-(4-methylcyclohexyl)-4-(4-propylcyclohexylidene)cyclohexane;1-[4-[(E)-prop-1-enyl]cyclohexyl]-4-(4-propylcyclohexylidene)cyclohexane;1-(4-propylcyclohexyl)-4-[4-(4-propylcyclohexyl)cyclohexylidene]cyclohexane
O=C(c1nc2c(s1)CCOc1cc(-c3cn[nH]c3)ccc1-2)N1CCN(CC2CC2)CC1	[4-(cyclopropylmethyl)piperazin-1-yl]-[8-(1H-pyrazol-4-yl)-4,5-dihydro-[1]benzoxepino[5,4-d][1,3]thiazol-2-yl]methanone
CCOCc1cc(C2(c3cccc(-c4cccnc4F)c3)N=C(N)N(C)C2=O)cn1CC1CC1	2-amino-5-[1-(cyclopropylmethyl)-5-(ethoxymethyl)pyrrol-3-yl]-5-[3-(2-fluoropyridin-3-yl)phenyl]-3-methylimidazol-4-one
CC1CCC(CN)CN1c1ccc([N+](=O)[O-])cc1Cl	[1-(2-chloro-4-nitrophenyl)-6-methylpiperidin-3-yl]methanamine
CC[C@H](C)[C@@H]1NCCOc2ccccc2CCCNC(=O)[C@@H](C(c2ccccc2)c2ccccc2)NC(=O)[C@@H](C)N(C)C1=O	(6S,9R,12R)-12-benzhydryl-6-[(2S)-butan-2-yl]-8,9-dimethyl-2-oxa-5,8,11,14-tetrazabicyclo[16.4.0]docosa-1(22),18,20-triene-7,10,13-trione
CCNc1ccc(C)cc1C(=O)NC(C)Cc1cccs1	2-(ethylamino)-5-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide
O=S(=O)(Nc1cccc(Br)c1)N1CCNCC1	N-(3-bromophenyl)piperazine-1-sulfonamide
CCc1noc(COc2ccccc2CNCCOC)n1	N-[[2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methyl]-2-methoxyethanamine
CC1(C)C(=O)Nc2ccc(CC(=O)NCC3CCCO3)cc21	2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-N-(oxolan-2-ylmethyl)acetamide
Nc1ccn2c(C3CCSC3)ncc2c1	3-(thiolan-3-yl)imidazo[1,5-a]pyridin-7-amine
COc1ccccc1CCN1C[C@@H](C(=O)Nc2c(C)nn(C)c2C)CC1=O	(3S)-1-[2-(2-methoxyphenyl)ethyl]-5-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyrrolidine-3-carboxamide
O=C(/C=C/c1ccc(N2CCCC2=O)cc1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	1-[4-[(E)-3-oxo-3-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]prop-1-enyl]phenyl]pyrrolidin-2-one
CCOC(=O)COc1ccc(-c2cc3cc4c(cc3o2)OC(C(C)(C)O)C4)cc1	ethyl 2-[4-[6-(2-hydroxypropan-2-yl)-5,6-dihydrofuro[3,2-f][1]benzofuran-2-yl]phenoxy]acetate
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3ccc(C(=O)O)cc3)cc2)cc1	4-[[4-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoic acid
CCCC(NC)c1ccn(Cc2nc(C)cs2)c1	N-methyl-1-[1-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrol-3-yl]butan-1-amine
C=C1C(=O)[C@]23[C@H](O)[C@H]1C[C@H](O)[C@H]2[C@]12CCCC(C)(C)[C@H]1C[C@H]3O[C@@H]2OCCCn1cc(CSc2nc3ccccc3s2)nn1	(1S,2S,3S,5S,8S,9R,11R,16S,18R)-16-[3-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)triazol-1-yl]propoxy]-3,18-dihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one
OCc1cccc(Oc2ccccc2OC(F)(F)F)n1	[6-[2-(trifluoromethoxy)phenoxy]pyridin-2-yl]methanol
O=C1Nc2ccccc2C12CCN(S(=O)(=O)c1cccc(Cl)c1)C2	1'-(3-chlorophenyl)sulfonylspiro[1H-indole-3,3'-pyrrolidine]-2-one
O=C(CSCC(=O)NC1CCC1)NCCn1ccc(C(F)(F)F)cc1=O	2-[2-(cyclobutylamino)-2-oxoethyl]sulfanyl-N-[2-[2-oxo-4-(trifluoromethyl)pyridin-1-yl]ethyl]acetamide
CCCCCCCCCCCCC(CN(C)C)C(=O)O	2-[(dimethylamino)methyl]tetradecanoic acid
CCNCC(COC)N(C)CC(F)(F)F	1-N-ethyl-3-methoxy-2-N-methyl-2-N-(2,2,2-trifluoroethyl)propane-1,2-diamine
NC(c1ccc(F)cc1F)c1ccc(F)c(F)c1Br	(2-bromo-3,4-difluorophenyl)-(2,4-difluorophenyl)methanamine
O=c1[nH]c2cccc(I)c2c(Cl)c1O	4-chloro-3-hydroxy-5-iodo-1H-quinolin-2-one
CN=C(NCCCCN1CCC(Cc2ccccc2)CC1)NCCSC	1-[4-(4-benzylpiperidin-1-yl)butyl]-2-methyl-3-(2-methylsulfanylethyl)guanidine
COCCCNC(=O)CN(Cc1ccc2c(c1)OCO2)S(C)(=O)=O	2-[1,3-benzodioxol-5-ylmethyl(methylsulfonyl)amino]-N-(3-methoxypropyl)acetamide
