AdrianM0/SMILES-to-IUPAC-BOOTSTRAP-ROUND-38

SMILES stringlengths 2 1.01k	IUPAC stringlengths 6 1.38k
CCOc1cccc(C2(C)NCCNC2=O)c1	3-(3-ethoxyphenyl)-3-methylpiperazin-2-one
CCCCC/C=C(\C(=O)O)c1nsc(NC(=O)OC(C)(C)C)n1	(Z)-2-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-1,2,4-thiadiazol-3-yl]oct-2-enoic acid
CCNc1cc(CSc2cnn(C)c2)ccn1	N-ethyl-4-[(1-methylpyrazol-4-yl)sulfanylmethyl]pyridin-2-amine
CCOC(=O)c1c(C)c2c(n1C)CSc1cc(C#N)c(=O)[nH]c1-2	ethyl 11-cyano-3,5-dimethyl-12-oxo-8-thia-5,13-diazatricyclo[7.4.0.02,6]trideca-1(9),2(6),3,10-tetraene-4-carboxylate
COc1cc(F)c(Br)cc1C(N)C(F)(F)F	1-(5-bromo-4-fluoro-2-methoxyphenyl)-2,2,2-trifluoroethanamine
CC(C)Oc1cc(Oc2ccc(S(C)(=O)=O)cc2)cc2cc(C3=NCC(CC(=O)O)S3)[nH]c12	2-[2-[5-(4-methylsulfonylphenoxy)-7-propan-2-yloxy-1H-indol-2-yl]-4,5-dihydro-1,3-thiazol-5-yl]acetic acid
O=C(N[C@H]1CCOc2ccccc21)c1cnc2c(-c3cc(Cl)cc(Cl)c3)cccc2c1SCCO	8-(3,5-dichlorophenyl)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-4-(2-hydroxyethylsulfanyl)quinoline-3-carboxamide
NCC1(c2c(Cl)cc(C=O)c3c2OCO3)CCCCC1	7-[1-(aminomethyl)cyclohexyl]-6-chloro-1,3-benzodioxole-4-carbaldehyde
Cn1c(CCNC(=O)c2cnc3cnn(C)c3c2)n[nH]c1=O	1-methyl-N-[2-(4-methyl-5-oxo-1H-1,2,4-triazol-3-yl)ethyl]pyrazolo[4,3-b]pyridine-6-carboxamide
Cn1nc(NC(=O)CN2CCCC2)c2c(Cl)ccc(-c3ccc(C#CC(C)(C)O)nc3C(Cc3cc(F)cc(F)c3)NC(=O)Cn3nc(C(F)F)c4c3C(F)(F)C35CC43C5)c21	N-[4-chloro-7-[2-[1-[[2-[3-(difluoromethyl)-7,7-difluoro-4,5-diazatetracyclo[6.1.1.01,8.02,6]deca-2(6),3-dien-5-yl]acetyl]amino]-2-(3,5-difluorophenyl)ethyl]-6-(3-hydroxy-3-methylbut-1-ynyl)pyridin-3-yl]-1-methylindazol-3-yl]-2-pyrrolidin-1-ylacetamide
COc1c(NSC)cc(C(C)(C)C)cc1NC(=O)c1ccc(C)c(Nc2ncnc3cnc(N(C)CCN(C)C)nc23)c1	N-[5-tert-butyl-2-methoxy-3-(methylsulfanylamino)phenyl]-3-[[6-[2-(dimethylamino)ethyl-methylamino]pyrimido[5,4-d]pyrimidin-4-yl]amino]-4-methylbenzamide
CC/C=C\C/C=C\CC(O)/C=C/C=C\C/C=C\C/C=C\CCC(=O)OC[C@H](COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\CCCCCC	2-[[(2R)-2-[(Z)-hexadec-9-enoyl]oxy-3-[(4Z,7Z,10Z,12E,16Z,19Z)-14-hydroxydocosa-4,7,10,12,16,19-hexaenoyl]oxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
CO[C@@H]1CN(C(=O)c2cc(C)ccc2C)C[C@H]1Oc1cccc(NS(=O)(=O)N2CC3CC3C2)c1	N-[3-[(3R,4R)-1-(2,5-dimethylbenzoyl)-4-methoxypyrrolidin-3-yl]oxyphenyl]-3-azabicyclo[3.1.0]hexane-3-sulfonamide
N#Cc1nccn1CC1CC2CC2C1	1-(3-bicyclo[3.1.0]hexanylmethyl)imidazole-2-carbonitrile
COC(=O)[C@@H](CC(C)C)c1[nH]c2ccc(Cl)cc2c1CCNC(=O)OC(C)(C)C	methyl (2S)-2-[5-chloro-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-1H-indol-2-yl]-4-methylpentanoate
O=C(Nc1ccc(Oc2cccc3ccccc23)cc1)[C@@H]1CC(=O)N(c2ccccc2Cl)C1	(3R)-1-(2-chlorophenyl)-N-(4-naphthalen-1-yloxyphenyl)-5-oxopyrrolidine-3-carboxamide
CC(C)[Si]1(C(C)C)OCC2OC(n3cnc4c(Cl)nc(NC(=O)c5ccccc5)nc43)[C@@](O)(CCO)C2O[Si](C(C)C)(C(C)C)O1.CC(C)[Si]1(C(C)C)OCC2OC(n3cnc4c(Cl)nc(NC(=O)c5ccccc5)nc43)[C@@](O)(CCOS(C)(=O)=O)C2O[Si](C(C)C)(C(C)C)O1.CS(=O)(=O)Cl	2-[(9R)-8-(2-benzamido-6-chloropurin-9-yl)-9-hydroxy-2,2,4,4-tetra(propan-2-yl)-6,6a,8,9a-tetrahydrofuro[3,2-f][1,3,5,2,4]trioxadisilocin-9-yl]ethyl methanesulfonate;N-[6-chloro-9-[(9R)-9-hydroxy-9-(2-hydroxyethyl)-2,2,4,4-tetra(propan-2-yl)-6,6a,8,9a-tetrahydrofuro[3,2-f][1,3,5,2,4]trioxadisilocin-8-yl]purin-2-yl]benzamide;methanesulfonyl chloride
