AdrianM0/SMILES-to-IUPAC-BOOTSTRAP-ROUND-45

SMILES stringlengths 2 708	IUPAC stringlengths 6 1.25k
COc1ccc(C(=O)COCCCCl)cc1-c1ccc(F)cc1	2-(3-chloropropoxy)-1-[3-(4-fluorophenyl)-4-methoxyphenyl]ethanone
CC(C)(C)OC(=O)NCC(=O)OCc1ccccc1.Cc1ccc(OCc2ccccc2)c(C/C=N/N(C)C)c1	benzyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]acetate;N-methyl-N-[(E)-2-(5-methyl-2-phenylmethoxyphenyl)ethylideneamino]methanamine
CCS(=O)(=O)N1CC[C@]2(CCN(Cc3ccccc3C)C2)C1	(5S)-2-ethylsulfonyl-7-[(2-methylphenyl)methyl]-2,7-diazaspiro[4.4]nonane
CC1CC(=O)N(C(=O)c2cc(Br)cn2C2CC2)C1	1-(4-bromo-1-cyclopropylpyrrole-2-carbonyl)-4-methylpyrrolidin-2-one
Cn1cc(CC(O)c2cccc(F)c2F)cn1	1-(2,3-difluorophenyl)-2-(1-methylpyrazol-4-yl)ethanol
O=C(NC1CCCCC1)c1cccnc1Oc1ccccc1	N-cyclohexyl-2-phenoxypyridine-3-carboxamide
C1CNC2CN(C3CCN4CCCCC34)CC2C1	6-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridine
Cc1c(-c2[nH]nc3nc(N4CC[C@@H]5[C@H](C4)[C@@]5(CN)c4ncccc4F)cnc23)ccc2nn(C)cc12	[(1S,6R,7S)-3-[3-(2,4-dimethylindazol-5-yl)-2H-pyrazolo[3,4-b]pyrazin-6-yl]-7-(3-fluoropyridin-2-yl)-3-azabicyclo[4.1.0]heptan-7-yl]methanamine
CNc1cncnc1OC1CCC1	4-cyclobutyloxy-N-methylpyrimidin-5-amine
Cc1ccc(S(=O)(=O)n2c3c(c4cc(C#N)ccc42)CCCC3(O[Si](C)(C)C)C(F)(F)F)cc1	9-(4-methylphenyl)sulfonyl-8-(trifluoromethyl)-8-trimethylsilyloxy-6,7-dihydro-5H-carbazole-3-carbonitrile
C[C@@H]1CN(C(=O)[C@@H](C)n2cncn2)C[C@@H](c2ccccc2)O1	(2R)-1-[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-2-(1,2,4-triazol-1-yl)propan-1-one
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(S(=O)(=O)c2ccc(C#N)cc2)cc1.COc1ccc2c(c1)c1cc(OC)ccc1n2-c1ccc(S(=O)(=O)c2ccc(C#N)cc2)cc1.N#Cc1ccc(S(=O)(=O)c2ccc(-n3c4ccc(-n5c6ccccc6c6ccccc65)cc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)cc2)cc1.N#Cc1ccc(S(=O)(=O)c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1	4-(4-carbazol-9-ylphenyl)sulfonylbenzonitrile;4-[4-(3,6-ditert-butylcarbazol-9-yl)phenyl]sulfonylbenzonitrile;4-[4-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]sulfonylbenzonitrile;4-[4-(3,6-dimethoxycarbazol-9-yl)phenyl]sulfonylbenzonitrile
CCCCC=O.Cc1ccccc1	pentanal;toluene
C/C=C/c1ccc(OCCCn2c(CCCCCNC(=O)c3cccc(Cl)c3)nc3ccccc32)c(OC)c1	3-chloro-N-[5-[1-[3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propyl]benzimidazol-2-yl]pentyl]benzamide
Cc1noc(-c2ccccc2C(=O)N2CCC(c3nc(C)no3)C2)n1	[2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]-[3-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]methanone
CCCCCCOC(=O)CCNC(=O)CCNC(=O)c1ccccc1C	hexyl 3-[3-[(2-methylbenzoyl)amino]propanoylamino]propanoate
O=C(COc1ncnc2scc(-c3ccccc3)c12)Nc1ccc(OCc2ccccc2)cc1	N-(4-phenylmethoxyphenyl)-2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide
CC1SCc2ncnc(N3CCN(C(=O)[C@H](N)Cc4ccc(Cl)c(F)c4)CC3)c21	(2R)-2-amino-3-(4-chloro-3-fluorophenyl)-1-[4-(5-methyl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl)piperazin-1-yl]propan-1-one
c1ccc2c(c1)CCCC2CNCCCNC1CC1	N'-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)propane-1,3-diamine
CC1(C)[C@H]2CC[C@@]1(CS(=O)(=O)Nc1ccc3c(c1)OCCCO3)C(=O)C2	N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-[(1S,4S)-7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl]methanesulfonamide
CC(C)(C)c1ccc(CCCC(=O)O)c(N)c1	4-(2-amino-4-tert-butylphenyl)butanoic acid
CC(C)(C)NCCC(=O)Nc1c(F)cc(Br)cc1F	N-(4-bromo-2,6-difluorophenyl)-3-(tert-butylamino)propanamide
CCNC(=NCC1(CCO)CCOC1)NCCN(CC)c1cccc(C)c1.I	1-ethyl-3-[2-(N-ethyl-3-methylanilino)ethyl]-2-[[3-(2-hydroxyethyl)oxolan-3-yl]methyl]guanidine;hydroiodide
Nc1cc(F)cc(S(=O)(=O)NCc2ccno2)c1	3-amino-5-fluoro-N-(1,2-oxazol-5-ylmethyl)benzenesulfonamide
BrP(Cc1[nH]nc2ccc(I)cc12)(c1ccccc1)(c1ccccc1)c1ccccc1	bromo-[(5-iodo-2H-indazol-3-yl)methyl]-triphenyl-λ5-phosphane
CN(CC(=O)Nc1ccc(CN2CCCC2)cc1)S(=O)(=O)c1cccs1	2-[methyl(thiophen-2-ylsulfonyl)amino]-N-[4-(pyrrolidin-1-ylmethyl)phenyl]acetamide
