AdrianM0/SMILES-to-IUPAC-BOOTSTRAP-ROUND-6

SMILES stringlengths 2 1.33k	IUPAC stringlengths 6 1.6k
CCCN(CCOC(C)(C)C)C1CCCNC1	N-[2-[(2-methylpropan-2-yl)oxy]ethyl]-N-propylpiperidin-3-amine
CCCCOc1ccc(NC(=O)Nc2ccc(N3CCC(OC)C3)cc2)cc1	1-(4-butoxyphenyl)-3-[4-(3-methoxypyrrolidin-1-yl)phenyl]urea
CCOC[C@@H](n1cnc2cnc3ccccc3c21)C(O)(CC)CC	(2R)-1-ethoxy-3-ethyl-2-imidazo[4,5-c]quinolin-1-ylpentan-3-ol
CC12CC=C(n3ccnc3)C=C1C=C1SC[N+](=O)N=C12	7-imidazol-1-yl-9a-methyl-3,9-dihydroindeno[1,2-e][1,3,4]thiadiazin-2-ium 2-oxide
CCNC(=O)c1noc(-c2sc(CN)nc2C)n1	5-[2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]-N-ethyl-1,2,4-oxadiazole-3-carboxamide
CC1Cc2ccccc2N(CCOCCCl)C1	1-[2-(2-chloroethoxy)ethyl]-3-methyl-3,4-dihydro-2H-quinoline
COc1ccc(C(=O)NCCNc2ncccc2C)cc1N1CCOCC1	4-methoxy-N-[2-[(3-methylpyridin-2-yl)amino]ethyl]-3-morpholin-4-ylbenzamide
Cl.O=C(NC1CCSCC1)[C@@H]1CCNC1	(3R)-N-(thian-4-yl)pyrrolidine-3-carboxamide;hydrochloride
CCn1c(C2CCCN2C(=O)c2ccc(C(=O)N(C)C)nc2C)nc2ccccc21	5-[2-(1-ethylbenzimidazol-2-yl)pyrrolidine-1-carbonyl]-N,N,6-trimethylpyridine-2-carboxamide
C[C@H](N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O	(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-1-[(2S,3R)-2-[[(2S)-2-aminopropanoyl]amino]-3-hydroxybutanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]amino]-5-oxopentanoyl]amino]pentanedioic acid
Cc1cc(C(=O)Nc2c(O)cccc2[N+](=O)[O-])no1	N-(2-hydroxy-6-nitrophenyl)-5-methyl-1,2-oxazole-3-carboxamide
CS(=O)N(C(=O)C(NC(=O)C(CCCc1ccc(-c2ccccc2)cc1)CC(=O)O)C(C)(C)C)c1ccccc1	3-[[3,3-dimethyl-1-(N-methylsulfinylanilino)-1-oxobutan-2-yl]carbamoyl]-6-(4-phenylphenyl)hexanoic acid
Cc1cc2c(cc1-c1c(C)noc1C)ncc1nc(C3CCOCC3)n(CCOC(F)F)c12	4-[1-[2-(difluoromethoxy)ethyl]-8-methyl-2-(oxan-4-yl)imidazo[4,5-c]quinolin-7-yl]-3,5-dimethyl-1,2-oxazole
CC(C)C[C@H](NC(=O)c1ccco1)c1nc2cccnc2n1C	N-[(1S)-3-methyl-1-(3-methylimidazo[4,5-b]pyridin-2-yl)butyl]furan-2-carboxamide
Nc1c(Oc2cccc(Cl)c2F)cccc1C(=O)O	2-amino-3-(3-chloro-2-fluorophenoxy)benzoic acid
C=CCNC(=O)Cn1c(CC)nc(Cl)cc1=O	2-(4-chloro-2-ethyl-6-oxopyrimidin-1-yl)-N-prop-2-enylacetamide
CC12CCCC3(CO3)C1CC1C(C2)OC(=O)C1CN1CCN(c2cccc(Cl)c2)CC1	3-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-8a-methylspiro[3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-5,2'-oxirane]-2-one
CC(C)(C)C1=CC(=C(N=Nc2ccc(Cl)cc2)c2oc(C#N)c3ccccc23)C=C(C(C)(C)C)C1=O	3-[[(4-chlorophenyl)diazenyl]-(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2-benzofuran-1-carbonitrile
C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@@]43C)[C@@H]1CC[C@@H]2[C@@](C)(O)CCCc1ccccc1	(3S,8S,9S,10R,13S,14S,17S)-17-[(2S)-2-hydroxy-5-phenylpentan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Nc1nc2nc(Cc3ccc(Br)cc3)[nH]c2c(=O)[nH]1	2-amino-8-[(4-bromophenyl)methyl]-1,7-dihydropurin-6-one
O=C(Nc1cc2c(=O)n(CC3(O)CCNCC3)cnn2c1)c1csc(-c2ccccc2)n1	N-[3-[(4-hydroxypiperidin-4-yl)methyl]-4-oxopyrrolo[2,1-f][1,2,4]triazin-6-yl]-2-phenyl-1,3-thiazole-4-carboxamide
c1ccc(-c2nc(-c3ccc(-n4c5cc6ccccc6cc5c5cc6ccccc6cc54)cc3-c3cccc4ccccc34)nc(-c3cccc4ccccc34)n2)cc1	12-[3-naphthalen-1-yl-4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene
C[C@H]1CCCCN1C[C@H](O)c1c[nH]c2ccccc12	(1R)-1-(1H-indol-3-yl)-2-[(2S)-2-methylpiperidin-1-yl]ethanol
CCOC(=O)c1c(NC(=O)[C@@H](C)Sc2cc(Cl)ccc2Cl)sc2c1CC[C@@H](C)C2	ethyl (6R)-2-[[(2R)-2-(2,5-dichlorophenyl)sulfanylpropanoyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
O=S1CCC(N2C=NCC2)C1	3-(4,5-dihydroimidazol-1-yl)thiolane 1-oxide
COc1ccccc1Oc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)c1cnc(C)cn1	N-[2-(2-methoxyphenoxy)-5-piperidin-1-ylsulfonylphenyl]-5-methylpyrazine-2-carboxamide
O=C(Cc1cccnc1)C1C2CCCC21	1-(6-bicyclo[3.1.0]hexanyl)-2-pyridin-3-ylethanone
CC(C)[C@H]1CSC(=O)N1Cc1ccccc1	(4S)-3-benzyl-4-propan-2-yl-1,3-thiazolidin-2-one
CCNC(=O)CCNCc1cc(F)ccc1Br	3-[(2-bromo-5-fluorophenyl)methylamino]-N-ethylpropanamide