CC(C)(C)OC(=O)N[C@@]1(C(=O)OC(C)(C)C)CCNC1	tert-butyl (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidine-3-carboxylate
Cc1cc(=O)oc2cc(OC(O)COCCOCCOCCOCCOCCOCCOCCOCC(O)Oc3ccc4c(C)cc(=O)oc4c3)ccc12	7-[1-hydroxy-2-[2-[2-[2-[2-[2-[2-[2-[2-hydroxy-2-(4-methyl-2-oxochromen-7-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4-methylchromen-2-one
O=C(Nc1cc(C#CCCO)ccn1)NC1CC1	1-cyclopropyl-3-[4-(4-hydroxybut-1-ynyl)pyridin-2-yl]urea
CCOC(=O)Cc1c(C#N)ccc(C=O)c1CC	ethyl 2-(6-cyano-2-ethyl-3-formylphenyl)acetate
O=C1OC(c2ccccc2)=N/C1=C/c1ccccc1OCc1ccccc1F	(4E)-4-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one
CC(C)CN1C[C@@H](C)C(N2CCN(C(C)C)CC2)C[C@H]1C	1-[(2R,5R)-2,5-dimethyl-1-(2-methylpropyl)piperidin-4-yl]-4-propan-2-ylpiperazine
C[C@@H](CSc1nnnn1-c1ccccc1)N1CCc2nocc2C1	5-[(2S)-1-(1-phenyltetrazol-5-yl)sulfanylpropan-2-yl]-6,7-dihydro-4H-[1,2]oxazolo[4,3-c]pyridine
CCCC[C@@H](COC(=O)N(Cc1ccccc1)C(C)c1ccccc1)NC(=O)N[C@@H](CC(=O)O)c1ccc2c(c1)OCO2	(3S)-3-(1,3-benzodioxol-5-yl)-3-[[(2S)-1-[benzyl(1-phenylethyl)carbamoyl]oxyhexan-2-yl]carbamoylamino]propanoic acid
C[C@@H](N)C(=O)N1CCN(C)CC1c1ccccc1.Cl	(2R)-2-amino-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one;hydrochloride
Oc1ccc2nc(-c3ccsc3)c(CNCc3ccc(C(F)(F)F)cc3)cc2c1	2-thiophen-3-yl-3-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]quinolin-6-ol
COc1cccc(C2CSc3cc(C(C)(O)C(F)(F)F)ccc3N2C(=O)C(C)C)c1	1-[3-(3-methoxyphenyl)-7-(1,1,1-trifluoro-2-hydroxypropan-2-yl)-2,3-dihydro-1,4-benzothiazin-4-yl]-2-methylpropan-1-one
CC(Cn1cncn1)NC(=O)C1(c2cccs2)CCCCC1	1-thiophen-2-yl-N-[1-(1,2,4-triazol-1-yl)propan-2-yl]cyclohexane-1-carboxamide
O=C(Cc1ccc(Cl)cc1Cl)c1cc(F)ccc1F	2-(2,4-dichlorophenyl)-1-(2,5-difluorophenyl)ethanone
[2H]C([2H])([2H])N1C([2H])([2H])C([2H])([2H])N(C([2H])(c2ccccc2)c2ccccc2)C([2H])([2H])C1([2H])[2H].[2H]C([2H])([2H])N1C([2H])([2H])CN(C([2H])(c2ccccc2)c2ccccc2)CC1([2H])[2H].[2H]C(c1ccccc1)(c1ccccc1)N1C([2H])([2H])C([2H])([2H])N(C)C([2H])([2H])C1([2H])[2H].[2H]c1c([2H])c([2H])c(C([2H])(c2c([2H])c([2H])c([2H])c([2H])c2[2H])N2C([2H])([2H])C([2H])([2H])N(C)C([2H])([2H])C2([2H])[2H])c([2H])c1[2H].[2H]c1c([2H])c([2H])c(C([2H])(c2c([2H])c([2H])c([2H])c([2H])c2[2H])N2CC([2H])([2H])N(C([2H])([2H])[2H])C([2H])([2H])C2)c([2H])c1[2H]	2,2,3,3,5,5,6,6-octadeuterio-1-[deuterio-bis(2,3,4,5,6-pentadeuteriophenyl)methyl]-4-methylpiperazine;2,2,3,3,5,5,6,6-octadeuterio-1-[deuterio(diphenyl)methyl]-4-methylpiperazine;2,2,3,3,5,5,6,6-octadeuterio-1-[deuterio(diphenyl)methyl]-4-(trideuteriomethyl)piperazine;2,2,6,6-tetradeuterio-4-[deuterio-bis(2,3,4,5,6-pentadeuteriophenyl)methyl]-1-(trideuteriomethyl)piperazine;2,2,6,6-tetradeuterio-4-[deuterio(diphenyl)methyl]-1-(trideuteriomethyl)piperazine
Nc1nccc2c1c(-c1ccc(NC(=O)Nc3cc(C4(C(F)(F)F)CC4)on3)c3nccn13)cn2C1CC1	1-[5-(4-amino-1-cyclopropylpyrrolo[3,2-c]pyridin-3-yl)imidazo[1,2-a]pyridin-8-yl]-3-[5-[1-(trifluoromethyl)cyclopropyl]-1,2-oxazol-3-yl]urea
CNCc1cncc(-c2ccc(F)c(F)c2)c1	1-[5-(3,4-difluorophenyl)pyridin-3-yl]-N-methylmethanamine