CCN(C(=O)O)[C@@H](Cc1ccccc1)C(=O)O	(2S)-2-[carboxy(ethyl)amino]-3-phenylpropanoic acid
O=C(Nc1cccc2ccccc12)NC1CC(O)C1	1-(3-hydroxycyclobutyl)-3-naphthalen-1-ylurea
O=C(Nc1ccc(-c2n[nH]c(CC3CC3)n2)cc1)C1C=C(CN2CCSCC2)C=CC1	N-[4-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]phenyl]-3-(thiomorpholin-4-ylmethyl)cyclohexa-2,4-diene-1-carboxamide
C1=CC=C2CC2=C2CCC2=C1	tricyclo[7.2.0.02,4]undeca-1,4,6,8-tetraene
O=C(O)CCCC=CC[C@H]1C(O)CC(O)[C@@H]1COC(=O)NCc1cccc(C(F)(F)F)c1	7-[(1R,2S)-3,5-dihydroxy-2-[[3-(trifluoromethyl)phenyl]methylcarbamoyloxymethyl]cyclopentyl]hept-5-enoic acid
O=C(c1cccnc1Oc1cccc(Br)c1)N1CCN(CCO)CC1	[2-(3-bromophenoxy)pyridin-3-yl]-[4-(2-hydroxyethyl)piperazin-1-yl]methanone
CCCC(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1COc1cccc(C(F)(F)F)c1	1-[(1R)-6,7-dimethoxy-1-[[3-(trifluoromethyl)phenoxy]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]butan-1-one
CC(C)(C)c1ccc(OC(=O)COc2cccc3ccccc23)c(Br)c1	(2-bromo-4-tert-butylphenyl) 2-naphthalen-1-yloxyacetate
COc1ccnc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O[C@@H](C)[C@H](Oc2cccc(F)c2)c2ccccc2)c1OCOC(C)=O	[(1R,2S)-1-(3-fluorophenoxy)-1-phenylpropan-2-yl] (2S)-2-[[3-(acetyloxymethoxy)-4-methoxypyridine-2-carbonyl]amino]-3-phenylpropanoate
CCC(CC)(c1ccc(O)c(C)c1)c1cc(C)c(C(=O)O)s1	5-[3-(4-hydroxy-3-methylphenyl)pentan-3-yl]-3-methylthiophene-2-carboxylic acid
Cc1cn(-c2cccc3[nH]c(-c4n[nH]c5c4=C(F)C(c4cncc(NC(C)C)c4)=C[C@H](C)C=5)nc23)cn1	5-[(7S)-4-fluoro-7-methyl-3-[4-(4-methylimidazol-1-yl)-1H-benzimidazol-2-yl]-1,7-dihydrocyclohepta[c]pyrazol-5-yl]-N-propan-2-ylpyridin-3-amine
COC(=O)c1oc2c(C(=O)/C=C/c3ccc(OC)cc3)c(OCCCN3CCCCC3)ccc2c1C.Cl	methyl 7-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]-3-methyl-6-(3-piperidin-1-ylpropoxy)-1-benzofuran-2-carboxylate;hydrochloride
Cc1ccc2c(c1)C(=O)CNCC2	7-methyl-1,2,3,4-tetrahydro-3-benzazepin-5-one
Cc1cc(C)c2c(c1Br)OC(CN)C(=O)N2	2-(aminomethyl)-8-bromo-5,7-dimethyl-4H-1,4-benzoxazin-3-one
O=C1CC2CN(Cc3ccccc3)CCN2c2ncc(C(F)(F)F)cc2N1	13-benzyl-5-(trifluoromethyl)-1,3,8,13-tetrazatricyclo[9.4.0.02,7]pentadeca-2(7),3,5-trien-9-one
C=c1cccc/c1=C(/[O-])[N-]c1ccccc1.[Li+].[Li+]	dilithium;(Z)-(6-methylidenecyclohexa-2,4-dien-1-ylidene)-phenylazanidylmethanolate
CCCCCCCC1CCC(c2cc(F)c(C3CCc4cc(OC(F)(F)F)c(F)cc4C3)c(F)c2)CC1	2-[2,6-difluoro-4-(4-heptylcyclohexyl)phenyl]-7-fluoro-6-(trifluoromethoxy)-1,2,3,4-tetrahydronaphthalene
CC(C)OC(=O)c1cc2ccccc2cc1Cl	propan-2-yl 3-chloronaphthalene-2-carboxylate
Cc1nn(CC(C)C)c(C)c1CCC(=O)NCc1cccc(COCc2ccccc2)c1	3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-N-[[3-(phenylmethoxymethyl)phenyl]methyl]propanamide
CC(C)NCc1ccc(CS(=O)(=O)C(C)(C)C)o1	N-[[5-(tert-butylsulfonylmethyl)furan-2-yl]methyl]propan-2-amine
COc1ccc(NC(=O)Cc2ccc(-c3ccccc3)cc2)cc1OC	N-(3,4-dimethoxyphenyl)-2-(4-phenylphenyl)acetamide
CC(CO)OC(CO)C(O)C(C)OC1OC(C(=O)O)C(C)C(O)C1O	6-[3,5-dihydroxy-4-(1-hydroxypropan-2-yloxy)pentan-2-yl]oxy-4,5-dihydroxy-3-methyloxane-2-carboxylic acid
CN=C(NCc1ccccc1NS(C)(=O)=O)NCc1ccc(C)cc1OC1CCCC1.I	1-[(2-cyclopentyloxy-4-methylphenyl)methyl]-3-[[2-(methanesulfonamido)phenyl]methyl]-2-methylguanidine;hydroiodide
N#Cc1c(N)nc2c(c1-c1ccccc1Cn1cccn1)CC(N)CC2	2,6-diamino-4-[2-(pyrazol-1-ylmethyl)phenyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile
CCCCNC(=O)[C@@H](C)N(Cc1ccccc1F)C(=O)CSCc1ccc(Cl)c(Cl)c1	(2R)-N-butyl-2-[[2-[(3,4-dichlorophenyl)methylsulfanyl]acetyl]-[(2-fluorophenyl)methyl]amino]propanamide
CCCCC(=O)Nc1ccc(C(=O)Nc2ccc(S(=O)(=O)NCCC)cc2)cc1	4-(pentanoylamino)-N-[4-(propylsulfamoyl)phenyl]benzamide
COC(C)=[N+](C)C.F[B-](F)(F)F	1-methoxyethylidene(dimethyl)azanium;tetrafluoroborate
COc1ccc(Sc2ccc(C(=O)O)cc2N)c(C(=O)O)c1	3-amino-4-(2-carboxy-4-methoxyphenyl)sulfanylbenzoic acid
CCOC(C)CNc1ccc(C(N)=S)cc1Br	3-bromo-4-(2-ethoxypropylamino)benzenecarbothioamide
CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(C[n+]3ccc4c(O)cccc4c3)CS[C@@H]12)c1coc(N)n1	(6S)-7-[[2-(2-amino-1,3-oxazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[(5-hydroxyisoquinolin-2-ium-2-yl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CCCCCCC/C=C\C/C=C\CCCCCCCCCCCCCCCCCC(=O)NC(COC1OC(CO)C(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C1O)C(O)/C=C/CC/C=C/CCCCCCCCCC	(19Z,22Z)-N-[(4E,8E)-1-[5-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxynonadeca-4,8-dien-2-yl]triaconta-19,22-dienamide
O=C1c2ccccc2C(=O)N1CCSc1nnc(Cc2ccccc2)o1	2-[2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]ethyl]isoindole-1,3-dione
CCSC1=C(C#N)[C@H](c2cccs2)C(C(=O)Nc2ccccc2OC)=C(C)N1	(4R)-5-cyano-6-ethylsulfanyl-N-(2-methoxyphenyl)-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide
Fc1ccccc1-n1ncc(-c2nnn(Cc3ccccc3)n2)c1Cl	2-benzyl-5-[5-chloro-1-(2-fluorophenyl)pyrazol-4-yl]tetrazole
Cc1csc2c(OC(=O)N(C)CCN(C)C(=O)OCc3ccc(NC(=O)[C@H](CCCNC(N)=O)NC(=O)CNC(=O)OCC4c5ccccc5-c5ccccc54)cc3)cc3c(c12)CCN3C(=O)c1cc2cc(NC(=O)c3cc4cc(OCCN5CCCC5)ccc4[nH]3)ccc2[nH]1	[1-methyl-6-[5-[[5-(2-pyrrolidin-1-ylethoxy)-1H-indole-2-carbonyl]amino]-1H-indole-2-carbonyl]-7,8-dihydrothieno[3,2-e]indol-4-yl] N-[2-[[4-[[(2S)-5-(carbamoylamino)-2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)acetyl]amino]pentanoyl]amino]phenyl]methoxycarbonyl-methylamino]ethyl]-N-methylcarbamate
CCC(O)CNc1c(F)cc(Br)cc1F	1-(4-bromo-2,6-difluoroanilino)butan-2-ol
COCCCN1CCOc2ccc(CO[C@H]3CNC[C@@H](OCC(O)COC)[C@@H]3c3ccc(COC)cc3)cc21	1-methoxy-3-[(3S,4R,5R)-4-[4-(methoxymethyl)phenyl]-5-[[4-(3-methoxypropyl)-2,3-dihydro-1,4-benzoxazin-6-yl]methoxy]piperidin-3-yl]oxypropan-2-ol
O=C(O)Cc1cc(C(=O)Cc2ccccc2)sc1-c1ccc(Cl)cc1	2-[2-(4-chlorophenyl)-5-(2-phenylacetyl)thiophen-3-yl]acetic acid
Cc1ccc(OCCCN2CCOCC2)c(Br)c1	4-[3-(2-bromo-4-methylphenoxy)propyl]morpholine
Brc1cccc2c1CC(Cc1ccccc1)NC2	3-benzyl-5-bromo-1,2,3,4-tetrahydroisoquinoline
COc1ccc(CN2Cc3ccccc3OC(CN(C)C)C2)cc1OC	1-[4-[(3,4-dimethoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-2-yl]-N,N-dimethylmethanamine
Cc1ccc(SC[C@@H](C)N)c(C)c1	(2R)-1-(2,4-dimethylphenyl)sulfanylpropan-2-amine
CCNC(=NCCCOCC1CCOCC1)NC(C)(C)C	1-tert-butyl-3-ethyl-2-[3-(oxan-4-ylmethoxy)propyl]guanidine
Fc1ccc2c(N3CCN(CCCN4Cc5ccccc5C4)CC3)n[nH]c2c1	3-[4-[3-(1,3-dihydroisoindol-2-yl)propyl]piperazin-1-yl]-6-fluoro-1H-indazole
CN(C1CCCCC1)S(=O)(=O)c1ccc2[nH]c(=O)[nH]c(=O)c2c1	N-cyclohexyl-N-methyl-2,4-dioxo-1H-quinazoline-6-sulfonamide
C[n+]1cc(F)c(Nc2cccc([N+](=O)[O-])c2)nc1Cl	2-chloro-5-fluoro-1-methyl-N-(3-nitrophenyl)pyrimidin-1-ium-4-amine
CCN(C(=O)[C@H]1CCCN1)c1cccc(F)c1	(2R)-N-ethyl-N-(3-fluorophenyl)pyrrolidine-2-carboxamide
CCn1nc(C)cc1-c1ccc2c(n1)[nH]c1ccc(C#N)cc12	2-(2-ethyl-5-methylpyrazol-3-yl)-9H-pyrido[2,3-b]indole-6-carbonitrile