CCOC(=O)C(C)CN1CC(C)CC(N)C1	ethyl 3-(3-amino-5-methylpiperidin-1-yl)-2-methylpropanoate
CN(C)C(=O)c1ccc(NCc2ccc(O)c(O)c2)cc1	4-[(3,4-dihydroxyphenyl)methylamino]-N,N-dimethylbenzamide
C=C[C@@H](C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)O)C(C)C	[(2S)-1-[[(2S)-1-[[(2S,3S,5S)-1-cyclohexyl-3-hydroxy-5-propan-2-ylhept-6-en-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-3-naphthalen-1-yl-1-oxopropan-2-yl]carbamic acid
COc1cc2c(cc1OCC(F)(F)F)CCN1C[C@H](CC(C)C)[C@@H](C)C[C@@]21C	(2S,3R,11bS)-10-methoxy-2,11b-dimethyl-3-(2-methylpropyl)-9-(2,2,2-trifluoroethoxy)-1,2,3,4,6,7-hexahydrobenzo[a]quinolizine
Cc1cc(OCC(=O)N2CCCC2C(=O)Nc2nccs2)c(C(C)C)cc1Cl	1-[2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)acetyl]-N-(1,3-thiazol-2-yl)pyrrolidine-2-carboxamide
CC(C)(F)CN1CCC(COc2ccc(-c3ccc(C(=O)N4CCCC(O)C4)c(F)c3F)cc2)CC1	[2,3-difluoro-4-[4-[[1-(2-fluoro-2-methylpropyl)piperidin-4-yl]methoxy]phenyl]phenyl]-(3-hydroxypiperidin-1-yl)methanone
CC(=O)O[C@@H]1CC[C@@]2(C)[C@H](CC[C@@H]3[C@@H]2CC[C@]2(C)[C@@H]4[C@H](C[C@@H]32)O[C@@]2(OC[C@H](C)C[C@@H]2OC(C)=O)[C@H]4C)C1	[(1R,2S,3'S,4S,5'R,6S,7S,8R,9S,12S,13S,16R,18R)-3'-acetyloxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl] acetate
CNC(=O)c1ccc(CN2CCC(C(O)c3nccn3C)CC2)cc1	4-[[4-[hydroxy-(1-methylimidazol-2-yl)methyl]piperidin-1-yl]methyl]-N-methylbenzamide
Cc1cc(Br)ccc1S(=O)(=O)N1C[C@H]2CNC[C@H]2C1.Cl	(3aS,6aR)-5-(4-bromo-2-methylphenyl)sulfonyl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;hydrochloride
C[C@@H](Oc1ccc2c(-c3ccc(F)cc3Cl)ccnc2c1)C(=O)N1CCC=C(C(=O)O)C1	1-[(2R)-2-[4-(2-chloro-4-fluorophenyl)quinolin-7-yl]oxypropanoyl]-3,6-dihydro-2H-pyridine-5-carboxylic acid
CCN1C(=O)C[C@](CC(=O)N(C)C[C@H]2CCCCO2)(c2cccc(C(F)(F)F)c2)C1=O	2-[(3R)-1-ethyl-2,5-dioxo-3-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl]-N-methyl-N-[[(2R)-oxan-2-yl]methyl]acetamide
CCCCCCOc1ccccc1C(=O)Nc1ccccc1C(=O)N1CCC(C)CC1	2-hexoxy-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]benzamide
CCOc1cc(/C=C2\SC(=Nc3ccc(Cl)cc3Cl)NC2=O)cc(Cl)c1OCc1ccccc1Cl	(5Z)-5-[[3-chloro-4-[(2-chlorophenyl)methoxy]-5-ethoxyphenyl]methylidene]-2-(2,4-dichlorophenyl)imino-1,3-thiazolidin-4-one
COc1cc2nc(-c3ccc(Cl)cc3O)[nH]c2cc1OC	5-chloro-2-(5,6-dimethoxy-1H-benzimidazol-2-yl)phenol
CC1CC1C(=O)N1CCCCC1CO	[2-(hydroxymethyl)piperidin-1-yl]-(2-methylcyclopropyl)methanone
CCOc1ccccc1C(C)(NCC(F)(F)F)C(=O)OC	methyl 2-(2-ethoxyphenyl)-2-(2,2,2-trifluoroethylamino)propanoate
Oc1ccc(C2(O)c3ccccc3C(O)C2O)cc1	3-(4-hydroxyphenyl)-1,2-dihydroindene-1,2,3-triol
Cc1c(-c2cc(Nc3ccc(N4CCN(C)CC4)cn3)c(=O)n(C)c2)cccc1N1/C=C\c2cc(C3CC3)cc(F)c2COC1.[HH]	5-[3-[(5Z)-8-cyclopropyl-10-fluoro-1,3-dihydro-2,4-benzoxazocin-4-yl]-2-methylphenyl]-1-methyl-3-[[5-(4-methylpiperazin-1-yl)pyridin-2-yl]amino]pyridin-2-one;molecular hydrogen
CC(C)c1ccnc2c1N(c1ccccc1)[CH-]N2c1[c-]cccc1.[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1N1[CH-]N(c2ccccc2)c2c(C3CCCC3)ccnc21.[c-]1ccccc1N1[CH-]N(c2ccccc2)c2cc(Oc3ccccc3)cnc21.[c-]1ccccc1N1[CH-]N(c2ccccc2)c2ccc(Oc3ccccc3)nc21	7-cyclopentyl-1-phenyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;iridium;5-phenoxy-1-phenyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;6-phenoxy-1-phenyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;1-phenyl-3-phenyl-7-propan-2-yl-2H-imidazo[4,5-b]pyridin-2-ide
CCOC(=O)c1nn(CC(=O)NC(CCC=C(C)F)c2ccccn2)c2c1CC1CC2C1	ethyl 3-[2-[(5-fluoro-1-pyridin-2-ylhex-4-enyl)amino]-2-oxoethyl]-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene-5-carboxylate
CC(C)(CCCC1CCCCC1)C(=O)Nc1ccc(F)cc1F	5-cyclohexyl-N-(2,4-difluorophenyl)-2,2-dimethylpentanamide
CC1CNCC1C(=O)OCc1ccccc1Cl	(2-chlorophenyl)methyl 4-methylpyrrolidine-3-carboxylate
CC1CCCN(C(C)(C)CNC(=O)c2cc(-c3ccco3)on2)C1	5-(furan-2-yl)-N-[2-methyl-2-(3-methylpiperidin-1-yl)propyl]-1,2-oxazole-3-carboxamide