CCS(=O)(=O)c1ccc(N2CCNCC2C)cc1	1-(4-ethylsulfonylphenyl)-2-methylpiperazine
CC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)Nc1nc(CN2CC(C)OC(C)C2)cs1	2-acetamido-N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-(1H-indol-3-yl)propanamide
C=S(CCN(C)C)c1cc(Cl)c(-c2cc3cnc(Nc4ccc(NC5CCN(C)CC5)cc4)nc3n(CC(=O)N3CCCC3)c2=O)c(Cl)c1	6-[2,6-dichloro-4-[2-(dimethylamino)ethyl-methylidene-λ4-sulfanyl]phenyl]-2-[4-[(1-methylpiperidin-4-yl)amino]anilino]-8-(2-oxo-2-pyrrolidin-1-ylethyl)pyrido[2,3-d]pyrimidin-7-one
Nc1nc2ccc(Cl)cc2n1C1C2C3CCC(C3)C21	6-chloro-1-(3-tricyclo[3.2.1.02,4]octanyl)benzimidazol-2-amine
CN(CCn1cccn1)C(=O)C1CCCN(C2CCN(C(=O)C3CC3)CC2)C1	1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-methyl-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide
NC(=NCC1CCC1)NCCc1nc(-c2ccco2)n[nH]1	2-(cyclobutylmethyl)-1-[2-[3-(furan-2-yl)-1H-1,2,4-triazol-5-yl]ethyl]guanidine
NCc1sccc1S(=O)(=O)Nc1c(F)c(F)cc(F)c1F	2-(aminomethyl)-N-(2,3,5,6-tetrafluorophenyl)thiophene-3-sulfonamide
COc1ccc(C(N)Cc2cccc(O)c2)cc1C	3-[2-amino-2-(4-methoxy-3-methylphenyl)ethyl]phenol
Cc1cc(C(O)CCC2CCCO2)sc1Cl	1-(5-chloro-4-methylthiophen-2-yl)-3-(oxolan-2-yl)propan-1-ol
Cc1cc(C(=O)N2CCCC(N(C)C)C2)ccc1Br	(4-bromo-3-methylphenyl)-[3-(dimethylamino)piperidin-1-yl]methanone
c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4ccccc4)c4oc5cc6c(cc5c4c3)c3ccccc3n6-c3ccccc3)n2)cc1	2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4,7-diphenyl-[1]benzofuro[2,3-b]carbazole
COc1ccc(C(=O)O)cc1N(C)c1ncccc1Cl	3-[(3-chloropyridin-2-yl)-methylamino]-4-methoxybenzoic acid
CC(=O)c1oc(C)cc1C(=O)c1ccccc1	1-(3-benzoyl-5-methylfuran-2-yl)ethanone
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)Nc1ccncc1)OCc1ccccc1	benzyl N-[(2R)-3-(1H-indol-3-yl)-1-oxo-1-(pyridin-4-ylamino)propan-2-yl]carbamate
CC(C)(C)OC(=O)N(CCO)CCN(C(=O)O)c1ccc(NC(=O)CC23CC4CC(CC(C4)C2)C3)c2cccnc12	[5-[[2-(1-adamantyl)acetyl]amino]quinolin-8-yl]-[2-[2-hydroxyethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]carbamic acid
CC(C)(C)OC(=O)Nc1ccc(Cl)c(C(O)CCN)c1	tert-butyl N-[3-(3-amino-1-hydroxypropyl)-4-chlorophenyl]carbamate
[2H]/C(CN(C)C)=C(/[2H])C(=O)Nc1cc2c(Nc3c([2H])c([2H])c(F)c(Cl)c3[2H])c(C#N)cnc2cc1OC([2H])([2H])C	(E)-N-[4-(3-chloro-2,5,6-trideuterio-4-fluoroanilino)-3-cyano-7-(1,1-dideuterioethoxy)quinolin-6-yl]-2,3-dideuterio-4-(dimethylamino)but-2-enamide
CCOC(=O)c1ccccc1NC(=O)COc1cccc2ccc(N3CCCC3)nc12	ethyl 2-[[2-(2-pyrrolidin-1-ylquinolin-8-yl)oxyacetyl]amino]benzoate
O=C(Nc1cccc(Cl)c1)[C@@H]1[C@H]2C=CCCCC[C@H]21	(1S,8R,9S)-N-(3-chlorophenyl)bicyclo[6.1.0]non-2-ene-9-carboxamide
Cl.O=C(Nc1ccc2c(c1F)CCNC2)C1CC1c1ccc2c(c1)OCCO2	2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-fluoro-1,2,3,4-tetrahydroisoquinolin-6-yl)cyclopropane-1-carboxamide;hydrochloride
COc1ccc(-n2c(C(=O)NCc3cccc(C#N)c3)c3n(c2=O)CCN(C(=O)c2ccc(Br)c(Cl)c2)C3)cc1	7-(4-bromo-3-chlorobenzoyl)-N-[(3-cyanophenyl)methyl]-2-(4-methoxyphenyl)-3-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxamide
COC(=O)Cc1ccc(Cl)cc1N(Cc1ccc(Cl)cc1)C(=O)CCl	methyl 2-[4-chloro-2-[(2-chloroacetyl)-[(4-chlorophenyl)methyl]amino]phenyl]acetate
C[C@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)CSSCCC(=O)N1c1cccc2ccccc12	(2S)-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]-1-[(4R,7S,10S,13S,16S)-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-benzyl-16-methyl-17-naphthalen-1-yl-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]pyrrolidine-2-carboxamide
Cc1ccc(CNc2nc(Nc3ccc(C(=O)NC4CCC(N5CCN(CC6CC6)CC5)CC4)cc3F)ncc2C(F)(F)F)c(NS(C)(=O)=O)c1	N-[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]-3-fluoro-4-[[4-[[2-(methanesulfonamido)-4-methylphenyl]methylamino]-5-(trifluoromethyl)pyrimidin-2-yl]amino]benzamide