CC(=O)C(NC(=O)CN(CCC(=O)O)C(C)(C)C)C(C)C

3-[tert-butyl-[2-[(2-methyl-4-oxopentan-3-yl)amino]-2-oxoethyl]amino]propanoic acid

NCCCN(CCCc1ccccc1)Cc1ccccc1

N'-benzyl-N'-(3-phenylpropyl)propane-1,3-diamine

COc1ccc(CNC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1OC

1-[(3,4-dimethoxyphenyl)methyl]-3-(4-nitrophenyl)thiourea

NC1(N2CCCC2)CCc2cc(Cl)ccc21

5-chloro-1-pyrrolidin-1-yl-2,3-dihydroinden-1-amine

Cc1ccc(-c2ccc(-c3ccc4c(c3)COC(C(F)(F)F)C4)cc2)cc1

7-[4-(4-methylphenyl)phenyl]-3-(trifluoromethyl)-3,4-dihydro-1H-isochromene

COc1cccc(C(=O)OC2CCC(O)(c3ccc4ccccc4c3)C(CN3CCN(C)CC3)C2)c1

[4-hydroxy-3-[(4-methylpiperazin-1-yl)methyl]-4-naphthalen-2-ylcyclohexyl] 3-methoxybenzoate

CCC1=Cc2ccccc2Cc2nnc(OC)n21

5-ethyl-3-methoxy-11H-[1,2,4]triazolo[3,4-b][3]benzazepine

CCOC(=O)C1CC12CCC(F)(F)[C@@H](c1ccc(OC)nc1)C2

ethyl (7R)-6,6-difluoro-7-(6-methoxypyridin-3-yl)spiro[2.5]octane-2-carboxylate

CCN1CCN(Cc2ccc(OC)c([N+](=O)[O-])c2)CC1

1-ethyl-4-[(4-methoxy-3-nitrophenyl)methyl]piperazine

Cc1nc(C(=O)N(C)Cc2cnn(C)c2C)nc(N2CC[C@@H](N(C)C)C2)c1C

4-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-N-[(1,5-dimethylpyrazol-4-yl)methyl]-N,5,6-trimethylpyrimidine-2-carboxamide

O=C(c1ccc(-c2ccccc2)cc1)N1CCN(C2CN(C(=O)c3cccc(F)c3)C2)CC1

[4-[1-(3-fluorobenzoyl)azetidin-3-yl]piperazin-1-yl]-(4-phenylphenyl)methanone

O=C(COc1cc(Cl)cc(Cl)c1)c1ccc(Cl)c(Cl)c1

2-(3,5-dichlorophenoxy)-1-(3,4-dichlorophenyl)ethanone

CCc1cc(CCC(=O)OCCO)cc(C(C)(C)CC)c1OC

2-hydroxyethyl 3-[3-ethyl-4-methoxy-5-(2-methylbutan-2-yl)phenyl]propanoate

[2H]c1c([2H])c(OC(=O)CCCC(=O)O)c([2H])c([2H])c1N=Nc1ccc(OC)cc1

5-oxo-5-[2,3,5,6-tetradeuterio-4-[(4-methoxyphenyl)diazenyl]phenoxy]pentanoic acid

CCOC(=O)c1cc(-c2ccnc(C=Cc3cccnc3)c2)[nH]c1N

ethyl 2-amino-5-[2-(2-pyridin-3-ylethenyl)pyridin-4-yl]-1H-pyrrole-3-carboxylate

CC(C)N(C(=O)CN1C(=O)N[C@](C)(c2ccccc2)C1=O)c1ccccc1

2-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-phenyl-N-propan-2-ylacetamide

CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)cc(-c4ccc(O)c(CO)c4)nc3c2)C[C@@H]1C.S

propyl (2S)-4-[4-chloro-2-[4-hydroxy-3-(hydroxymethyl)phenyl]quinoline-7-carbonyl]-2-methylpiperazine-1-carboxylate;sulfane

C#CCOc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2ccc(O)cc2)C1=O

(5E)-1-(4-hydroxyphenyl)-5-[(2-prop-2-ynoxynaphthalen-1-yl)methylidene]-1,3-diazinane-2,4,6-trione