C[C@H](CC(=O)N[C@@H]1CC=CCC1)NC(=O)OC(C)(C)C	tert-butyl N-[(2R)-4-[[(1S)-cyclohex-3-en-1-yl]amino]-4-oxobutan-2-yl]carbamate
CCOCCc1cccc(N(C)C)c1	3-(2-ethoxyethyl)-N,N-dimethylaniline
Cc1sc(NCC2CCCO2)nc1-c1ccc(F)c(F)c1	4-(3,4-difluorophenyl)-5-methyl-N-(oxolan-2-ylmethyl)-1,3-thiazol-2-amine
CCCc1ccc(C(CC)CC(=O)O)cc1	3-(4-propylphenyl)pentanoic acid
O=C(O)[C@@H](NCl)C(=O)c1ccccc1	(2S)-2-(chloroamino)-3-oxo-3-phenylpropanoic acid
NC(c1ccncc1Cl)c1cccc(Cl)c1Cl	(3-chloropyridin-4-yl)-(2,3-dichlorophenyl)methanamine
Clc1cc(Cl)cc(-c2nncn2C2CC2)c1	4-cyclopropyl-3-(3,5-dichlorophenyl)-1,2,4-triazole
CC1(C)CNC(CO)C(=O)N(C2CCCCCC2)C1	1-cycloheptyl-3-(hydroxymethyl)-6,6-dimethyl-1,4-diazepan-2-one
CCNC(=O)[C@H](Cc1ccccc1)N(Cc1cccc(C)c1)C(=O)CN(c1cc(C)ccc1C)S(=O)(=O)N(C)C	(2S)-2-[[2-[N-(dimethylsulfamoyl)-2,5-dimethylanilino]acetyl]-[(3-methylphenyl)methyl]amino]-N-ethyl-3-phenylpropanamide
CC(C)C1CN2CCCC2CN1Cc1sccc1Br	2-[(3-bromothiophen-2-yl)methyl]-3-propan-2-yl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
Cc1c(SCCCSc2ncccn2)ccnc1CNc1cnc2ccccc2c1	N-[[3-methyl-4-(3-pyrimidin-2-ylsulfanylpropylsulfanyl)pyridin-2-yl]methyl]quinolin-3-amine
C/C=C\C.C=CC=CC(/C=C\C)C1CCCN1C(=O)C(O)C(O)C=O.CC.CN(C)C.CNCc1nc(Cn2c(C)nc(C)c2C)cs1	(Z)-but-2-ene;2,3-dihydroxy-4-[2-[(2Z)-octa-2,5,7-trien-4-yl]pyrrolidin-1-yl]-4-oxobutanal;N,N-dimethylmethanamine;ethane;N-methyl-1-[4-[(2,4,5-trimethylimidazol-1-yl)methyl]-1,3-thiazol-2-yl]methanamine
CC1CN(c2ccc3ncccc3c2)CCN1	6-(3-methylpiperazin-1-yl)quinoline
Fc1ccccc1N1CCNCC1NCc1ccccc1	N-benzyl-1-(2-fluorophenyl)piperazin-2-amine
Cc1ccc([N+](=O)[O-])cc1NC1OC(=O)c2ccccc21	3-(2-methyl-5-nitroanilino)-3H-2-benzofuran-1-one
CCC(C(=O)O)N(C)Cc1nc2ccccc2c(C)c1Cl	2-[(3-chloro-4-methylquinolin-2-yl)methyl-methylamino]butanoic acid
COCCN1CCN([C@@H](C)c2nc(-c3ccccc3)no2)C[C@@H]1C	5-[(1S)-1-[(3S)-4-(2-methoxyethyl)-3-methylpiperazin-1-yl]ethyl]-3-phenyl-1,2,4-oxadiazole
Cc1cc(F)cc(-c2nccc3[nH]c(-c4n[nH]c5ccc(-c6ccncc6)cc45)nc23)c1	4-(3-fluoro-5-methylphenyl)-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine
CNC(=O)C1CCCCN1C(=O)c1cc(N)c(F)cc1F	1-(5-amino-2,4-difluorobenzoyl)-N-methylpiperidine-2-carboxamide
CC(C)C[C@H](N)[C@@H](O)CC(=O)O.C[C@H](NC(=O)OC(C)(C)C)C(=O)O.N[C@@H](CCC(=O)OCc1ccccc1)C(=O)OCc1ccccc1	(3S,4S)-4-amino-3-hydroxy-6-methylheptanoic acid;dibenzyl (2S)-2-aminopentanedioate;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
COc1c(Br)cccc1C1=NOC(C)(C)C1=O	3-(3-bromo-2-methoxyphenyl)-5,5-dimethyl-1,2-oxazol-4-one
C=CC(C)(C)OC[C@H]1O[C@H](O[C@@H]2C3=C([C@H](C)COC(C)=O)C[C@H](O)C3(C)/C=C3/[C@@H](COC)CC[C@H]3[C@@H](C)C2O)C(O)C(OC(C)=O)C1O	[(2S)-2-[(1E,4S,8R,10R,11S,14S)-8-[(2S,6R)-4-acetyloxy-3,5-dihydroxy-6-(2-methylbut-3-en-2-yloxymethyl)oxan-2-yl]oxy-4,9-dihydroxy-14-(methoxymethyl)-3,10-dimethyl-6-tricyclo[9.3.0.03,7]tetradeca-1,6-dienyl]propyl] acetate
Cc1ccc(C(=O)Nc2cc(C3CCOCC3)cc(C(F)(F)F)c2)cc1C#Cc1cnc(NC(=O)C2CC2)cn1	3-[2-[5-(cyclopropanecarbonylamino)pyrazin-2-yl]ethynyl]-4-methyl-N-[3-(oxan-4-yl)-5-(trifluoromethyl)phenyl]benzamide
CCOC(=O)C=Cc1c(-c2ccccc2)nc2c(cnn2CC)c1C(C)C	ethyl 3-(1-ethyl-6-phenyl-4-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)prop-2-enoate