CN[C@H](C(=O)N(C)[C@H](C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)N(C)[C@H](C(=O)NCCc1cnc[nH]1)C(C)C)C(C)C)C(C)C	(2S)-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[2-(1H-imidazol-5-yl)ethylamino]-3-methyl-1-oxobutan-2-yl]-methylamino]-1-oxo-3-phenylpropan-2-yl]-methylamino]-3-methyl-1-oxobutan-2-yl]-N,3-dimethyl-2-(methylamino)butanamide
N#Cc1ccc(NC(=O)NCCN2CC[C@@H](c3ccccc3)C2)cn1	1-(6-cyanopyridin-3-yl)-3-[2-[(3S)-3-phenylpyrrolidin-1-yl]ethyl]urea
COc1cc(-c2nc3ccc([N+](=O)[O-])cc3[nH]2)cc([N+](=O)[O-])c1OCc1cccc(C)c1	2-[3-methoxy-4-[(3-methylphenyl)methoxy]-5-nitrophenyl]-6-nitro-1H-benzimidazole
N#Cc1nc(-c2cccc3ccccc23)oc1NCc1ccc(F)cc1	5-[(4-fluorophenyl)methylamino]-2-naphthalen-1-yl-1,3-oxazole-4-carbonitrile
CNc1noc2ccc(S(=O)(=O)N(CC(C)C)C(Cc3ccccc3)C(O)CNC(=O)OC3COC4OCCC34)cc12	2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl N-[2-hydroxy-3-[[3-(methylamino)-1,2-benzoxazol-5-yl]sulfonyl-(2-methylpropyl)amino]-4-phenylbutyl]carbamate
CCN1CCN(CCCCNC(=O)c2ccccc2OCc2noc(C)n2)CC1	N-[4-(4-ethylpiperazin-1-yl)butyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide
CCCC(NC(=O)C(F)(F)F)C(N)c1ccc2c(c1)N=C(N)C(C)O2.Cl.Cl	N-[1-amino-1-(3-amino-2-methyl-2H-1,4-benzoxazin-6-yl)pentan-2-yl]-2,2,2-trifluoroacetamide;dihydrochloride
CC(C)OC(=O)[C@H](Cn1ccnc1)NC(=O)c1ccc(-c2cccc(F)c2)cc1	propan-2-yl (2S)-2-[[4-(3-fluorophenyl)benzoyl]amino]-3-imidazol-1-ylpropanoate
CCCOC(=O)C[C@H]1C(=O)NCCN1Cc1cccc(OC)c1OC	propyl 2-[(2S)-1-[(2,3-dimethoxyphenyl)methyl]-3-oxopiperazin-2-yl]acetate
CCCCCCSc1nc(C)cc(CC2CC3CN(C2)C3)n1	3-[(2-hexylsulfanyl-6-methylpyrimidin-4-yl)methyl]-1-azabicyclo[3.1.1]heptane
Cc1cccc(S(C)(=O)=NC(=O)c2cncc(C#Cc3ccc(Br)cc3)c2)c1	5-[2-(4-bromophenyl)ethynyl]-N-[methyl-(3-methylphenyl)-oxo-λ6-sulfanylidene]pyridine-3-carboxamide
CC(C)(N)CC(N)C(C)(C)C(=O)SCCCCCCCOc1cc2oc(=O)c(-c3cccc(Cl)c3)cc2cn1	S-[7-[3-(3-chlorophenyl)-2-oxopyrano[3,2-c]pyridin-7-yl]oxyheptyl] 3,5-diamino-2,2,5-trimethylhexanethioate
COc1ccc(N(CCNS(=O)(=O)c2ccc(C)cc2)S(C)(=O)=O)cc1	N-[2-(4-methoxy-N-methylsulfonylanilino)ethyl]-4-methylbenzenesulfonamide
CNC(C)c1cnc(-c2cc(F)cc(F)c2)nc1C	1-[2-(3,5-difluorophenyl)-4-methylpyrimidin-5-yl]-N-methylethanamine
COC(=O)c1c(-c2ccccc2OS(=O)(=O)c2ccc(C)cc2)nn(-c2ccccc2)c1C(=O)OC	dimethyl 5-[2-(4-methylphenyl)sulfonyloxyphenyl]-2-phenylpyrazole-3,4-dicarboxylate
Cn1cc(C[C@@H](N)C(=O)NCC(=O)O)c2ccccc21	2-[[(2R)-2-amino-3-(1-methylindol-3-yl)propanoyl]amino]acetic acid
CN[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1.Cc1cc(F)ccc1[C@H]1CNCCN1	(1R)-1-[3,5-bis(trifluoromethyl)phenyl]-N-methylethanamine;(2S)-2-(4-fluoro-2-methylphenyl)piperazine
CC(=O)CCCC(C)(C)/C=C/Br	(E)-8-bromo-6,6-dimethyloct-7-en-2-one
Cc1ccsc1C(=O)N1CC2(C[C@H](COCC3CC3)CCN2C)C1	[(8R)-8-(cyclopropylmethoxymethyl)-5-methyl-2,5-diazaspiro[3.5]nonan-2-yl]-(3-methylthiophen-2-yl)methanone
C=CCC1CCN(C(=O)C(NC(=O)OCC(C)C)C2CCCCC2)C1C(=O)NC(CCC)C(=O)C(=O)NCC(=O)NC(C(=O)O)c1ccccc1	2-[[2-[[3-[[1-[2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-3-prop-2-enylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid
Cc1ccc(NC(=O)C[NH+]2CCC[C@H]3CCCC[C@@H]32)c(F)c1	2-[(4aR,8aS)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-1-ium-1-yl]-N-(2-fluoro-4-methylphenyl)acetamide
CNC(=O)/C(=N/OC)c1ccccc1CO/N=C(C)/C(=N/OC)c1ccc(C)cc1	(2E)-2-methoxyimino-2-[2-[[(E)-[(1E)-1-methoxyimino-1-(4-methylphenyl)propan-2-ylidene]amino]oxymethyl]phenyl]-N-methylacetamide
CC(C)C1C(=O)OC(=O)N1c1ccc(C(F)(F)F)cc1F	3-[2-fluoro-4-(trifluoromethyl)phenyl]-4-propan-2-yl-1,3-oxazolidine-2,5-dione
COc1ccc2cc([C@H](c3nnnn3Cc3ccccc3)N3CCN(c4ccccc4)CC3)c(=O)[nH]c2c1	3-[(R)-(1-benzyltetrazol-5-yl)-(4-phenylpiperazin-1-yl)methyl]-7-methoxy-1H-quinolin-2-one
OCCOCN1C=NCC1	2-(4,5-dihydroimidazol-1-ylmethoxy)ethanol
COc1ccc2nc(NC(=O)c3ccc(N(C)C)cc3)sc2c1	4-(dimethylamino)-N-(6-methoxy-1,3-benzothiazol-2-yl)benzamide
C[C@@H]1C(=O)C[C@@H](CC(=O)O)C1(C)C	2-[(1S,3S)-2,2,3-trimethyl-4-oxocyclopentyl]acetic acid