C=C.C=O.CC.CNc1ccc(NC(=O)c2n[nH]c3ccc(-c4cncc(CN5CCOCC5)c4)cc23)cn1

ethane;ethene;formaldehyde;N-[6-(methylamino)pyridin-3-yl]-5-[5-(morpholin-4-ylmethyl)pyridin-3-yl]-1H-indazole-3-carboxamide

COC(=O)c1cc(NC(=O)Nc2ccc(C#N)cc2)ccc1OC(c1ccccc1)c1ccccc1

methyl 2-benzhydryloxy-5-[(4-cyanophenyl)carbamoylamino]benzoate

C=CCSCCNC(C)CC1COCCN1C(=O)OC(C)(C)C

tert-butyl 3-[2-(2-prop-2-enylsulfanylethylamino)propyl]morpholine-4-carboxylate

C[C@@H]1CC[C@@H]1COc1ccc(I)cc1

1-iodo-4-[[(1S,2R)-2-methylcyclobutyl]methoxy]benzene

O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1cccc(Br)c1

N-[2-[[(3-bromobenzoyl)amino]carbamoyl]phenyl]thiophene-2-sulfonamide

CC(C)(CCBr)NS(=O)(=O)C1CCCCC1

N-(4-bromo-2-methylbutan-2-yl)cyclohexanesulfonamide

O=C(Cc1ccc(Br)s1)Nc1cnccc1CO

2-(5-bromothiophen-2-yl)-N-[4-(hydroxymethyl)pyridin-3-yl]acetamide

CC(OCCOC(=O)c1ccccc1)Oc1ccc(C(C)C(C)C)cc1

2-[1-[4-(3-methylbutan-2-yl)phenoxy]ethoxy]ethyl benzoate

O=C(OCOC(=O)c1c(OC2CCc3cc(Cl)c(Cl)cc3C2)nnn1C(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1

benzoyloxymethyl 5-[(6,7-dichloro-1,2,3,4-tetrahydronaphthalen-2-yl)oxy]-3-trityltriazole-4-carboxylate

C/C=C/C1CCC(C2CCC(=C3CCC(CCC)CC3)CC2)CC1.C/C=C/CC1CCC(C2CCC(=C3CCC(CC)CC3)CC2)CC1.C=CC1CCC(C2CCC(=C3CCC(CCC)CC3)CC2)CC1.C=CCC1CCC(C2CCC(=C3CCC(CC)CC3)CC2)CC1.CCC1CCC(=C2CCC(C3CCC(C)CC3)CC2)CC1.CCCC1CCC(=C2CCC(C3CCC(C)CC3)CC2)CC1.CCCC1CCC(=C2CCC(C3CCC(CC)CC3)CC2)CC1.CCCC1CCC(=C2CCC(C3CCC(CC)CC3)CC2)CC1.CCCC1CCC(C2CCC(=C3CCC(C4CCC(CC)CC4)CC3)CC2)CC1.CCCC1CCC(C2CCC(=C3CCC(C4CCC(CCC)CC4)CC3)CC2)CC1

1-[4-[(E)-but-2-enyl]cyclohexyl]-4-(4-ethylcyclohexylidene)cyclohexane;1-(4-ethenylcyclohexyl)-4-(4-propylcyclohexylidene)cyclohexane;1-(4-ethylcyclohexyl)-4-[4-(4-propylcyclohexyl)cyclohexylidene]cyclohexane;1-(4-ethylcyclohexyl)-4-(4-propylcyclohexylidene)cyclohexane;1-ethyl-4-[4-(4-methylcyclohexyl)cyclohexylidene]cyclohexane;1-ethyl-4-[4-(4-prop-2-enylcyclohexyl)cyclohexylidene]cyclohexane;1-(4-methylcyclohexyl)-4-(4-propylcyclohexylidene)cyclohexane;1-[4-[(E)-prop-1-enyl]cyclohexyl]-4-(4-propylcyclohexylidene)cyclohexane;1-(4-propylcyclohexyl)-4-[4-(4-propylcyclohexyl)cyclohexylidene]cyclohexane

O=C(c1nc2c(s1)CCOc1cc(-c3cn[nH]c3)ccc1-2)N1CCN(CC2CC2)CC1

[4-(cyclopropylmethyl)piperazin-1-yl]-[8-(1H-pyrazol-4-yl)-4,5-dihydro-[1]benzoxepino[5,4-d][1,3]thiazol-2-yl]methanone

CCOCc1cc(C2(c3cccc(-c4cccnc4F)c3)N=C(N)N(C)C2=O)cn1CC1CC1

2-amino-5-[1-(cyclopropylmethyl)-5-(ethoxymethyl)pyrrol-3-yl]-5-[3-(2-fluoropyridin-3-yl)phenyl]-3-methylimidazol-4-one

CC1CCC(CN)CN1c1ccc([N+](=O)[O-])cc1Cl

[1-(2-chloro-4-nitrophenyl)-6-methylpiperidin-3-yl]methanamine

CC[C@H](C)[C@@H]1NCCOc2ccccc2CCCNC(=O)[C@@H](C(c2ccccc2)c2ccccc2)NC(=O)[C@@H](C)N(C)C1=O