CCc1ccc(C(CNC(=O)CCC(=O)N2CCOc3ccccc32)N(C)C)cc1	4-(2,3-dihydro-1,4-benzoxazin-4-yl)-N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-4-oxobutanamide
O=C(O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc2c(c1)OCC(F)O2)c1cccs1	[(1S)-2-(3,5-dichloro-1-oxidopyridin-1-ium-4-yl)-1-(2-fluoro-2,3-dihydro-1,4-benzodioxin-6-yl)ethyl] thiophene-2-carboxylate
COc1ccccc1-n1nc(C(=O)NCc2csc(-c3cccnc3)n2)c(O)cc1=O	4-hydroxy-1-(2-methoxyphenyl)-6-oxo-N-[(2-pyridin-3-yl-1,3-thiazol-4-yl)methyl]pyridazine-3-carboxamide
COc1c(C)cccc1CN1CCC(c2c(C(=O)NCCO)sc3ncccc23)C1	N-(2-hydroxyethyl)-3-[1-[(2-methoxy-3-methylphenyl)methyl]pyrrolidin-3-yl]thieno[2,3-b]pyridine-2-carboxamide
CC(C)CC(NC(=O)C(CC(C)C)NC(=O)C(CCC(=O)O)NC(=O)C(N)Cc1c[nH]c2ccccc12)C(=O)O	2-[[2-[[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoic acid
C=CC(=O)CC(C)C1CCC1	5-cyclobutylhex-1-en-3-one
CN(C1=NC(C)(C2=CCC(C)(F)C=C2)C(C#N)S1)c1cn(C2CC2)c(=O)c2ccc(N3CC4(CC(O)C4)C3)cc12	2-[[2-cyclopropyl-6-(6-hydroxy-2-azaspiro[3.3]heptan-2-yl)-1-oxoisoquinolin-4-yl]-methylamino]-4-(4-fluoro-4-methylcyclohexa-1,5-dien-1-yl)-4-methyl-5H-1,3-thiazole-5-carbonitrile
COC(=O)[C@@H]1CC[C@@H](Sc2ccccc2)N1C(=O)OC	dimethyl (2S,5R)-5-phenylsulfanylpyrrolidine-1,2-dicarboxylate
CC(C)CNCC(Cc1ccc(Cl)c(Cl)c1)C(C)C	2-[(3,4-dichlorophenyl)methyl]-3-methyl-N-(2-methylpropyl)butan-1-amine
Cc1cc(N2CCN(C(=O)c3sc4ccccc4c3C)CC2)nc(C(C)C)n1	(3-methyl-1-benzothiophen-2-yl)-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]methanone
COC(CNC(=O)C1CC1C(=O)O)C(C)(C)C	2-[(2-methoxy-3,3-dimethylbutyl)carbamoyl]cyclopropane-1-carboxylic acid
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(Sc4nc5ccccc5s4)o3)c(=O)n2C1c1cccc2ccc(OC)cc12	ethyl (2E)-2-[[5-(1,3-benzothiazol-2-ylsulfanyl)furan-2-yl]methylidene]-5-(7-methoxynaphthalen-1-yl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
CCN(CCC(=O)OC)S(=O)(=O)c1cc(Cl)ccc1Cl	methyl 3-[(2,5-dichlorophenyl)sulfonyl-ethylamino]propanoate
CCC(CC)C(C)NS(=O)(=O)c1cc(CO)sc1C	N-(3-ethylpentan-2-yl)-5-(hydroxymethyl)-2-methylthiophene-3-sulfonamide
CCOC(=O)C1(Cc2ccccc2)CCN(C(=O)C(Cc2ccc3ccccc3c2)N(C)C(=O)/C=C/CC(C)(C)N)CC1	ethyl 1-[2-[[(E)-5-amino-5-methylhex-2-enoyl]-methylamino]-3-naphthalen-2-ylpropanoyl]-4-benzylpiperidine-4-carboxylate
Cc1ccc(F)cc1Oc1cc(Br)nc(C(C)C)n1	4-bromo-6-(5-fluoro-2-methylphenoxy)-2-propan-2-ylpyrimidine
CC1C=C(c2cc(-c3ccccc3)cc(-c3ccccc3)n2)C=CC1C1c2cccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3)c2C=CC1C	2-[4-[5-[4-(4,6-diphenylpyridin-2-yl)-6-methylcyclohexa-2,4-dien-1-yl]-6-methyl-5,6-dihydronaphthalen-1-yl]phenyl]-4,6-diphenyl-1,3,5-triazine
CC(Nc1cccc(F)c1)c1cc(F)ccc1F	N-[1-(2,5-difluorophenyl)ethyl]-3-fluoroaniline
Cl.NC[C@@H]1CN(C(=O)CCOc2ccccc2Cl)C[C@H]1c1ccccc1	1-[(3R,4R)-3-(aminomethyl)-4-phenylpyrrolidin-1-yl]-3-(2-chlorophenoxy)propan-1-one;hydrochloride
CN=C(NCc1ccsc1)NCc1cccc(Cn2cccn2)c1	2-methyl-1-[[3-(pyrazol-1-ylmethyl)phenyl]methyl]-3-(thiophen-3-ylmethyl)guanidine
COc1cccc(-n2cnnc2SC[C@H](O)COc2ccc(Cl)cc2)c1	(2R)-1-(4-chlorophenoxy)-3-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]propan-2-ol
CN=C(NCc1cccc(OCC(C)C)c1)NCC1CC(=O)Nc2ccccc21.I	2-methyl-1-[[3-(2-methylpropoxy)phenyl]methyl]-3-[(2-oxo-3,4-dihydro-1H-quinolin-4-yl)methyl]guanidine;hydroiodide
C[C@@H]1C[C@@H](CN2c3ccccc3Sc3ccccc32)[C@@H](C)N1C	10-[[(2R,3S,5R)-1,2,5-trimethylpyrrolidin-3-yl]methyl]phenothiazine
CC(CCC(=O)Nc1cccc(Br)c1)ON1C(=O)c2ccccc2C1=O	N-(3-bromophenyl)-4-(1,3-dioxoisoindol-2-yl)oxypentanamide
CN(C)C(=O)C=N.[Cl-].[Cl-]	2-imino-N,N-dimethylacetamide;dichloride
Cc1ccc2c(c1)OC(C)(C)CC2NC(=O)CCCN(c1cccc(C)c1C)S(C)(=O)=O	4-(2,3-dimethyl-N-methylsulfonylanilino)-N-(2,2,7-trimethyl-3,4-dihydrochromen-4-yl)butanamide
C[Si](C)(C)Cn1cc(F)c(=O)n(C[Si](C)(C)C)c1=O	5-fluoro-1,3-bis(trimethylsilylmethyl)pyrimidine-2,4-dione