C=C1C=C2CCC3C(CC[C@@]4(C)C3CC[C@@H]4O)[C@@]2(CC)CC1	(10R,13S,17S)-10-ethyl-13-methyl-3-methylidene-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-ol
COC(=O)c1cc(C)c(-c2ccc(F)cc2F)cc1NC(C)=O	methyl 2-acetamido-4-(2,4-difluorophenyl)-5-methylbenzoate
CC1CCN(CC2CC23CCNCC3)C1	2-[(3-methylpyrrolidin-1-yl)methyl]-6-azaspiro[2.5]octane
CC(=O)Oc1cc(OC(C)=O)c2ccncc2c1OC(C)=O	(7,8-diacetyloxyisoquinolin-5-yl) acetate
C=CCOc1ccc(C(=O)N2CCN(Cc3ccc(OC)c(F)c3)CC2)cc1OC	[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]-(3-methoxy-4-prop-2-enoxyphenyl)methanone
CCCNC(=O)CNC(=NC)NCc1ccccc1OC	2-[[N-[(2-methoxyphenyl)methyl]-N'-methylcarbamimidoyl]amino]-N-propylacetamide
C=C([CH2+])C1C=CC(O)C(F)C1C	6-fluoro-5-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol
COC(=O)C(Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1)NC(=O)COCC(=O)O	2-[2-[[3-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl]-1-methoxy-1-oxopropan-2-yl]amino]-2-oxoethoxy]acetic acid
OB(O)C1=Cc2cc(Cl)ccc2CC1	(7-chloro-3,4-dihydronaphthalen-2-yl)boronic acid
CC(C)c1ccc(CN(c2nc3ccccn3c(=O)c2[N+](=O)[O-])C2CC2)cc1	2-[cyclopropyl-[(4-propan-2-ylphenyl)methyl]amino]-3-nitropyrido[1,2-a]pyrimidin-4-one
Cc1cc(C2=N/C(=C\c3ccc(OCc4ccc([N+](=O)[O-])cc4)cc3)C(=O)O2)ccc1[N+](=O)[O-]	(4Z)-2-(3-methyl-4-nitrophenyl)-4-[[4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-1,3-oxazol-5-one
CC[C@H](C)C([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)NS(=O)(=O)c1ccc(C2(CC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](CC(=O)CCOCCOCCOCCN3C(=O)C=CC3=O)C(C)C)CC2)cc1)OC)N(C)C(=O)[C@@H](CC(=O)[C@H](C(C)C)N(C)C)C(C)C	(2S,5S)-N-[(3R,5S)-1-[(2S)-2-[(1R,2R)-3-[[4-[1-[(3S)-6-(carbamoylamino)-3-[[(2S)-6-[2-[2-[2-(2,5-dioxopyrrol-1-yl)ethoxy]ethoxy]ethoxy]-4-oxo-2-propan-2-ylhexanoyl]amino]-2-oxohexyl]cyclopropyl]phenyl]sulfonylamino]-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl]-3-methoxy-5-methyl-1-oxoheptan-4-yl]-5-(dimethylamino)-N,6-dimethyl-4-oxo-2-propan-2-ylheptanamide
CCn1c(-c2ccc(-c3ccc4nc(-c5ccccc5)c5c(ccc6ccc(-c7ccccc7)nc65)c4c3)cc2)nc2ccccc21.CCn1c(-c2cccc(-c3ccc4nc(-c5ccccc5)c5c(ccc6ccc(-c7ccccc7)nc65)c4c3)c2)nc2ccccc21.c1ccc(-c2ccc3ccc4c5cc(-c6ccc(-n7c(-c8ccccc8)nc8ccccc87)cc6)ccc5nc(-c5ccccc5)c4c3n2)cc1.c1ccc(-c2ccc3ccc4c5cc(-c6ccc7nc(-c8ccccc8)cn7c6)ccc5nc(-c5ccccc5)c4c3n2)cc1.c1ccc(-c2ccc3ccc4c5cc(-c6cccc(-c7cn8ccccc8n7)c6)ccc5nc(-c5ccccc5)c4c3n2)cc1.c1ccc(-c2ccc3ccc4c5cc(-c6ccn7cc(-c8ccccc8)nc7c6)ccc5nc(-c5ccccc5)c4c3n2)cc1	3,5-diphenyl-9-[4-(2-phenylbenzimidazol-1-yl)phenyl]benzo[i][1,9]phenanthroline;3,5-diphenyl-9-(2-phenylimidazo[1,2-a]pyridin-6-yl)benzo[i][1,9]phenanthroline;3,5-diphenyl-9-(2-phenylimidazo[1,2-a]pyridin-7-yl)benzo[i][1,9]phenanthroline;9-[3-(1-ethylbenzimidazol-2-yl)phenyl]-3,5-diphenylbenzo[i][1,9]phenanthroline;9-[4-(1-ethylbenzimidazol-2-yl)phenyl]-3,5-diphenylbenzo[i][1,9]phenanthroline;9-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3,5-diphenylbenzo[i][1,9]phenanthroline
CN=C(NCc1ccc(C(=O)N2CCNC(=O)C2)cc1)NCc1c(C)noc1C	1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-methyl-3-[[4-(3-oxopiperazine-1-carbonyl)phenyl]methyl]guanidine
Cc1cc(C(C)Nc2ncnc(C)c2F)c(C)o1	N-[1-(2,5-dimethylfuran-3-yl)ethyl]-5-fluoro-6-methylpyrimidin-4-amine
COc1ccc(/C=N/NC(=O)Nc2ccc(-c3c(-c4ncn[nH]4)sc(N4CCOCC4)c3C#N)cc2)cc1	1-[4-[4-cyano-5-morpholin-4-yl-2-(1H-1,2,4-triazol-5-yl)thiophen-3-yl]phenyl]-3-[(E)-(4-methoxyphenyl)methylideneamino]urea
CCC(CO)NC(=O)c1csc(NC(=O)Cc2ccccc2)n1	N-(1-hydroxybutan-2-yl)-2-[(2-phenylacetyl)amino]-1,3-thiazole-4-carboxamide
Cc1ccccc1C(=O)/C(C#N)=C/c1cc(Br)c2c(c1)OCO2	(E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-(2-methylbenzoyl)prop-2-enenitrile
CCCN(CC)C(=O)C1CCCCC1(C)N.Cl	2-amino-N-ethyl-2-methyl-N-propylcyclohexane-1-carboxamide;hydrochloride
C[C@@H](O)[C@H](NC(=O)C1CC1)c1nc(C2CCCC2)no1	N-[(1S,2R)-1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-2-hydroxypropyl]cyclopropanecarboxamide