(6S,9R,12R)-12-benzhydryl-6-[(2S)-butan-2-yl]-8,9-dimethyl-2-oxa-5,8,11,14-tetrazabicyclo[16.4.0]docosa-1(22),18,20-triene-7,10,13-trione

CCNc1ccc(C)cc1C(=O)NC(C)Cc1cccs1

2-(ethylamino)-5-methyl-N-(1-thiophen-2-ylpropan-2-yl)benzamide

O=S(=O)(Nc1cccc(Br)c1)N1CCNCC1

N-(3-bromophenyl)piperazine-1-sulfonamide

CCc1noc(COc2ccccc2CNCCOC)n1

N-[[2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methyl]-2-methoxyethanamine

CC1(C)C(=O)Nc2ccc(CC(=O)NCC3CCCO3)cc21

2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-N-(oxolan-2-ylmethyl)acetamide

Nc1ccn2c(C3CCSC3)ncc2c1

3-(thiolan-3-yl)imidazo[1,5-a]pyridin-7-amine

COc1ccccc1CCN1C[C@@H](C(=O)Nc2c(C)nn(C)c2C)CC1=O

(3S)-1-[2-(2-methoxyphenyl)ethyl]-5-oxo-N-(1,3,5-trimethylpyrazol-4-yl)pyrrolidine-3-carboxamide

O=C(/C=C/c1ccc(N2CCCC2=O)cc1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1

1-[4-[(E)-3-oxo-3-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]prop-1-enyl]phenyl]pyrrolidin-2-one

CCOC(=O)COc1ccc(-c2cc3cc4c(cc3o2)OC(C(C)(C)O)C4)cc1

ethyl 2-[4-[6-(2-hydroxypropan-2-yl)-5,6-dihydrofuro[3,2-f][1]benzofuran-2-yl]phenoxy]acetate

Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3ccc(C(=O)O)cc3)cc2)cc1

4-[[4-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoic acid

CCCC(NC)c1ccn(Cc2nc(C)cs2)c1

N-methyl-1-[1-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrol-3-yl]butan-1-amine

C=C1C(=O)[C@]23[C@H](O)[C@H]1C[C@H](O)[C@H]2[C@]12CCCC(C)(C)[C@H]1C[C@H]3O[C@@H]2OCCCn1cc(CSc2nc3ccccc3s2)nn1

(1S,2S,3S,5S,8S,9R,11R,16S,18R)-16-[3-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)triazol-1-yl]propoxy]-3,18-dihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one

OCc1cccc(Oc2ccccc2OC(F)(F)F)n1

[6-[2-(trifluoromethoxy)phenoxy]pyridin-2-yl]methanol

O=C1Nc2ccccc2C12CCN(S(=O)(=O)c1cccc(Cl)c1)C2

1'-(3-chlorophenyl)sulfonylspiro[1H-indole-3,3'-pyrrolidine]-2-one

O=C(CSCC(=O)NC1CCC1)NCCn1ccc(C(F)(F)F)cc1=O

2-[2-(cyclobutylamino)-2-oxoethyl]sulfanyl-N-[2-[2-oxo-4-(trifluoromethyl)pyridin-1-yl]ethyl]acetamide

CCCCCCCCCCCCC(CN(C)C)C(=O)O

2-[(dimethylamino)methyl]tetradecanoic acid

CCNCC(COC)N(C)CC(F)(F)F

1-N-ethyl-3-methoxy-2-N-methyl-2-N-(2,2,2-trifluoroethyl)propane-1,2-diamine

NC(c1ccc(F)cc1F)c1ccc(F)c(F)c1Br

(2-bromo-3,4-difluorophenyl)-(2,4-difluorophenyl)methanamine

O=c1[nH]c2cccc(I)c2c(Cl)c1O

4-chloro-3-hydroxy-5-iodo-1H-quinolin-2-one

CN=C(NCCCCN1CCC(Cc2ccccc2)CC1)NCCSC

1-[4-(4-benzylpiperidin-1-yl)butyl]-2-methyl-3-(2-methylsulfanylethyl)guanidine

COCCCNC(=O)CN(Cc1ccc2c(c1)OCO2)S(C)(=O)=O

2-[1,3-benzodioxol-5-ylmethyl(methylsulfonyl)amino]-N-(3-methoxypropyl)acetamide

CCN(C(=O)O)[C@@H](Cc1ccccc1)C(=O)O

(2S)-2-[carboxy(ethyl)amino]-3-phenylpropanoic acid

O=C(Nc1cccc2ccccc12)NC1CC(O)C1

1-(3-hydroxycyclobutyl)-3-naphthalen-1-ylurea

O=C(Nc1ccc(-c2n[nH]c(CC3CC3)n2)cc1)C1C=C(CN2CCSCC2)C=CC1

N-[4-[5-(cyclopropylmethyl)-1H-1,2,4-triazol-3-yl]phenyl]-3-(thiomorpholin-4-ylmethyl)cyclohexa-2,4-diene-1-carboxamide

C1=CC=C2CC2=C2CCC2=C1

tricyclo[7.2.0.02,4]undeca-1,4,6,8-tetraene

O=C(O)CCCC=CC[C@H]1C(O)CC(O)[C@@H]1COC(=O)NCc1cccc(C(F)(F)F)c1

7-[(1R,2S)-3,5-dihydroxy-2-[[3-(trifluoromethyl)phenyl]methylcarbamoyloxymethyl]cyclopentyl]hept-5-enoic acid