C[C@H](C(=O)N1C[C@H](C)O[C@@H](C)C1)N(C)CC(=O)Nc1ccc(F)c(F)c1F	2-[[(2R)-1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-1-oxopropan-2-yl]-methylamino]-N-(2,3,4-trifluorophenyl)acetamide
CC(C)Oc1ccc(N2CCN(C(=O)C(=O)Nc3ccc4[nH]c(=O)oc4c3)[C@H](C)C2)cc1F	2-[(2R)-4-(3-fluoro-4-propan-2-yloxyphenyl)-2-methylpiperazin-1-yl]-2-oxo-N-(2-oxo-3H-1,3-benzoxazol-6-yl)acetamide
Cc1[nH]c(=S)[nH]c(=O)c1N=Nc1ccccc1O	5-[(2-hydroxyphenyl)diazenyl]-6-methyl-2-sulfanylidene-1H-pyrimidin-4-one
COCC(C)NC(=O)CNc1ccc(C#N)cc1Br	2-(2-bromo-4-cyanoanilino)-N-(1-methoxypropan-2-yl)acetamide
c1ccc2c(c1)NCC(c1nc(C3CCOC3)no1)O2	2-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]-3,4-dihydro-2H-1,4-benzoxazine
Cc1cc(S(=O)(=O)N[C@@H](C)COC2CCC(CN3CCN(c4ccc5c(c4F)n(C)c(=O)n5C4CCC(=O)NC4=O)CC3)CC2)ccc1Nc1ncc(C(F)(F)F)c(N2CC[C@H](C(C)(C)O)C2)n1	N-[(2S)-1-[4-[[4-[1-(2,6-dioxopiperidin-3-yl)-4-fluoro-3-methyl-2-oxobenzimidazol-5-yl]piperazin-1-yl]methyl]cyclohexyl]oxypropan-2-yl]-4-[[4-[(3S)-3-(2-hydroxypropan-2-yl)pyrrolidin-1-yl]-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3-methylbenzenesulfonamide
C/C=C/C(OC(=O)c1ccc(N=[N+]=[N-])cc1)n1cnc2c(=O)n(C)c(=O)n(C)c21	[(E)-1-(1,3-dimethyl-2,6-dioxopurin-9-yl)but-2-enyl] 4-azidobenzoate
COc1c(C(O)CN)cc2c(c1Cl)OCC2	2-amino-1-(7-chloro-6-methoxy-2,3-dihydro-1-benzofuran-5-yl)ethanol
CCC(CO)NC1C(=O)Nc2cccc(Br)c21	4-bromo-3-(1-hydroxybutan-2-ylamino)-1,3-dihydroindol-2-one
C#Cc1c(F)ccc2cc(O)cc(-c3ncc4c(N5CCOCC5)nc(N5CC[C@H](N(C)C)C5)nc4c3F)c12	4-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-8-fluoro-4-morpholin-4-ylpyrido[4,3-d]pyrimidin-7-yl]-5-ethynyl-6-fluoronaphthalen-2-ol
O=C1[C@H](N2CCCS(=O)(=O)CC2)CCN1c1ccccc1F	(3R)-3-(1,1-dioxo-1,4-thiazepan-4-yl)-1-(2-fluorophenyl)pyrrolidin-2-one
CC(C)C(NC(=O)c1cc(Cl)cc(Br)c1)c1ccccc1	3-bromo-5-chloro-N-(2-methyl-1-phenylpropyl)benzamide
Cc1ccc(-c2nc(-c3cc(CCC(=O)C(C)(C)C(F)(F)F)ccc3Cl)[nH]c(=O)n2)cc1Cl	4-(3-chloro-4-methylphenyl)-6-[2-chloro-5-(5,5,5-trifluoro-4,4-dimethyl-3-oxopentyl)phenyl]-1H-1,3,5-triazin-2-one
CCOCc1cccc(NC(=O)CN2CCC(C)CC2)c1	N-[3-(ethoxymethyl)phenyl]-2-(4-methylpiperidin-1-yl)acetamide
CCOc1ccc(/C(O)=C2\C(=O)C(=O)N(c3ccc4c(c3)OCCO4)C2c2cccc(OC)c2)cc1C	(4E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(4-ethoxy-3-methylphenyl)-hydroxymethylidene]-5-(3-methoxyphenyl)pyrrolidine-2,3-dione
CC1=CC=C(C(C)(c2ccc(C)cc2)c2ccc(C)cc2)CC1	1-methyl-4-[1-(4-methylcyclohexa-1,3-dien-1-yl)-1-(4-methylphenyl)ethyl]benzene
C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCC2)Oc2ncc(C3=CCCC3)cc2C1=O	N-[[(2S,3S)-8-(cyclopenten-1-yl)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methylcyclobutanecarboxamide
CCC(O)CNC(=O)c1c(I)c(NC(=O)CCO)c(I)c(C(=O)N(C)CC(O)CO)c1I	3-N-(2,3-dihydroxypropyl)-1-N-(2-hydroxybutyl)-5-(3-hydroxypropanoylamino)-2,4,6-triiodo-3-N-methylbenzene-1,3-dicarboxamide
CCCNc1cc(N2CCC(C(N)=O)C2)nc(CC)n1	1-[2-ethyl-6-(propylamino)pyrimidin-4-yl]pyrrolidine-3-carboxamide
Brc1ccccc1Nc1cnnc(NC2CC2)n1	5-N-(2-bromophenyl)-3-N-cyclopropyl-1,2,4-triazine-3,5-diamine
COc1cnccc1C(=O)NCC1CCCC1N	N-[(2-aminocyclopentyl)methyl]-3-methoxypyridine-4-carboxamide
c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4cccc(-c5ccc6cc7oc8ccccc8c7cc6c5)c4)n3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc5cc6oc7ccccc7c6cc45)c4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4cccc5c4ccc4sc6ccccc6c45)c3)n2)cc1	2-(4-naphtho[6,7-b][1]benzofuran-10-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(3-naphtho[2,3-b][1]benzofuran-9-ylphenyl)-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine;2-(3-naphtho[2,1-b][1]benzothiol-4-ylphenyl)-4,6-diphenyl-1,3,5-triazine
CCCC1CC1Nc1ccc(Cl)cn1	5-chloro-N-(2-propylcyclopropyl)pyridin-2-amine
c1ccc(CN2CC3CNCC(C3)C2)nc1	3-(pyridin-2-ylmethyl)-3,7-diazabicyclo[3.3.1]nonane