CCCN(CCOC(C)(C)C)C1CCCNC1

N-[2-[(2-methylpropan-2-yl)oxy]ethyl]-N-propylpiperidin-3-amine

CCCCOc1ccc(NC(=O)Nc2ccc(N3CCC(OC)C3)cc2)cc1

1-(4-butoxyphenyl)-3-[4-(3-methoxypyrrolidin-1-yl)phenyl]urea

CCOC[C@@H](n1cnc2cnc3ccccc3c21)C(O)(CC)CC

(2R)-1-ethoxy-3-ethyl-2-imidazo[4,5-c]quinolin-1-ylpentan-3-ol

CC12CC=C(n3ccnc3)C=C1C=C1SC[N+](=O)N=C12

7-imidazol-1-yl-9a-methyl-3,9-dihydroindeno[1,2-e][1,3,4]thiadiazin-2-ium 2-oxide

CCNC(=O)c1noc(-c2sc(CN)nc2C)n1

5-[2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]-N-ethyl-1,2,4-oxadiazole-3-carboxamide

CC1Cc2ccccc2N(CCOCCCl)C1

1-[2-(2-chloroethoxy)ethyl]-3-methyl-3,4-dihydro-2H-quinoline

COc1ccc(C(=O)NCCNc2ncccc2C)cc1N1CCOCC1

4-methoxy-N-[2-[(3-methylpyridin-2-yl)amino]ethyl]-3-morpholin-4-ylbenzamide

Cl.O=C(NC1CCSCC1)[C@@H]1CCNC1

(3R)-N-(thian-4-yl)pyrrolidine-3-carboxamide;hydrochloride

CCn1c(C2CCCN2C(=O)c2ccc(C(=O)N(C)C)nc2C)nc2ccccc21

5-[2-(1-ethylbenzimidazol-2-yl)pyrrolidine-1-carbonyl]-N,N,6-trimethylpyridine-2-carboxamide

C[C@H](N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O

(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-1-[(2S,3R)-2-[[(2S)-2-aminopropanoyl]amino]-3-hydroxybutanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]amino]-5-oxopentanoyl]amino]pentanedioic acid

Cc1cc(C(=O)Nc2c(O)cccc2[N+](=O)[O-])no1

N-(2-hydroxy-6-nitrophenyl)-5-methyl-1,2-oxazole-3-carboxamide

CS(=O)N(C(=O)C(NC(=O)C(CCCc1ccc(-c2ccccc2)cc1)CC(=O)O)C(C)(C)C)c1ccccc1

3-[[3,3-dimethyl-1-(N-methylsulfinylanilino)-1-oxobutan-2-yl]carbamoyl]-6-(4-phenylphenyl)hexanoic acid

Cc1cc2c(cc1-c1c(C)noc1C)ncc1nc(C3CCOCC3)n(CCOC(F)F)c12

4-[1-[2-(difluoromethoxy)ethyl]-8-methyl-2-(oxan-4-yl)imidazo[4,5-c]quinolin-7-yl]-3,5-dimethyl-1,2-oxazole

CC(C)C[C@H](NC(=O)c1ccco1)c1nc2cccnc2n1C

N-[(1S)-3-methyl-1-(3-methylimidazo[4,5-b]pyridin-2-yl)butyl]furan-2-carboxamide

Nc1c(Oc2cccc(Cl)c2F)cccc1C(=O)O

2-amino-3-(3-chloro-2-fluorophenoxy)benzoic acid

C=CCNC(=O)Cn1c(CC)nc(Cl)cc1=O

2-(4-chloro-2-ethyl-6-oxopyrimidin-1-yl)-N-prop-2-enylacetamide

CC12CCCC3(CO3)C1CC1C(C2)OC(=O)C1CN1CCN(c2cccc(Cl)c2)CC1

3-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-8a-methylspiro[3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-5,2'-oxirane]-2-one

CC(C)(C)C1=CC(=C(N=Nc2ccc(Cl)cc2)c2oc(C#N)c3ccccc23)C=C(C(C)(C)C)C1=O

3-[[(4-chlorophenyl)diazenyl]-(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2-benzofuran-1-carbonitrile

C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@@]43C)[C@@H]1CC[C@@H]2[C@@](C)(O)CCCc1ccccc1

(3S,8S,9S,10R,13S,14S,17S)-17-[(2S)-2-hydroxy-5-phenylpentan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

Nc1nc2nc(Cc3ccc(Br)cc3)[nH]c2c(=O)[nH]1

2-amino-8-[(4-bromophenyl)methyl]-1,7-dihydropurin-6-one

O=C(Nc1cc2c(=O)n(CC3(O)CCNCC3)cnn2c1)c1csc(-c2ccccc2)n1

N-[3-[(4-hydroxypiperidin-4-yl)methyl]-4-oxopyrrolo[2,1-f][1,2,4]triazin-6-yl]-2-phenyl-1,3-thiazole-4-carboxamide

c1ccc(-c2nc(-c3ccc(-n4c5cc6ccccc6cc5c5cc6ccccc6cc54)cc3-c3cccc4ccccc34)nc(-c3cccc4ccccc34)n2)cc1

12-[3-naphthalen-1-yl-4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene

C[C@H]1CCCCN1C[C@H](O)c1c[nH]c2ccccc12

(1R)-1-(1H-indol-3-yl)-2-[(2S)-2-methylpiperidin-1-yl]ethanol

CCOC(=O)c1c(NC(=O)[C@@H](C)Sc2cc(Cl)ccc2Cl)sc2c1CC[C@@H](C)C2

ethyl (6R)-2-[[(2R)-2-(2,5-dichlorophenyl)sulfanylpropanoyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

O=S1CCC(N2C=NCC2)C1

3-(4,5-dihydroimidazol-1-yl)thiolane 1-oxide

COc1ccccc1Oc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)c1cnc(C)cn1

N-[2-(2-methoxyphenoxy)-5-piperidin-1-ylsulfonylphenyl]-5-methylpyrazine-2-carboxamide

O=C(Cc1cccnc1)C1C2CCCC21

1-(6-bicyclo[3.1.0]hexanyl)-2-pyridin-3-ylethanone

CC(C)[C@H]1CSC(=O)N1Cc1ccccc1

(4S)-3-benzyl-4-propan-2-yl-1,3-thiazolidin-2-one

CCNC(=O)CCNCc1cc(F)ccc1Br

3-[(2-bromo-5-fluorophenyl)methylamino]-N-ethylpropanamide

CCS(=O)(=O)c1ccc(N2CCNCC2C)cc1

1-(4-ethylsulfonylphenyl)-2-methylpiperazine

CC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)Nc1nc(CN2CC(C)OC(C)C2)cs1