Cc1ccc(OC(F)F)c(-c2csc(-c3cnccn3)n2)c1	4-[2-(difluoromethoxy)-5-methylphenyl]-2-pyrazin-2-yl-1,3-thiazole
C[C@@H](OC(=O)CCn1c(=O)oc2ccccc21)C(=O)N(C)CCC#N	[(2R)-1-[2-cyanoethyl(methyl)amino]-1-oxopropan-2-yl] 3-(2-oxo-1,3-benzoxazol-3-yl)propanoate
Cc1cccc([N+](=O)[O-])c1NC(=O)COc1ccc(Br)cc1Br	2-(2,4-dibromophenoxy)-N-(2-methyl-6-nitrophenyl)acetamide
N#C/C(=C/N1CCN(C(=O)c2ccco2)CC1)C(=O)NC1CCCCC1	(Z)-2-cyano-N-cyclohexyl-3-[4-(furan-2-carbonyl)piperazin-1-yl]prop-2-enamide
CCC(C)(C#N)C(=O)N1CCC2(CCCC2)C1	2-(2-azaspiro[4.4]nonane-2-carbonyl)-2-methylbutanenitrile
C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C3[C@@H](S[C@H]4CCNC4)CCC[C@@H]3C12	(1S,5S,8aS)-1-[(1R)-1-hydroxyethyl]-2-oxo-5-[(3S)-pyrrolidin-3-yl]sulfanyl-5,6,7,8,8a,8b-hexahydro-1H-azeto[1,2-b]isoindole-4-carboxylic acid
Cc1ccc(-c2cccc(-c3ccccc3)c2)cc1Cl.ClCCl.Oc1ccc(-c2cccc(-c3ccccc3)c2)cc1Cl	2-chloro-1-methyl-4-(3-phenylphenyl)benzene;2-chloro-4-(3-phenylphenyl)phenol;dichloromethane
N#CC(N)COCC(F)(F)F	2-amino-3-(2,2,2-trifluoroethoxy)propanenitrile
Cc1cc(C)n(Cc2cc(C(=O)NN)sc2C)n1	4-[(3,5-dimethylpyrazol-1-yl)methyl]-5-methylthiophene-2-carbohydrazide
O.O=C(/C=C/c1cccs1)N1CCCC1	(E)-1-pyrrolidin-1-yl-3-thiophen-2-ylprop-2-en-1-one;hydrate
COCCOCC[N+]1=C(C=C2C(=O)C(C=C3N(CCCC(=O)ON4C(=O)CCC4=O)c4ccc(S(=O)(=O)O)cc4C3(C)CCOC)=C2O)C(C)(CCCS(=O)(=O)O)c2cc(S(=O)(=O)O)ccc21	1-[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutyl]-2-[[2-hydroxy-3-[[1-[2-(2-methoxyethoxy)ethyl]-3-methyl-5-sulfo-3-(3-sulfopropyl)indol-1-ium-2-yl]methylidene]-4-oxocyclobuten-1-yl]methylidene]-3-(2-methoxyethyl)-3-methylindole-5-sulfonic acid
CC(CO)CNCC1CSc2ccccc21	3-(2,3-dihydro-1-benzothiophen-3-ylmethylamino)-2-methylpropan-1-ol
COc1cccc(CCNC(=O)N(CCN)C(=O)OC(C)(C)C)c1	tert-butyl N-(2-aminoethyl)-N-[2-(3-methoxyphenyl)ethylcarbamoyl]carbamate
CCOCC(C)OCC(=O)Nc1ccccc1C#N	N-(2-cyanophenyl)-2-(1-ethoxypropan-2-yloxy)acetamide
CCNC(c1cc(C)ccc1OCC)c1scc(C)c1Cl	N-[(3-chloro-4-methylthiophen-2-yl)-(2-ethoxy-5-methylphenyl)methyl]ethanamine
CCCCCCCC(=O)OCC(CCO[C@H]1COC(COC(=O)CCN(C)C)[C@@H]1OCCC(COC(=O)CCCCCCC)COC(=O)CCCCCCC)COC(=O)CCCCCCC	[4-[(3S,4R)-5-[3-(dimethylamino)propanoyloxymethyl]-4-[4-octanoyloxy-3-(octanoyloxymethyl)butoxy]oxolan-3-yl]oxy-2-(octanoyloxymethyl)butyl] octanoate
CS(=O)(=O)C1CCN(C(=O)c2cc(-c3ccccc3)no2)C1	(3-methylsulfonylpyrrolidin-1-yl)-(3-phenyl-1,2-oxazol-5-yl)methanone
COCCOCCn1nc(C)c(CCl)c1C	4-(chloromethyl)-1-[2-(2-methoxyethoxy)ethyl]-3,5-dimethylpyrazole
COCCO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)[O-])=C(C[n+]3csc4c3CCCC4)CS[C@@H]12)c1csc(N)n1	(6S,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(2-methoxyethoxyimino)acetyl]amino]-8-oxo-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-3-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CCNC(C#N)(CSc1ccncn1)C1CC1	2-cyclopropyl-2-(ethylamino)-3-pyrimidin-4-ylsulfanylpropanenitrile
C[Si]1(C)C=CC[Si](C)(C)CC1	1,1,4,4-tetramethyl-3,5-dihydro-2H-1,4-disilepine