COc1ccc(C(=O)COCCCCl)cc1-c1ccc(F)cc1

2-(3-chloropropoxy)-1-[3-(4-fluorophenyl)-4-methoxyphenyl]ethanone

CC(C)(C)OC(=O)NCC(=O)OCc1ccccc1.Cc1ccc(OCc2ccccc2)c(C/C=N/N(C)C)c1

benzyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]acetate;N-methyl-N-[(E)-2-(5-methyl-2-phenylmethoxyphenyl)ethylideneamino]methanamine

CCS(=O)(=O)N1CC[C@]2(CCN(Cc3ccccc3C)C2)C1

(5S)-2-ethylsulfonyl-7-[(2-methylphenyl)methyl]-2,7-diazaspiro[4.4]nonane

CC1CC(=O)N(C(=O)c2cc(Br)cn2C2CC2)C1

1-(4-bromo-1-cyclopropylpyrrole-2-carbonyl)-4-methylpyrrolidin-2-one

Cn1cc(CC(O)c2cccc(F)c2F)cn1

1-(2,3-difluorophenyl)-2-(1-methylpyrazol-4-yl)ethanol

O=C(NC1CCCCC1)c1cccnc1Oc1ccccc1

N-cyclohexyl-2-phenoxypyridine-3-carboxamide

C1CNC2CN(C3CCN4CCCCC34)CC2C1

6-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridine

Cc1c(-c2[nH]nc3nc(N4CC[C@@H]5[C@H](C4)[C@@]5(CN)c4ncccc4F)cnc23)ccc2nn(C)cc12

[(1S,6R,7S)-3-[3-(2,4-dimethylindazol-5-yl)-2H-pyrazolo[3,4-b]pyrazin-6-yl]-7-(3-fluoropyridin-2-yl)-3-azabicyclo[4.1.0]heptan-7-yl]methanamine

CNc1cncnc1OC1CCC1

4-cyclobutyloxy-N-methylpyrimidin-5-amine

Cc1ccc(S(=O)(=O)n2c3c(c4cc(C#N)ccc42)CCCC3(O[Si](C)(C)C)C(F)(F)F)cc1

9-(4-methylphenyl)sulfonyl-8-(trifluoromethyl)-8-trimethylsilyloxy-6,7-dihydro-5H-carbazole-3-carbonitrile

C[C@@H]1CN(C(=O)[C@@H](C)n2cncn2)C[C@@H](c2ccccc2)O1

(2R)-1-[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-2-(1,2,4-triazol-1-yl)propan-1-one

CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(S(=O)(=O)c2ccc(C#N)cc2)cc1.COc1ccc2c(c1)c1cc(OC)ccc1n2-c1ccc(S(=O)(=O)c2ccc(C#N)cc2)cc1.N#Cc1ccc(S(=O)(=O)c2ccc(-n3c4ccc(-n5c6ccccc6c6ccccc65)cc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)cc2)cc1.N#Cc1ccc(S(=O)(=O)c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1

4-(4-carbazol-9-ylphenyl)sulfonylbenzonitrile;4-[4-(3,6-ditert-butylcarbazol-9-yl)phenyl]sulfonylbenzonitrile;4-[4-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]sulfonylbenzonitrile;4-[4-(3,6-dimethoxycarbazol-9-yl)phenyl]sulfonylbenzonitrile

CCCCC=O.Cc1ccccc1

pentanal;toluene

C/C=C/c1ccc(OCCCn2c(CCCCCNC(=O)c3cccc(Cl)c3)nc3ccccc32)c(OC)c1

3-chloro-N-[5-[1-[3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propyl]benzimidazol-2-yl]pentyl]benzamide

Cc1noc(-c2ccccc2C(=O)N2CCC(c3nc(C)no3)C2)n1

[2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]-[3-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]methanone

CCCCCCOC(=O)CCNC(=O)CCNC(=O)c1ccccc1C

hexyl 3-[3-[(2-methylbenzoyl)amino]propanoylamino]propanoate

O=C(COc1ncnc2scc(-c3ccccc3)c12)Nc1ccc(OCc2ccccc2)cc1

N-(4-phenylmethoxyphenyl)-2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide

CC1SCc2ncnc(N3CCN(C(=O)[C@H](N)Cc4ccc(Cl)c(F)c4)CC3)c21

(2R)-2-amino-3-(4-chloro-3-fluorophenyl)-1-[4-(5-methyl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl)piperazin-1-yl]propan-1-one

c1ccc2c(c1)CCCC2CNCCCNC1CC1

N'-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)propane-1,3-diamine

CC1(C)[C@H]2CC[C@@]1(CS(=O)(=O)Nc1ccc3c(c1)OCCCO3)C(=O)C2

N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-[(1S,4S)-7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl]methanesulfonamide

CC(C)(C)c1ccc(CCCC(=O)O)c(N)c1

4-(2-amino-4-tert-butylphenyl)butanoic acid

CC(C)(C)NCCC(=O)Nc1c(F)cc(Br)cc1F

N-(4-bromo-2,6-difluorophenyl)-3-(tert-butylamino)propanamide

CCNC(=NCC1(CCO)CCOC1)NCCN(CC)c1cccc(C)c1.I

1-ethyl-3-[2-(N-ethyl-3-methylanilino)ethyl]-2-[[3-(2-hydroxyethyl)oxolan-3-yl]methyl]guanidine;hydroiodide

Nc1cc(F)cc(S(=O)(=O)NCc2ccno2)c1

3-amino-5-fluoro-N-(1,2-oxazol-5-ylmethyl)benzenesulfonamide

BrP(Cc1[nH]nc2ccc(I)cc12)(c1ccccc1)(c1ccccc1)c1ccccc1

bromo-[(5-iodo-2H-indazol-3-yl)methyl]-triphenyl-λ5-phosphane

CN(CC(=O)Nc1ccc(CN2CCCC2)cc1)S(=O)(=O)c1cccs1

2-[methyl(thiophen-2-ylsulfonyl)amino]-N-[4-(pyrrolidin-1-ylmethyl)phenyl]acetamide

CCOC(=O)C(C)CN1CC(C)CC(N)C1

ethyl 3-(3-amino-5-methylpiperidin-1-yl)-2-methylpropanoate

CN(C)C(=O)c1ccc(NCc2ccc(O)c(O)c2)cc1

4-[(3,4-dihydroxyphenyl)methylamino]-N,N-dimethylbenzamide

C=C[C@@H](C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)O)C(C)C

[(2S)-1-[[(2S)-1-[[(2S,3S,5S)-1-cyclohexyl-3-hydroxy-5-propan-2-ylhept-6-en-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-3-naphthalen-1-yl-1-oxopropan-2-yl]carbamic acid