O=C(c1cccnc1Oc1cccc(Br)c1)N1CCN(CCO)CC1

[2-(3-bromophenoxy)pyridin-3-yl]-[4-(2-hydroxyethyl)piperazin-1-yl]methanone

CCCC(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1COc1cccc(C(F)(F)F)c1

1-[(1R)-6,7-dimethoxy-1-[[3-(trifluoromethyl)phenoxy]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]butan-1-one

CC(C)(C)c1ccc(OC(=O)COc2cccc3ccccc23)c(Br)c1

(2-bromo-4-tert-butylphenyl) 2-naphthalen-1-yloxyacetate

COc1ccnc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O[C@@H](C)[C@H](Oc2cccc(F)c2)c2ccccc2)c1OCOC(C)=O

[(1R,2S)-1-(3-fluorophenoxy)-1-phenylpropan-2-yl] (2S)-2-[[3-(acetyloxymethoxy)-4-methoxypyridine-2-carbonyl]amino]-3-phenylpropanoate

CCC(CC)(c1ccc(O)c(C)c1)c1cc(C)c(C(=O)O)s1

5-[3-(4-hydroxy-3-methylphenyl)pentan-3-yl]-3-methylthiophene-2-carboxylic acid

Cc1cn(-c2cccc3[nH]c(-c4n[nH]c5c4=C(F)C(c4cncc(NC(C)C)c4)=C[C@H](C)C=5)nc23)cn1

5-[(7S)-4-fluoro-7-methyl-3-[4-(4-methylimidazol-1-yl)-1H-benzimidazol-2-yl]-1,7-dihydrocyclohepta[c]pyrazol-5-yl]-N-propan-2-ylpyridin-3-amine

COC(=O)c1oc2c(C(=O)/C=C/c3ccc(OC)cc3)c(OCCCN3CCCCC3)ccc2c1C.Cl

methyl 7-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]-3-methyl-6-(3-piperidin-1-ylpropoxy)-1-benzofuran-2-carboxylate;hydrochloride

Cc1ccc2c(c1)C(=O)CNCC2

7-methyl-1,2,3,4-tetrahydro-3-benzazepin-5-one

Cc1cc(C)c2c(c1Br)OC(CN)C(=O)N2

2-(aminomethyl)-8-bromo-5,7-dimethyl-4H-1,4-benzoxazin-3-one

O=C1CC2CN(Cc3ccccc3)CCN2c2ncc(C(F)(F)F)cc2N1

13-benzyl-5-(trifluoromethyl)-1,3,8,13-tetrazatricyclo[9.4.0.02,7]pentadeca-2(7),3,5-trien-9-one

C=c1cccc/c1=C(/[O-])[N-]c1ccccc1.[Li+].[Li+]

dilithium;(Z)-(6-methylidenecyclohexa-2,4-dien-1-ylidene)-phenylazanidylmethanolate

CCCCCCCC1CCC(c2cc(F)c(C3CCc4cc(OC(F)(F)F)c(F)cc4C3)c(F)c2)CC1

2-[2,6-difluoro-4-(4-heptylcyclohexyl)phenyl]-7-fluoro-6-(trifluoromethoxy)-1,2,3,4-tetrahydronaphthalene

CC(C)OC(=O)c1cc2ccccc2cc1Cl

propan-2-yl 3-chloronaphthalene-2-carboxylate

Cc1nn(CC(C)C)c(C)c1CCC(=O)NCc1cccc(COCc2ccccc2)c1

3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-N-[[3-(phenylmethoxymethyl)phenyl]methyl]propanamide

CC(C)NCc1ccc(CS(=O)(=O)C(C)(C)C)o1

N-[[5-(tert-butylsulfonylmethyl)furan-2-yl]methyl]propan-2-amine

COc1ccc(NC(=O)Cc2ccc(-c3ccccc3)cc2)cc1OC

N-(3,4-dimethoxyphenyl)-2-(4-phenylphenyl)acetamide

CC(CO)OC(CO)C(O)C(C)OC1OC(C(=O)O)C(C)C(O)C1O

6-[3,5-dihydroxy-4-(1-hydroxypropan-2-yloxy)pentan-2-yl]oxy-4,5-dihydroxy-3-methyloxane-2-carboxylic acid

CN=C(NCc1ccccc1NS(C)(=O)=O)NCc1ccc(C)cc1OC1CCCC1.I

1-[(2-cyclopentyloxy-4-methylphenyl)methyl]-3-[[2-(methanesulfonamido)phenyl]methyl]-2-methylguanidine;hydroiodide

N#Cc1c(N)nc2c(c1-c1ccccc1Cn1cccn1)CC(N)CC2

2,6-diamino-4-[2-(pyrazol-1-ylmethyl)phenyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile

CCCCNC(=O)[C@@H](C)N(Cc1ccccc1F)C(=O)CSCc1ccc(Cl)c(Cl)c1

(2R)-N-butyl-2-[[2-[(3,4-dichlorophenyl)methylsulfanyl]acetyl]-[(2-fluorophenyl)methyl]amino]propanamide