2-acetamido-N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-(1H-indol-3-yl)propanamide

C=S(CCN(C)C)c1cc(Cl)c(-c2cc3cnc(Nc4ccc(NC5CCN(C)CC5)cc4)nc3n(CC(=O)N3CCCC3)c2=O)c(Cl)c1

6-[2,6-dichloro-4-[2-(dimethylamino)ethyl-methylidene-λ4-sulfanyl]phenyl]-2-[4-[(1-methylpiperidin-4-yl)amino]anilino]-8-(2-oxo-2-pyrrolidin-1-ylethyl)pyrido[2,3-d]pyrimidin-7-one

Nc1nc2ccc(Cl)cc2n1C1C2C3CCC(C3)C21

6-chloro-1-(3-tricyclo[3.2.1.02,4]octanyl)benzimidazol-2-amine

CN(CCn1cccn1)C(=O)C1CCCN(C2CCN(C(=O)C3CC3)CC2)C1

1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-methyl-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide

NC(=NCC1CCC1)NCCc1nc(-c2ccco2)n[nH]1

2-(cyclobutylmethyl)-1-[2-[3-(furan-2-yl)-1H-1,2,4-triazol-5-yl]ethyl]guanidine

NCc1sccc1S(=O)(=O)Nc1c(F)c(F)cc(F)c1F

2-(aminomethyl)-N-(2,3,5,6-tetrafluorophenyl)thiophene-3-sulfonamide

COc1ccc(C(N)Cc2cccc(O)c2)cc1C

3-[2-amino-2-(4-methoxy-3-methylphenyl)ethyl]phenol

Cc1cc(C(O)CCC2CCCO2)sc1Cl

1-(5-chloro-4-methylthiophen-2-yl)-3-(oxolan-2-yl)propan-1-ol

Cc1cc(C(=O)N2CCCC(N(C)C)C2)ccc1Br

(4-bromo-3-methylphenyl)-[3-(dimethylamino)piperidin-1-yl]methanone

c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4ccccc4)c4oc5cc6c(cc5c4c3)c3ccccc3n6-c3ccccc3)n2)cc1

2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4,7-diphenyl-[1]benzofuro[2,3-b]carbazole

COc1ccc(C(=O)O)cc1N(C)c1ncccc1Cl

3-[(3-chloropyridin-2-yl)-methylamino]-4-methoxybenzoic acid

CC(=O)c1oc(C)cc1C(=O)c1ccccc1

1-(3-benzoyl-5-methylfuran-2-yl)ethanone

O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)Nc1ccncc1)OCc1ccccc1

benzyl N-[(2R)-3-(1H-indol-3-yl)-1-oxo-1-(pyridin-4-ylamino)propan-2-yl]carbamate

CC(C)(C)OC(=O)N(CCO)CCN(C(=O)O)c1ccc(NC(=O)CC23CC4CC(CC(C4)C2)C3)c2cccnc12

[5-[[2-(1-adamantyl)acetyl]amino]quinolin-8-yl]-[2-[2-hydroxyethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]carbamic acid

CC(C)(C)OC(=O)Nc1ccc(Cl)c(C(O)CCN)c1

tert-butyl N-[3-(3-amino-1-hydroxypropyl)-4-chlorophenyl]carbamate

[2H]/C(CN(C)C)=C(/[2H])C(=O)Nc1cc2c(Nc3c([2H])c([2H])c(F)c(Cl)c3[2H])c(C#N)cnc2cc1OC([2H])([2H])C

(E)-N-[4-(3-chloro-2,5,6-trideuterio-4-fluoroanilino)-3-cyano-7-(1,1-dideuterioethoxy)quinolin-6-yl]-2,3-dideuterio-4-(dimethylamino)but-2-enamide

CCOC(=O)c1ccccc1NC(=O)COc1cccc2ccc(N3CCCC3)nc12

ethyl 2-[[2-(2-pyrrolidin-1-ylquinolin-8-yl)oxyacetyl]amino]benzoate

O=C(Nc1cccc(Cl)c1)[C@@H]1[C@H]2C=CCCCC[C@H]21

(1S,8R,9S)-N-(3-chlorophenyl)bicyclo[6.1.0]non-2-ene-9-carboxamide

Cl.O=C(Nc1ccc2c(c1F)CCNC2)C1CC1c1ccc2c(c1)OCCO2

2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-fluoro-1,2,3,4-tetrahydroisoquinolin-6-yl)cyclopropane-1-carboxamide;hydrochloride

COc1ccc(-n2c(C(=O)NCc3cccc(C#N)c3)c3n(c2=O)CCN(C(=O)c2ccc(Br)c(Cl)c2)C3)cc1

7-(4-bromo-3-chlorobenzoyl)-N-[(3-cyanophenyl)methyl]-2-(4-methoxyphenyl)-3-oxo-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxamide

COC(=O)Cc1ccc(Cl)cc1N(Cc1ccc(Cl)cc1)C(=O)CCl

methyl 2-[4-chloro-2-[(2-chloroacetyl)-[(4-chlorophenyl)methyl]amino]phenyl]acetate

C[C@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)CSSCCC(=O)N1c1cccc2ccccc12

(2S)-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]-1-[(4R,7S,10S,13S,16S)-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-benzyl-16-methyl-17-naphthalen-1-yl-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]pyrrolidine-2-carboxamide

Cc1ccc(CNc2nc(Nc3ccc(C(=O)NC4CCC(N5CCN(CC6CC6)CC5)CC4)cc3F)ncc2C(F)(F)F)c(NS(C)(=O)=O)c1

N-[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]-3-fluoro-4-[[4-[[2-(methanesulfonamido)-4-methylphenyl]methylamino]-5-(trifluoromethyl)pyrimidin-2-yl]amino]benzamide

CN[C@H](C(=O)N(C)[C@H](C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)N(C)[C@H](C(=O)NCCc1cnc[nH]1)C(C)C)C(C)C)C(C)C

(2S)-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[2-(1H-imidazol-5-yl)ethylamino]-3-methyl-1-oxobutan-2-yl]-methylamino]-1-oxo-3-phenylpropan-2-yl]-methylamino]-3-methyl-1-oxobutan-2-yl]-N,3-dimethyl-2-(methylamino)butanamide