COc1cc2c(cc1OCC(F)(F)F)CCN1C[C@H](CC(C)C)[C@@H](C)C[C@@]21C

(2S,3R,11bS)-10-methoxy-2,11b-dimethyl-3-(2-methylpropyl)-9-(2,2,2-trifluoroethoxy)-1,2,3,4,6,7-hexahydrobenzo[a]quinolizine

Cc1cc(OCC(=O)N2CCCC2C(=O)Nc2nccs2)c(C(C)C)cc1Cl

1-[2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)acetyl]-N-(1,3-thiazol-2-yl)pyrrolidine-2-carboxamide

CC(C)(F)CN1CCC(COc2ccc(-c3ccc(C(=O)N4CCCC(O)C4)c(F)c3F)cc2)CC1

[2,3-difluoro-4-[4-[[1-(2-fluoro-2-methylpropyl)piperidin-4-yl]methoxy]phenyl]phenyl]-(3-hydroxypiperidin-1-yl)methanone

CC(=O)O[C@@H]1CC[C@@]2(C)[C@H](CC[C@@H]3[C@@H]2CC[C@]2(C)[C@@H]4[C@H](C[C@@H]32)O[C@@]2(OC[C@H](C)C[C@@H]2OC(C)=O)[C@H]4C)C1

[(1R,2S,3'S,4S,5'R,6S,7S,8R,9S,12S,13S,16R,18R)-3'-acetyloxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl] acetate

CNC(=O)c1ccc(CN2CCC(C(O)c3nccn3C)CC2)cc1

4-[[4-[hydroxy-(1-methylimidazol-2-yl)methyl]piperidin-1-yl]methyl]-N-methylbenzamide

Cc1cc(Br)ccc1S(=O)(=O)N1C[C@H]2CNC[C@H]2C1.Cl

(3aS,6aR)-5-(4-bromo-2-methylphenyl)sulfonyl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;hydrochloride

C[C@@H](Oc1ccc2c(-c3ccc(F)cc3Cl)ccnc2c1)C(=O)N1CCC=C(C(=O)O)C1

1-[(2R)-2-[4-(2-chloro-4-fluorophenyl)quinolin-7-yl]oxypropanoyl]-3,6-dihydro-2H-pyridine-5-carboxylic acid

CCN1C(=O)C[C@](CC(=O)N(C)C[C@H]2CCCCO2)(c2cccc(C(F)(F)F)c2)C1=O

2-[(3R)-1-ethyl-2,5-dioxo-3-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl]-N-methyl-N-[[(2R)-oxan-2-yl]methyl]acetamide

CCCCCCOc1ccccc1C(=O)Nc1ccccc1C(=O)N1CCC(C)CC1

2-hexoxy-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]benzamide

CCOc1cc(/C=C2\SC(=Nc3ccc(Cl)cc3Cl)NC2=O)cc(Cl)c1OCc1ccccc1Cl

(5Z)-5-[[3-chloro-4-[(2-chlorophenyl)methoxy]-5-ethoxyphenyl]methylidene]-2-(2,4-dichlorophenyl)imino-1,3-thiazolidin-4-one

COc1cc2nc(-c3ccc(Cl)cc3O)[nH]c2cc1OC

5-chloro-2-(5,6-dimethoxy-1H-benzimidazol-2-yl)phenol

CC1CC1C(=O)N1CCCCC1CO

[2-(hydroxymethyl)piperidin-1-yl]-(2-methylcyclopropyl)methanone

CCOc1ccccc1C(C)(NCC(F)(F)F)C(=O)OC

methyl 2-(2-ethoxyphenyl)-2-(2,2,2-trifluoroethylamino)propanoate

Oc1ccc(C2(O)c3ccccc3C(O)C2O)cc1

3-(4-hydroxyphenyl)-1,2-dihydroindene-1,2,3-triol

Cc1c(-c2cc(Nc3ccc(N4CCN(C)CC4)cn3)c(=O)n(C)c2)cccc1N1/C=C\c2cc(C3CC3)cc(F)c2COC1.[HH]

5-[3-[(5Z)-8-cyclopropyl-10-fluoro-1,3-dihydro-2,4-benzoxazocin-4-yl]-2-methylphenyl]-1-methyl-3-[[5-(4-methylpiperazin-1-yl)pyridin-2-yl]amino]pyridin-2-one;molecular hydrogen

CC(C)c1ccnc2c1N(c1ccccc1)[CH-]N2c1[c-]cccc1.[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1N1[CH-]N(c2ccccc2)c2c(C3CCCC3)ccnc21.[c-]1ccccc1N1[CH-]N(c2ccccc2)c2cc(Oc3ccccc3)cnc21.[c-]1ccccc1N1[CH-]N(c2ccccc2)c2ccc(Oc3ccccc3)nc21

7-cyclopentyl-1-phenyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;iridium;5-phenoxy-1-phenyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;6-phenoxy-1-phenyl-3-phenyl-2H-imidazo[4,5-b]pyridin-2-ide;1-phenyl-3-phenyl-7-propan-2-yl-2H-imidazo[4,5-b]pyridin-2-ide

CCOC(=O)c1nn(CC(=O)NC(CCC=C(C)F)c2ccccn2)c2c1CC1CC2C1

ethyl 3-[2-[(5-fluoro-1-pyridin-2-ylhex-4-enyl)amino]-2-oxoethyl]-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene-5-carboxylate

CC(C)(CCCC1CCCCC1)C(=O)Nc1ccc(F)cc1F

5-cyclohexyl-N-(2,4-difluorophenyl)-2,2-dimethylpentanamide

CC1CNCC1C(=O)OCc1ccccc1Cl

(2-chlorophenyl)methyl 4-methylpyrrolidine-3-carboxylate

CC1CCCN(C(C)(C)CNC(=O)c2cc(-c3ccco3)on2)C1

5-(furan-2-yl)-N-[2-methyl-2-(3-methylpiperidin-1-yl)propyl]-1,2-oxazole-3-carboxamide

CCc1ccc(C(CNC(=O)CCC(=O)N2CCOc3ccccc32)N(C)C)cc1

4-(2,3-dihydro-1,4-benzoxazin-4-yl)-N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-4-oxobutanamide