C#C[C@@]12O/C=C/[C@H](C=C)[C@@H](C)[C@@H](OC(=O)CC(=O)NCC3CCCN(C)C3)[C@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@@H](C)/C=C/C=C(/C)C(=O)N=c3c(O)c4c(O)c(C)c(c(c4c4c3=NC3(CCN(CC(C)C)CC3)N4)C1=O)O2	[(7S,9E,11S,12R,13R,14R,15R,16R,17S,18S,19E,21Z)-11-ethenyl-7-ethynyl-2,15,17,32-tetrahydroxy-3,12,14,16,18,22-hexamethyl-1'-(2-methylpropyl)-6,23-dioxospiro[8,33-dioxa-24,27,29-triazapentacyclo[23.6.1.14,7.05,31.026,30]tritriaconta-1(32),2,4,9,19,21,24,26,30-nonaene-28,4'-piperidine]-13-yl] 3-[(1-methylpiperidin-3-yl)methylamino]-3-oxopropanoate
CCCc1ccc(S(=O)(=O)N2CC3CCCC(N)C3C2)cc1	2-(4-propylphenyl)sulfonyl-1,3,3a,4,5,6,7,7a-octahydroisoindol-4-amine
CCOC(=O)c1c(C(F)F)cc(C)nc1C	ethyl 4-(difluoromethyl)-2,6-dimethylpyridine-3-carboxylate
Cc1cc(NC(=O)c2ccc(NSCCO)cc2N2CCC3(CC2)CC3)nc(N2CCCC(O)C2)n1	2-(6-azaspiro[2.5]octan-6-yl)-4-(2-hydroxyethylsulfanylamino)-N-[2-(3-hydroxypiperidin-1-yl)-6-methylpyrimidin-4-yl]benzamide
CC(C)(C)c1cc(-c2ccccc2)c(Oc2ccc(Oc3c(-c4ccccc4)cc(C(C)(C)C)cc3-c3ccccc3)c3c4[nH]c(c23)N=c2[nH]c(c3ccccc23)=Nc2[nH]c(c3ccccc23)N=c2[nH]c(c3c(Oc5c(-c6ccccc6)cc(C(C)(C)C)cc5-c5ccccc5)ccc(Oc5c(-c6ccccc6)cc(C(C)(C)C)cc5-c5ccccc5)c23)=N4)c(-c2ccccc2)c1	5,8,14,17-tetrakis(4-tert-butyl-2,6-diphenylphenoxy)-2,11,20,29,37,38,39,40-octazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1(36),2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34-octadecaene
CCc1ccc(Cn2cc(C(Br)CC)nn2)s1	4-(1-bromopropyl)-1-[(5-ethylthiophen-2-yl)methyl]triazole
COc1ccc(NC(C)=O)cc1NC(=O)CSc1ncc(-c2ccccc2)n1-c1ccccc1	N-(5-acetamido-2-methoxyphenyl)-2-(1,5-diphenylimidazol-2-yl)sulfanylacetamide
Cc1ccc2c(c1)c1ccnc3c4ccccc4c(=O)n2c13	5-methyl-1,11-diazapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2(7),3,5,8(20),9,11,13,15,17-nonaen-19-one
COc1ccc([C@@H](O)CCN)c(O)c1	2-[(1S)-3-amino-1-hydroxypropyl]-5-methoxyphenol
COc1ccc(C(=O)NCCN2CCN(C(=O)C3(N)CCOCC3)CC2)cc1	N-[2-[4-(4-aminooxane-4-carbonyl)piperazin-1-yl]ethyl]-4-methoxybenzamide
CC/C=C(\C=C(C)C)c1ccc(C(=O)NCc2cccc(C(=O)NC(C)C)c2)cc1	3-[[[4-[(4E)-2-methylhepta-2,4-dien-4-yl]benzoyl]amino]methyl]-N-propan-2-ylbenzamide
NCC(O)c1ccc2occc2c1Cl	2-amino-1-(4-chloro-1-benzofuran-5-yl)ethanol
N=C(N)C(N)CCC[C@H](N)C(=O)O	(2S)-2,6,7-triamino-7-iminoheptanoic acid
Cc1ccc(Cl)cc1NC(=O)/C(C#N)=C/c1c(OCc2cccc([N+](=O)[O-])c2)ccc2ccccc12	(E)-N-(5-chloro-2-methylphenyl)-2-cyano-3-[2-[(3-nitrophenyl)methoxy]naphthalen-1-yl]prop-2-enamide
CC(C)C(C#N)(CCCN1CCN(c2nc3ccccc3[nH]2)CC1)c1cccc(F)c1	5-[4-(1H-benzimidazol-2-yl)piperazin-1-yl]-2-(3-fluorophenyl)-2-propan-2-ylpentanenitrile
COCCn1cc(NC(=O)c2ncccc2Br)ccc1=O	3-bromo-N-[1-(2-methoxyethyl)-6-oxopyridin-3-yl]pyridine-2-carboxamide
Cc1cccnc1CN1CCN(c2nc(C)c(C)c(C)n2)CC1	4,5,6-trimethyl-2-[4-[(3-methylpyridin-2-yl)methyl]piperazin-1-yl]pyrimidine
CC(C)(C)OC(C)(C)/C=C/c1ccccc1	[(E)-3-methyl-3-[(2-methylpropan-2-yl)oxy]but-1-enyl]benzene
CCCc1[nH]nc(C(=O)N(C)c2ccc(C)cc2C)c1N	4-amino-N-(2,4-dimethylphenyl)-N-methyl-5-propyl-1H-pyrazole-3-carboxamide
O=C(c1cc2c(F)cccc2s1)N1CCOC(c2ccc(F)cc2)C1	(4-fluoro-1-benzothiophen-2-yl)-[2-(4-fluorophenyl)morpholin-4-yl]methanone
CCCCC1CCCCCCC(CCCC)CCOC(=O)CCCCCCCCCC(OCCCCN2CCOCC2)CCCCCCCCCC(=O)OCC1	4,11-dibutyl-25-(4-morpholin-4-ylbutoxy)-1,14-dioxacyclopentatriacontane-15,35-dione
O=C(Nc1cc(Cl)ccc1O)c1ccn(COc2cccc(Cl)c2)n1	N-(5-chloro-2-hydroxyphenyl)-1-[(3-chlorophenoxy)methyl]pyrazole-3-carboxamide