N#Cc1ccc(NC(=O)NCCN2CC[C@@H](c3ccccc3)C2)cn1

1-(6-cyanopyridin-3-yl)-3-[2-[(3S)-3-phenylpyrrolidin-1-yl]ethyl]urea

COc1cc(-c2nc3ccc([N+](=O)[O-])cc3[nH]2)cc([N+](=O)[O-])c1OCc1cccc(C)c1

2-[3-methoxy-4-[(3-methylphenyl)methoxy]-5-nitrophenyl]-6-nitro-1H-benzimidazole

N#Cc1nc(-c2cccc3ccccc23)oc1NCc1ccc(F)cc1

5-[(4-fluorophenyl)methylamino]-2-naphthalen-1-yl-1,3-oxazole-4-carbonitrile

CNc1noc2ccc(S(=O)(=O)N(CC(C)C)C(Cc3ccccc3)C(O)CNC(=O)OC3COC4OCCC34)cc12

2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl N-[2-hydroxy-3-[[3-(methylamino)-1,2-benzoxazol-5-yl]sulfonyl-(2-methylpropyl)amino]-4-phenylbutyl]carbamate

CCN1CCN(CCCCNC(=O)c2ccccc2OCc2noc(C)n2)CC1

N-[4-(4-ethylpiperazin-1-yl)butyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide

CCCC(NC(=O)C(F)(F)F)C(N)c1ccc2c(c1)N=C(N)C(C)O2.Cl.Cl

N-[1-amino-1-(3-amino-2-methyl-2H-1,4-benzoxazin-6-yl)pentan-2-yl]-2,2,2-trifluoroacetamide;dihydrochloride

CC(C)OC(=O)[C@H](Cn1ccnc1)NC(=O)c1ccc(-c2cccc(F)c2)cc1

propan-2-yl (2S)-2-[[4-(3-fluorophenyl)benzoyl]amino]-3-imidazol-1-ylpropanoate

CCCOC(=O)C[C@H]1C(=O)NCCN1Cc1cccc(OC)c1OC

propyl 2-[(2S)-1-[(2,3-dimethoxyphenyl)methyl]-3-oxopiperazin-2-yl]acetate

CCCCCCSc1nc(C)cc(CC2CC3CN(C2)C3)n1

3-[(2-hexylsulfanyl-6-methylpyrimidin-4-yl)methyl]-1-azabicyclo[3.1.1]heptane

Cc1cccc(S(C)(=O)=NC(=O)c2cncc(C#Cc3ccc(Br)cc3)c2)c1

5-[2-(4-bromophenyl)ethynyl]-N-[methyl-(3-methylphenyl)-oxo-λ6-sulfanylidene]pyridine-3-carboxamide

CC(C)(N)CC(N)C(C)(C)C(=O)SCCCCCCCOc1cc2oc(=O)c(-c3cccc(Cl)c3)cc2cn1

S-[7-[3-(3-chlorophenyl)-2-oxopyrano[3,2-c]pyridin-7-yl]oxyheptyl] 3,5-diamino-2,2,5-trimethylhexanethioate

COc1ccc(N(CCNS(=O)(=O)c2ccc(C)cc2)S(C)(=O)=O)cc1

N-[2-(4-methoxy-N-methylsulfonylanilino)ethyl]-4-methylbenzenesulfonamide

CNC(C)c1cnc(-c2cc(F)cc(F)c2)nc1C

1-[2-(3,5-difluorophenyl)-4-methylpyrimidin-5-yl]-N-methylethanamine

COC(=O)c1c(-c2ccccc2OS(=O)(=O)c2ccc(C)cc2)nn(-c2ccccc2)c1C(=O)OC

dimethyl 5-[2-(4-methylphenyl)sulfonyloxyphenyl]-2-phenylpyrazole-3,4-dicarboxylate

Cn1cc(C[C@@H](N)C(=O)NCC(=O)O)c2ccccc21

2-[[(2R)-2-amino-3-(1-methylindol-3-yl)propanoyl]amino]acetic acid

CN[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1.Cc1cc(F)ccc1[C@H]1CNCCN1

(1R)-1-[3,5-bis(trifluoromethyl)phenyl]-N-methylethanamine;(2S)-2-(4-fluoro-2-methylphenyl)piperazine

CC(=O)CCCC(C)(C)/C=C/Br

(E)-8-bromo-6,6-dimethyloct-7-en-2-one

Cc1ccsc1C(=O)N1CC2(C[C@H](COCC3CC3)CCN2C)C1

[(8R)-8-(cyclopropylmethoxymethyl)-5-methyl-2,5-diazaspiro[3.5]nonan-2-yl]-(3-methylthiophen-2-yl)methanone

C=CCC1CCN(C(=O)C(NC(=O)OCC(C)C)C2CCCCC2)C1C(=O)NC(CCC)C(=O)C(=O)NCC(=O)NC(C(=O)O)c1ccccc1

2-[[2-[[3-[[1-[2-cyclohexyl-2-(2-methylpropoxycarbonylamino)acetyl]-3-prop-2-enylpyrrolidine-2-carbonyl]amino]-2-oxohexanoyl]amino]acetyl]amino]-2-phenylacetic acid

Cc1ccc(NC(=O)C[NH+]2CCC[C@H]3CCCC[C@@H]32)c(F)c1

2-[(4aR,8aS)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-1-ium-1-yl]-N-(2-fluoro-4-methylphenyl)acetamide

CNC(=O)/C(=N/OC)c1ccccc1CO/N=C(C)/C(=N/OC)c1ccc(C)cc1

(2E)-2-methoxyimino-2-[2-[[(E)-[(1E)-1-methoxyimino-1-(4-methylphenyl)propan-2-ylidene]amino]oxymethyl]phenyl]-N-methylacetamide

CC(C)C1C(=O)OC(=O)N1c1ccc(C(F)(F)F)cc1F

3-[2-fluoro-4-(trifluoromethyl)phenyl]-4-propan-2-yl-1,3-oxazolidine-2,5-dione

COc1ccc2cc([C@H](c3nnnn3Cc3ccccc3)N3CCN(c4ccccc4)CC3)c(=O)[nH]c2c1

3-[(R)-(1-benzyltetrazol-5-yl)-(4-phenylpiperazin-1-yl)methyl]-7-methoxy-1H-quinolin-2-one

OCCOCN1C=NCC1

2-(4,5-dihydroimidazol-1-ylmethoxy)ethanol

COc1ccc2nc(NC(=O)c3ccc(N(C)C)cc3)sc2c1

4-(dimethylamino)-N-(6-methoxy-1,3-benzothiazol-2-yl)benzamide

C[C@@H]1C(=O)C[C@@H](CC(=O)O)C1(C)C

2-[(1S,3S)-2,2,3-trimethyl-4-oxocyclopentyl]acetic acid

C=C1C=C2CCC3C(CC[C@@]4(C)C3CC[C@@H]4O)[C@@]2(CC)CC1

(10R,13S,17S)-10-ethyl-13-methyl-3-methylidene-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-ol