O=C(O[C@@H](Cc1c(Cl)c[n+]([O-])cc1Cl)c1ccc2c(c1)OCC(F)O2)c1cccs1

[(1S)-2-(3,5-dichloro-1-oxidopyridin-1-ium-4-yl)-1-(2-fluoro-2,3-dihydro-1,4-benzodioxin-6-yl)ethyl] thiophene-2-carboxylate

COc1ccccc1-n1nc(C(=O)NCc2csc(-c3cccnc3)n2)c(O)cc1=O

4-hydroxy-1-(2-methoxyphenyl)-6-oxo-N-[(2-pyridin-3-yl-1,3-thiazol-4-yl)methyl]pyridazine-3-carboxamide

COc1c(C)cccc1CN1CCC(c2c(C(=O)NCCO)sc3ncccc23)C1

N-(2-hydroxyethyl)-3-[1-[(2-methoxy-3-methylphenyl)methyl]pyrrolidin-3-yl]thieno[2,3-b]pyridine-2-carboxamide

CC(C)CC(NC(=O)C(CC(C)C)NC(=O)C(CCC(=O)O)NC(=O)C(N)Cc1c[nH]c2ccccc12)C(=O)O

2-[[2-[[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoic acid

C=CC(=O)CC(C)C1CCC1

5-cyclobutylhex-1-en-3-one

CN(C1=NC(C)(C2=CCC(C)(F)C=C2)C(C#N)S1)c1cn(C2CC2)c(=O)c2ccc(N3CC4(CC(O)C4)C3)cc12

2-[[2-cyclopropyl-6-(6-hydroxy-2-azaspiro[3.3]heptan-2-yl)-1-oxoisoquinolin-4-yl]-methylamino]-4-(4-fluoro-4-methylcyclohexa-1,5-dien-1-yl)-4-methyl-5H-1,3-thiazole-5-carbonitrile

COC(=O)[C@@H]1CC[C@@H](Sc2ccccc2)N1C(=O)OC

dimethyl (2S,5R)-5-phenylsulfanylpyrrolidine-1,2-dicarboxylate

CC(C)CNCC(Cc1ccc(Cl)c(Cl)c1)C(C)C

2-[(3,4-dichlorophenyl)methyl]-3-methyl-N-(2-methylpropyl)butan-1-amine

Cc1cc(N2CCN(C(=O)c3sc4ccccc4c3C)CC2)nc(C(C)C)n1

(3-methyl-1-benzothiophen-2-yl)-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]methanone

COC(CNC(=O)C1CC1C(=O)O)C(C)(C)C

2-[(2-methoxy-3,3-dimethylbutyl)carbamoyl]cyclopropane-1-carboxylic acid

CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(Sc4nc5ccccc5s4)o3)c(=O)n2C1c1cccc2ccc(OC)cc12

ethyl (2E)-2-[[5-(1,3-benzothiazol-2-ylsulfanyl)furan-2-yl]methylidene]-5-(7-methoxynaphthalen-1-yl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

CCN(CCC(=O)OC)S(=O)(=O)c1cc(Cl)ccc1Cl

methyl 3-[(2,5-dichlorophenyl)sulfonyl-ethylamino]propanoate

CCC(CC)C(C)NS(=O)(=O)c1cc(CO)sc1C

N-(3-ethylpentan-2-yl)-5-(hydroxymethyl)-2-methylthiophene-3-sulfonamide

CCOC(=O)C1(Cc2ccccc2)CCN(C(=O)C(Cc2ccc3ccccc3c2)N(C)C(=O)/C=C/CC(C)(C)N)CC1

ethyl 1-[2-[[(E)-5-amino-5-methylhex-2-enoyl]-methylamino]-3-naphthalen-2-ylpropanoyl]-4-benzylpiperidine-4-carboxylate

Cc1ccc(F)cc1Oc1cc(Br)nc(C(C)C)n1

4-bromo-6-(5-fluoro-2-methylphenoxy)-2-propan-2-ylpyrimidine

CC1C=C(c2cc(-c3ccccc3)cc(-c3ccccc3)n2)C=CC1C1c2cccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3)c2C=CC1C

2-[4-[5-[4-(4,6-diphenylpyridin-2-yl)-6-methylcyclohexa-2,4-dien-1-yl]-6-methyl-5,6-dihydronaphthalen-1-yl]phenyl]-4,6-diphenyl-1,3,5-triazine

CC(Nc1cccc(F)c1)c1cc(F)ccc1F

N-[1-(2,5-difluorophenyl)ethyl]-3-fluoroaniline

Cl.NC[C@@H]1CN(C(=O)CCOc2ccccc2Cl)C[C@H]1c1ccccc1

1-[(3R,4R)-3-(aminomethyl)-4-phenylpyrrolidin-1-yl]-3-(2-chlorophenoxy)propan-1-one;hydrochloride

CN=C(NCc1ccsc1)NCc1cccc(Cn2cccn2)c1

2-methyl-1-[[3-(pyrazol-1-ylmethyl)phenyl]methyl]-3-(thiophen-3-ylmethyl)guanidine

COc1cccc(-n2cnnc2SC[C@H](O)COc2ccc(Cl)cc2)c1

(2R)-1-(4-chlorophenoxy)-3-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]propan-2-ol

CN=C(NCc1cccc(OCC(C)C)c1)NCC1CC(=O)Nc2ccccc21.I

2-methyl-1-[[3-(2-methylpropoxy)phenyl]methyl]-3-[(2-oxo-3,4-dihydro-1H-quinolin-4-yl)methyl]guanidine;hydroiodide

C[C@@H]1C[C@@H](CN2c3ccccc3Sc3ccccc32)[C@@H](C)N1C

10-[[(2R,3S,5R)-1,2,5-trimethylpyrrolidin-3-yl]methyl]phenothiazine

CC(CCC(=O)Nc1cccc(Br)c1)ON1C(=O)c2ccccc2C1=O

N-(3-bromophenyl)-4-(1,3-dioxoisoindol-2-yl)oxypentanamide

CN(C)C(=O)C=N.[Cl-].[Cl-]

2-imino-N,N-dimethylacetamide;dichloride

Cc1ccc2c(c1)OC(C)(C)CC2NC(=O)CCCN(c1cccc(C)c1C)S(C)(=O)=O

4-(2,3-dimethyl-N-methylsulfonylanilino)-N-(2,2,7-trimethyl-3,4-dihydrochromen-4-yl)butanamide