CCOc1cccc(C2(C)NCCNC2=O)c1

3-(3-ethoxyphenyl)-3-methylpiperazin-2-one

CCCCC/C=C(\C(=O)O)c1nsc(NC(=O)OC(C)(C)C)n1

(Z)-2-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-1,2,4-thiadiazol-3-yl]oct-2-enoic acid

CCNc1cc(CSc2cnn(C)c2)ccn1

N-ethyl-4-[(1-methylpyrazol-4-yl)sulfanylmethyl]pyridin-2-amine

CCOC(=O)c1c(C)c2c(n1C)CSc1cc(C#N)c(=O)[nH]c1-2

ethyl 11-cyano-3,5-dimethyl-12-oxo-8-thia-5,13-diazatricyclo[7.4.0.02,6]trideca-1(9),2(6),3,10-tetraene-4-carboxylate

COc1cc(F)c(Br)cc1C(N)C(F)(F)F

1-(5-bromo-4-fluoro-2-methoxyphenyl)-2,2,2-trifluoroethanamine

CC(C)Oc1cc(Oc2ccc(S(C)(=O)=O)cc2)cc2cc(C3=NCC(CC(=O)O)S3)[nH]c12

2-[2-[5-(4-methylsulfonylphenoxy)-7-propan-2-yloxy-1H-indol-2-yl]-4,5-dihydro-1,3-thiazol-5-yl]acetic acid

O=C(N[C@H]1CCOc2ccccc21)c1cnc2c(-c3cc(Cl)cc(Cl)c3)cccc2c1SCCO

8-(3,5-dichlorophenyl)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-4-(2-hydroxyethylsulfanyl)quinoline-3-carboxamide

NCC1(c2c(Cl)cc(C=O)c3c2OCO3)CCCCC1

7-[1-(aminomethyl)cyclohexyl]-6-chloro-1,3-benzodioxole-4-carbaldehyde

Cn1c(CCNC(=O)c2cnc3cnn(C)c3c2)n[nH]c1=O

1-methyl-N-[2-(4-methyl-5-oxo-1H-1,2,4-triazol-3-yl)ethyl]pyrazolo[4,3-b]pyridine-6-carboxamide

Cn1nc(NC(=O)CN2CCCC2)c2c(Cl)ccc(-c3ccc(C#CC(C)(C)O)nc3C(Cc3cc(F)cc(F)c3)NC(=O)Cn3nc(C(F)F)c4c3C(F)(F)C35CC43C5)c21

N-[4-chloro-7-[2-[1-[[2-[3-(difluoromethyl)-7,7-difluoro-4,5-diazatetracyclo[6.1.1.01,8.02,6]deca-2(6),3-dien-5-yl]acetyl]amino]-2-(3,5-difluorophenyl)ethyl]-6-(3-hydroxy-3-methylbut-1-ynyl)pyridin-3-yl]-1-methylindazol-3-yl]-2-pyrrolidin-1-ylacetamide

COc1c(NSC)cc(C(C)(C)C)cc1NC(=O)c1ccc(C)c(Nc2ncnc3cnc(N(C)CCN(C)C)nc23)c1

N-[5-tert-butyl-2-methoxy-3-(methylsulfanylamino)phenyl]-3-[[6-[2-(dimethylamino)ethyl-methylamino]pyrimido[5,4-d]pyrimidin-4-yl]amino]-4-methylbenzamide

CC/C=C\C/C=C\CC(O)/C=C/C=C\C/C=C\C/C=C\CCC(=O)OC[C@H](COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\CCCCCC

2-[[(2R)-2-[(Z)-hexadec-9-enoyl]oxy-3-[(4Z,7Z,10Z,12E,16Z,19Z)-14-hydroxydocosa-4,7,10,12,16,19-hexaenoyl]oxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium

CO[C@@H]1CN(C(=O)c2cc(C)ccc2C)C[C@H]1Oc1cccc(NS(=O)(=O)N2CC3CC3C2)c1

N-[3-[(3R,4R)-1-(2,5-dimethylbenzoyl)-4-methoxypyrrolidin-3-yl]oxyphenyl]-3-azabicyclo[3.1.0]hexane-3-sulfonamide

N#Cc1nccn1CC1CC2CC2C1

1-(3-bicyclo[3.1.0]hexanylmethyl)imidazole-2-carbonitrile

COC(=O)[C@@H](CC(C)C)c1[nH]c2ccc(Cl)cc2c1CCNC(=O)OC(C)(C)C

methyl (2S)-2-[5-chloro-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-1H-indol-2-yl]-4-methylpentanoate