COC(=O)c1cc(C)c(-c2ccc(F)cc2F)cc1NC(C)=O

methyl 2-acetamido-4-(2,4-difluorophenyl)-5-methylbenzoate

CC1CCN(CC2CC23CCNCC3)C1

2-[(3-methylpyrrolidin-1-yl)methyl]-6-azaspiro[2.5]octane

CC(=O)Oc1cc(OC(C)=O)c2ccncc2c1OC(C)=O

(7,8-diacetyloxyisoquinolin-5-yl) acetate

C=CCOc1ccc(C(=O)N2CCN(Cc3ccc(OC)c(F)c3)CC2)cc1OC

[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]-(3-methoxy-4-prop-2-enoxyphenyl)methanone

CCCNC(=O)CNC(=NC)NCc1ccccc1OC

2-[[N-[(2-methoxyphenyl)methyl]-N'-methylcarbamimidoyl]amino]-N-propylacetamide

C=C([CH2+])C1C=CC(O)C(F)C1C

6-fluoro-5-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol

COC(=O)C(Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1)NC(=O)COCC(=O)O

2-[2-[[3-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl]-1-methoxy-1-oxopropan-2-yl]amino]-2-oxoethoxy]acetic acid

OB(O)C1=Cc2cc(Cl)ccc2CC1

(7-chloro-3,4-dihydronaphthalen-2-yl)boronic acid

CC(C)c1ccc(CN(c2nc3ccccn3c(=O)c2[N+](=O)[O-])C2CC2)cc1

2-[cyclopropyl-[(4-propan-2-ylphenyl)methyl]amino]-3-nitropyrido[1,2-a]pyrimidin-4-one

Cc1cc(C2=N/C(=C\c3ccc(OCc4ccc([N+](=O)[O-])cc4)cc3)C(=O)O2)ccc1[N+](=O)[O-]

(4Z)-2-(3-methyl-4-nitrophenyl)-4-[[4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-1,3-oxazol-5-one

CC[C@H](C)C([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)NS(=O)(=O)c1ccc(C2(CC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](CC(=O)CCOCCOCCOCCN3C(=O)C=CC3=O)C(C)C)CC2)cc1)OC)N(C)C(=O)[C@@H](CC(=O)[C@H](C(C)C)N(C)C)C(C)C

(2S,5S)-N-[(3R,5S)-1-[(2S)-2-[(1R,2R)-3-[[4-[1-[(3S)-6-(carbamoylamino)-3-[[(2S)-6-[2-[2-[2-(2,5-dioxopyrrol-1-yl)ethoxy]ethoxy]ethoxy]-4-oxo-2-propan-2-ylhexanoyl]amino]-2-oxohexyl]cyclopropyl]phenyl]sulfonylamino]-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl]-3-methoxy-5-methyl-1-oxoheptan-4-yl]-5-(dimethylamino)-N,6-dimethyl-4-oxo-2-propan-2-ylheptanamide

CCn1c(-c2ccc(-c3ccc4nc(-c5ccccc5)c5c(ccc6ccc(-c7ccccc7)nc65)c4c3)cc2)nc2ccccc21.CCn1c(-c2cccc(-c3ccc4nc(-c5ccccc5)c5c(ccc6ccc(-c7ccccc7)nc65)c4c3)c2)nc2ccccc21.c1ccc(-c2ccc3ccc4c5cc(-c6ccc(-n7c(-c8ccccc8)nc8ccccc87)cc6)ccc5nc(-c5ccccc5)c4c3n2)cc1.c1ccc(-c2ccc3ccc4c5cc(-c6ccc7nc(-c8ccccc8)cn7c6)ccc5nc(-c5ccccc5)c4c3n2)cc1.c1ccc(-c2ccc3ccc4c5cc(-c6cccc(-c7cn8ccccc8n7)c6)ccc5nc(-c5ccccc5)c4c3n2)cc1.c1ccc(-c2ccc3ccc4c5cc(-c6ccn7cc(-c8ccccc8)nc7c6)ccc5nc(-c5ccccc5)c4c3n2)cc1

3,5-diphenyl-9-[4-(2-phenylbenzimidazol-1-yl)phenyl]benzo[i][1,9]phenanthroline;3,5-diphenyl-9-(2-phenylimidazo[1,2-a]pyridin-6-yl)benzo[i][1,9]phenanthroline;3,5-diphenyl-9-(2-phenylimidazo[1,2-a]pyridin-7-yl)benzo[i][1,9]phenanthroline;9-[3-(1-ethylbenzimidazol-2-yl)phenyl]-3,5-diphenylbenzo[i][1,9]phenanthroline;9-[4-(1-ethylbenzimidazol-2-yl)phenyl]-3,5-diphenylbenzo[i][1,9]phenanthroline;9-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3,5-diphenylbenzo[i][1,9]phenanthroline

CN=C(NCc1ccc(C(=O)N2CCNC(=O)C2)cc1)NCc1c(C)noc1C

1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-methyl-3-[[4-(3-oxopiperazine-1-carbonyl)phenyl]methyl]guanidine

Cc1cc(C(C)Nc2ncnc(C)c2F)c(C)o1

N-[1-(2,5-dimethylfuran-3-yl)ethyl]-5-fluoro-6-methylpyrimidin-4-amine

COc1ccc(/C=N/NC(=O)Nc2ccc(-c3c(-c4ncn[nH]4)sc(N4CCOCC4)c3C#N)cc2)cc1

1-[4-[4-cyano-5-morpholin-4-yl-2-(1H-1,2,4-triazol-5-yl)thiophen-3-yl]phenyl]-3-[(E)-(4-methoxyphenyl)methylideneamino]urea

CCC(CO)NC(=O)c1csc(NC(=O)Cc2ccccc2)n1

N-(1-hydroxybutan-2-yl)-2-[(2-phenylacetyl)amino]-1,3-thiazole-4-carboxamide

Cc1ccccc1C(=O)/C(C#N)=C/c1cc(Br)c2c(c1)OCO2

(E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-(2-methylbenzoyl)prop-2-enenitrile

CCCN(CC)C(=O)C1CCCCC1(C)N.Cl

2-amino-N-ethyl-2-methyl-N-propylcyclohexane-1-carboxamide;hydrochloride

C[C@@H](O)[C@H](NC(=O)C1CC1)c1nc(C2CCCC2)no1

N-[(1S,2R)-1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-2-hydroxypropyl]cyclopropanecarboxamide