C[Si](C)(C)Cn1cc(F)c(=O)n(C[Si](C)(C)C)c1=O

5-fluoro-1,3-bis(trimethylsilylmethyl)pyrimidine-2,4-dione

C[C@H](C(=O)N1C[C@H](C)O[C@@H](C)C1)N(C)CC(=O)Nc1ccc(F)c(F)c1F

2-[[(2R)-1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-1-oxopropan-2-yl]-methylamino]-N-(2,3,4-trifluorophenyl)acetamide

CC(C)Oc1ccc(N2CCN(C(=O)C(=O)Nc3ccc4[nH]c(=O)oc4c3)[C@H](C)C2)cc1F

2-[(2R)-4-(3-fluoro-4-propan-2-yloxyphenyl)-2-methylpiperazin-1-yl]-2-oxo-N-(2-oxo-3H-1,3-benzoxazol-6-yl)acetamide

Cc1[nH]c(=S)[nH]c(=O)c1N=Nc1ccccc1O

5-[(2-hydroxyphenyl)diazenyl]-6-methyl-2-sulfanylidene-1H-pyrimidin-4-one

COCC(C)NC(=O)CNc1ccc(C#N)cc1Br

2-(2-bromo-4-cyanoanilino)-N-(1-methoxypropan-2-yl)acetamide

c1ccc2c(c1)NCC(c1nc(C3CCOC3)no1)O2

2-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]-3,4-dihydro-2H-1,4-benzoxazine

Cc1cc(S(=O)(=O)N[C@@H](C)COC2CCC(CN3CCN(c4ccc5c(c4F)n(C)c(=O)n5C4CCC(=O)NC4=O)CC3)CC2)ccc1Nc1ncc(C(F)(F)F)c(N2CC[C@H](C(C)(C)O)C2)n1

N-[(2S)-1-[4-[[4-[1-(2,6-dioxopiperidin-3-yl)-4-fluoro-3-methyl-2-oxobenzimidazol-5-yl]piperazin-1-yl]methyl]cyclohexyl]oxypropan-2-yl]-4-[[4-[(3S)-3-(2-hydroxypropan-2-yl)pyrrolidin-1-yl]-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3-methylbenzenesulfonamide

C/C=C/C(OC(=O)c1ccc(N=[N+]=[N-])cc1)n1cnc2c(=O)n(C)c(=O)n(C)c21

[(E)-1-(1,3-dimethyl-2,6-dioxopurin-9-yl)but-2-enyl] 4-azidobenzoate

COc1c(C(O)CN)cc2c(c1Cl)OCC2

2-amino-1-(7-chloro-6-methoxy-2,3-dihydro-1-benzofuran-5-yl)ethanol

CCC(CO)NC1C(=O)Nc2cccc(Br)c21

4-bromo-3-(1-hydroxybutan-2-ylamino)-1,3-dihydroindol-2-one

C#Cc1c(F)ccc2cc(O)cc(-c3ncc4c(N5CCOCC5)nc(N5CC[C@H](N(C)C)C5)nc4c3F)c12

4-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-8-fluoro-4-morpholin-4-ylpyrido[4,3-d]pyrimidin-7-yl]-5-ethynyl-6-fluoronaphthalen-2-ol

O=C1[C@H](N2CCCS(=O)(=O)CC2)CCN1c1ccccc1F

(3R)-3-(1,1-dioxo-1,4-thiazepan-4-yl)-1-(2-fluorophenyl)pyrrolidin-2-one

CC(C)C(NC(=O)c1cc(Cl)cc(Br)c1)c1ccccc1

3-bromo-5-chloro-N-(2-methyl-1-phenylpropyl)benzamide

Cc1ccc(-c2nc(-c3cc(CCC(=O)C(C)(C)C(F)(F)F)ccc3Cl)[nH]c(=O)n2)cc1Cl

4-(3-chloro-4-methylphenyl)-6-[2-chloro-5-(5,5,5-trifluoro-4,4-dimethyl-3-oxopentyl)phenyl]-1H-1,3,5-triazin-2-one

CCOCc1cccc(NC(=O)CN2CCC(C)CC2)c1

N-[3-(ethoxymethyl)phenyl]-2-(4-methylpiperidin-1-yl)acetamide

CCOc1ccc(/C(O)=C2\C(=O)C(=O)N(c3ccc4c(c3)OCCO4)C2c2cccc(OC)c2)cc1C

(4E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(4-ethoxy-3-methylphenyl)-hydroxymethylidene]-5-(3-methoxyphenyl)pyrrolidine-2,3-dione

CC1=CC=C(C(C)(c2ccc(C)cc2)c2ccc(C)cc2)CC1

1-methyl-4-[1-(4-methylcyclohexa-1,3-dien-1-yl)-1-(4-methylphenyl)ethyl]benzene

C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCC2)Oc2ncc(C3=CCCC3)cc2C1=O

N-[[(2S,3S)-8-(cyclopenten-1-yl)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methylcyclobutanecarboxamide

CCC(O)CNC(=O)c1c(I)c(NC(=O)CCO)c(I)c(C(=O)N(C)CC(O)CO)c1I

3-N-(2,3-dihydroxypropyl)-1-N-(2-hydroxybutyl)-5-(3-hydroxypropanoylamino)-2,4,6-triiodo-3-N-methylbenzene-1,3-dicarboxamide

CCCNc1cc(N2CCC(C(N)=O)C2)nc(CC)n1

1-[2-ethyl-6-(propylamino)pyrimidin-4-yl]pyrrolidine-3-carboxamide

Brc1ccccc1Nc1cnnc(NC2CC2)n1

5-N-(2-bromophenyl)-3-N-cyclopropyl-1,2,4-triazine-3,5-diamine

COc1cnccc1C(=O)NCC1CCCC1N

N-[(2-aminocyclopentyl)methyl]-3-methoxypyridine-4-carboxamide

c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4cccc(-c5ccc6cc7oc8ccccc8c7cc6c5)c4)n3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc5cc6oc7ccccc7c6cc45)c4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4cccc5c4ccc4sc6ccccc6c45)c3)n2)cc1

2-(4-naphtho[6,7-b][1]benzofuran-10-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(3-naphtho[2,3-b][1]benzofuran-9-ylphenyl)-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine;2-(3-naphtho[2,1-b][1]benzothiol-4-ylphenyl)-4,6-diphenyl-1,3,5-triazine

CCCC1CC1Nc1ccc(Cl)cn1

5-chloro-N-(2-propylcyclopropyl)pyridin-2-amine

c1ccc(CN2CC3CNCC(C3)C2)nc1

3-(pyridin-2-ylmethyl)-3,7-diazabicyclo[3.3.1]nonane