O=C(Nc1ccc(Oc2cccc3ccccc23)cc1)[C@@H]1CC(=O)N(c2ccccc2Cl)C1

(3R)-1-(2-chlorophenyl)-N-(4-naphthalen-1-yloxyphenyl)-5-oxopyrrolidine-3-carboxamide

CC(C)[Si]1(C(C)C)OCC2OC(n3cnc4c(Cl)nc(NC(=O)c5ccccc5)nc43)[C@@](O)(CCO)C2O[Si](C(C)C)(C(C)C)O1.CC(C)[Si]1(C(C)C)OCC2OC(n3cnc4c(Cl)nc(NC(=O)c5ccccc5)nc43)[C@@](O)(CCOS(C)(=O)=O)C2O[Si](C(C)C)(C(C)C)O1.CS(=O)(=O)Cl

2-[(9R)-8-(2-benzamido-6-chloropurin-9-yl)-9-hydroxy-2,2,4,4-tetra(propan-2-yl)-6,6a,8,9a-tetrahydrofuro[3,2-f][1,3,5,2,4]trioxadisilocin-9-yl]ethyl methanesulfonate;N-[6-chloro-9-[(9R)-9-hydroxy-9-(2-hydroxyethyl)-2,2,4,4-tetra(propan-2-yl)-6,6a,8,9a-tetrahydrofuro[3,2-f][1,3,5,2,4]trioxadisilocin-8-yl]purin-2-yl]benzamide;methanesulfonyl chloride

CC(C)(C)OC(=O)N[C@@]1(C(=O)OC(C)(C)C)CCNC1

tert-butyl (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidine-3-carboxylate

Cc1cc(=O)oc2cc(OC(O)COCCOCCOCCOCCOCCOCCOCCOCC(O)Oc3ccc4c(C)cc(=O)oc4c3)ccc12

7-[1-hydroxy-2-[2-[2-[2-[2-[2-[2-[2-[2-hydroxy-2-(4-methyl-2-oxochromen-7-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4-methylchromen-2-one

O=C(Nc1cc(C#CCCO)ccn1)NC1CC1

1-cyclopropyl-3-[4-(4-hydroxybut-1-ynyl)pyridin-2-yl]urea

CCOC(=O)Cc1c(C#N)ccc(C=O)c1CC

ethyl 2-(6-cyano-2-ethyl-3-formylphenyl)acetate

O=C1OC(c2ccccc2)=N/C1=C/c1ccccc1OCc1ccccc1F

(4E)-4-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one

CC(C)CN1C[C@@H](C)C(N2CCN(C(C)C)CC2)C[C@H]1C

1-[(2R,5R)-2,5-dimethyl-1-(2-methylpropyl)piperidin-4-yl]-4-propan-2-ylpiperazine

C[C@@H](CSc1nnnn1-c1ccccc1)N1CCc2nocc2C1

5-[(2S)-1-(1-phenyltetrazol-5-yl)sulfanylpropan-2-yl]-6,7-dihydro-4H-[1,2]oxazolo[4,3-c]pyridine

CCCC[C@@H](COC(=O)N(Cc1ccccc1)C(C)c1ccccc1)NC(=O)N[C@@H](CC(=O)O)c1ccc2c(c1)OCO2

(3S)-3-(1,3-benzodioxol-5-yl)-3-[[(2S)-1-[benzyl(1-phenylethyl)carbamoyl]oxyhexan-2-yl]carbamoylamino]propanoic acid

C[C@@H](N)C(=O)N1CCN(C)CC1c1ccccc1.Cl

(2R)-2-amino-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one;hydrochloride

Oc1ccc2nc(-c3ccsc3)c(CNCc3ccc(C(F)(F)F)cc3)cc2c1

2-thiophen-3-yl-3-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]quinolin-6-ol

COc1cccc(C2CSc3cc(C(C)(O)C(F)(F)F)ccc3N2C(=O)C(C)C)c1

1-[3-(3-methoxyphenyl)-7-(1,1,1-trifluoro-2-hydroxypropan-2-yl)-2,3-dihydro-1,4-benzothiazin-4-yl]-2-methylpropan-1-one

CC(Cn1cncn1)NC(=O)C1(c2cccs2)CCCCC1

1-thiophen-2-yl-N-[1-(1,2,4-triazol-1-yl)propan-2-yl]cyclohexane-1-carboxamide

O=C(Cc1ccc(Cl)cc1Cl)c1cc(F)ccc1F

2-(2,4-dichlorophenyl)-1-(2,5-difluorophenyl)ethanone

[2H]C([2H])([2H])N1C([2H])([2H])C([2H])([2H])N(C([2H])(c2ccccc2)c2ccccc2)C([2H])([2H])C1([2H])[2H].[2H]C([2H])([2H])N1C([2H])([2H])CN(C([2H])(c2ccccc2)c2ccccc2)CC1([2H])[2H].[2H]C(c1ccccc1)(c1ccccc1)N1C([2H])([2H])C([2H])([2H])N(C)C([2H])([2H])C1([2H])[2H].[2H]c1c([2H])c([2H])c(C([2H])(c2c([2H])c([2H])c([2H])c([2H])c2[2H])N2C([2H])([2H])C([2H])([2H])N(C)C([2H])([2H])C2([2H])[2H])c([2H])c1[2H].[2H]c1c([2H])c([2H])c(C([2H])(c2c([2H])c([2H])c([2H])c([2H])c2[2H])N2CC([2H])([2H])N(C([2H])([2H])[2H])C([2H])([2H])C2)c([2H])c1[2H]