CCCCC(=O)Nc1ccc(C(=O)Nc2ccc(S(=O)(=O)NCCC)cc2)cc1

4-(pentanoylamino)-N-[4-(propylsulfamoyl)phenyl]benzamide

COC(C)=[N+](C)C.F[B-](F)(F)F

1-methoxyethylidene(dimethyl)azanium;tetrafluoroborate

COc1ccc(Sc2ccc(C(=O)O)cc2N)c(C(=O)O)c1

3-amino-4-(2-carboxy-4-methoxyphenyl)sulfanylbenzoic acid

CCOC(C)CNc1ccc(C(N)=S)cc1Br

3-bromo-4-(2-ethoxypropylamino)benzenecarbothioamide

CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(C[n+]3ccc4c(O)cccc4c3)CS[C@@H]12)c1coc(N)n1

(6S)-7-[[2-(2-amino-1,3-oxazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[(5-hydroxyisoquinolin-2-ium-2-yl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

CCCCCCC/C=C\C/C=C\CCCCCCCCCCCCCCCCCC(=O)NC(COC1OC(CO)C(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C1O)C(O)/C=C/CC/C=C/CCCCCCCCCC

(19Z,22Z)-N-[(4E,8E)-1-[5-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxynonadeca-4,8-dien-2-yl]triaconta-19,22-dienamide

O=C1c2ccccc2C(=O)N1CCSc1nnc(Cc2ccccc2)o1

2-[2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]ethyl]isoindole-1,3-dione

CCSC1=C(C#N)[C@H](c2cccs2)C(C(=O)Nc2ccccc2OC)=C(C)N1

(4R)-5-cyano-6-ethylsulfanyl-N-(2-methoxyphenyl)-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide

Fc1ccccc1-n1ncc(-c2nnn(Cc3ccccc3)n2)c1Cl

2-benzyl-5-[5-chloro-1-(2-fluorophenyl)pyrazol-4-yl]tetrazole

Cc1csc2c(OC(=O)N(C)CCN(C)C(=O)OCc3ccc(NC(=O)[C@H](CCCNC(N)=O)NC(=O)CNC(=O)OCC4c5ccccc5-c5ccccc54)cc3)cc3c(c12)CCN3C(=O)c1cc2cc(NC(=O)c3cc4cc(OCCN5CCCC5)ccc4[nH]3)ccc2[nH]1

[1-methyl-6-[5-[[5-(2-pyrrolidin-1-ylethoxy)-1H-indole-2-carbonyl]amino]-1H-indole-2-carbonyl]-7,8-dihydrothieno[3,2-e]indol-4-yl] N-[2-[[4-[[(2S)-5-(carbamoylamino)-2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)acetyl]amino]pentanoyl]amino]phenyl]methoxycarbonyl-methylamino]ethyl]-N-methylcarbamate

CCC(O)CNc1c(F)cc(Br)cc1F

1-(4-bromo-2,6-difluoroanilino)butan-2-ol

COCCCN1CCOc2ccc(CO[C@H]3CNC[C@@H](OCC(O)COC)[C@@H]3c3ccc(COC)cc3)cc21

1-methoxy-3-[(3S,4R,5R)-4-[4-(methoxymethyl)phenyl]-5-[[4-(3-methoxypropyl)-2,3-dihydro-1,4-benzoxazin-6-yl]methoxy]piperidin-3-yl]oxypropan-2-ol

O=C(O)Cc1cc(C(=O)Cc2ccccc2)sc1-c1ccc(Cl)cc1

2-[2-(4-chlorophenyl)-5-(2-phenylacetyl)thiophen-3-yl]acetic acid

Cc1ccc(OCCCN2CCOCC2)c(Br)c1

4-[3-(2-bromo-4-methylphenoxy)propyl]morpholine

Brc1cccc2c1CC(Cc1ccccc1)NC2

3-benzyl-5-bromo-1,2,3,4-tetrahydroisoquinoline

COc1ccc(CN2Cc3ccccc3OC(CN(C)C)C2)cc1OC

1-[4-[(3,4-dimethoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-2-yl]-N,N-dimethylmethanamine

Cc1ccc(SC[C@@H](C)N)c(C)c1

(2R)-1-(2,4-dimethylphenyl)sulfanylpropan-2-amine

CCNC(=NCCCOCC1CCOCC1)NC(C)(C)C

1-tert-butyl-3-ethyl-2-[3-(oxan-4-ylmethoxy)propyl]guanidine

Fc1ccc2c(N3CCN(CCCN4Cc5ccccc5C4)CC3)n[nH]c2c1

3-[4-[3-(1,3-dihydroisoindol-2-yl)propyl]piperazin-1-yl]-6-fluoro-1H-indazole

CN(C1CCCCC1)S(=O)(=O)c1ccc2[nH]c(=O)[nH]c(=O)c2c1

N-cyclohexyl-N-methyl-2,4-dioxo-1H-quinazoline-6-sulfonamide

C[n+]1cc(F)c(Nc2cccc([N+](=O)[O-])c2)nc1Cl

2-chloro-5-fluoro-1-methyl-N-(3-nitrophenyl)pyrimidin-1-ium-4-amine

CCN(C(=O)[C@H]1CCCN1)c1cccc(F)c1

(2R)-N-ethyl-N-(3-fluorophenyl)pyrrolidine-2-carboxamide

CCn1nc(C)cc1-c1ccc2c(n1)[nH]c1ccc(C#N)cc12

2-(2-ethyl-5-methylpyrazol-3-yl)-9H-pyrido[2,3-b]indole-6-carbonitrile