2,2,3,3,5,5,6,6-octadeuterio-1-[deuterio-bis(2,3,4,5,6-pentadeuteriophenyl)methyl]-4-methylpiperazine;2,2,3,3,5,5,6,6-octadeuterio-1-[deuterio(diphenyl)methyl]-4-methylpiperazine;2,2,3,3,5,5,6,6-octadeuterio-1-[deuterio(diphenyl)methyl]-4-(trideuteriomethyl)piperazine;2,2,6,6-tetradeuterio-4-[deuterio-bis(2,3,4,5,6-pentadeuteriophenyl)methyl]-1-(trideuteriomethyl)piperazine;2,2,6,6-tetradeuterio-4-[deuterio(diphenyl)methyl]-1-(trideuteriomethyl)piperazine

Nc1nccc2c1c(-c1ccc(NC(=O)Nc3cc(C4(C(F)(F)F)CC4)on3)c3nccn13)cn2C1CC1

1-[5-(4-amino-1-cyclopropylpyrrolo[3,2-c]pyridin-3-yl)imidazo[1,2-a]pyridin-8-yl]-3-[5-[1-(trifluoromethyl)cyclopropyl]-1,2-oxazol-3-yl]urea

CNCc1cncc(-c2ccc(F)c(F)c2)c1

1-[5-(3,4-difluorophenyl)pyridin-3-yl]-N-methylmethanamine

C[C@H](CC(=O)N[C@@H]1CC=CCC1)NC(=O)OC(C)(C)C

tert-butyl N-[(2R)-4-[[(1S)-cyclohex-3-en-1-yl]amino]-4-oxobutan-2-yl]carbamate

CCOCCc1cccc(N(C)C)c1

3-(2-ethoxyethyl)-N,N-dimethylaniline

Cc1sc(NCC2CCCO2)nc1-c1ccc(F)c(F)c1

4-(3,4-difluorophenyl)-5-methyl-N-(oxolan-2-ylmethyl)-1,3-thiazol-2-amine

CCCc1ccc(C(CC)CC(=O)O)cc1

3-(4-propylphenyl)pentanoic acid

O=C(O)[C@@H](NCl)C(=O)c1ccccc1

(2S)-2-(chloroamino)-3-oxo-3-phenylpropanoic acid

NC(c1ccncc1Cl)c1cccc(Cl)c1Cl

(3-chloropyridin-4-yl)-(2,3-dichlorophenyl)methanamine

Clc1cc(Cl)cc(-c2nncn2C2CC2)c1

4-cyclopropyl-3-(3,5-dichlorophenyl)-1,2,4-triazole

CC1(C)CNC(CO)C(=O)N(C2CCCCCC2)C1

1-cycloheptyl-3-(hydroxymethyl)-6,6-dimethyl-1,4-diazepan-2-one

CCNC(=O)[C@H](Cc1ccccc1)N(Cc1cccc(C)c1)C(=O)CN(c1cc(C)ccc1C)S(=O)(=O)N(C)C

(2S)-2-[[2-[N-(dimethylsulfamoyl)-2,5-dimethylanilino]acetyl]-[(3-methylphenyl)methyl]amino]-N-ethyl-3-phenylpropanamide

CC(C)C1CN2CCCC2CN1Cc1sccc1Br

2-[(3-bromothiophen-2-yl)methyl]-3-propan-2-yl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine

Cc1c(SCCCSc2ncccn2)ccnc1CNc1cnc2ccccc2c1

N-[[3-methyl-4-(3-pyrimidin-2-ylsulfanylpropylsulfanyl)pyridin-2-yl]methyl]quinolin-3-amine

C/C=C\C.C=CC=CC(/C=C\C)C1CCCN1C(=O)C(O)C(O)C=O.CC.CN(C)C.CNCc1nc(Cn2c(C)nc(C)c2C)cs1

(Z)-but-2-ene;2,3-dihydroxy-4-[2-[(2Z)-octa-2,5,7-trien-4-yl]pyrrolidin-1-yl]-4-oxobutanal;N,N-dimethylmethanamine;ethane;N-methyl-1-[4-[(2,4,5-trimethylimidazol-1-yl)methyl]-1,3-thiazol-2-yl]methanamine

CC1CN(c2ccc3ncccc3c2)CCN1

6-(3-methylpiperazin-1-yl)quinoline

Fc1ccccc1N1CCNCC1NCc1ccccc1

N-benzyl-1-(2-fluorophenyl)piperazin-2-amine

Cc1ccc([N+](=O)[O-])cc1NC1OC(=O)c2ccccc21

3-(2-methyl-5-nitroanilino)-3H-2-benzofuran-1-one

CCC(C(=O)O)N(C)Cc1nc2ccccc2c(C)c1Cl

2-[(3-chloro-4-methylquinolin-2-yl)methyl-methylamino]butanoic acid

COCCN1CCN([C@@H](C)c2nc(-c3ccccc3)no2)C[C@@H]1C

5-[(1S)-1-[(3S)-4-(2-methoxyethyl)-3-methylpiperazin-1-yl]ethyl]-3-phenyl-1,2,4-oxadiazole

Cc1cc(F)cc(-c2nccc3[nH]c(-c4n[nH]c5ccc(-c6ccncc6)cc45)nc23)c1

4-(3-fluoro-5-methylphenyl)-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine

CNC(=O)C1CCCCN1C(=O)c1cc(N)c(F)cc1F

1-(5-amino-2,4-difluorobenzoyl)-N-methylpiperidine-2-carboxamide

CC(C)C[C@H](N)[C@@H](O)CC(=O)O.C[C@H](NC(=O)OC(C)(C)C)C(=O)O.N[C@@H](CCC(=O)OCc1ccccc1)C(=O)OCc1ccccc1

(3S,4S)-4-amino-3-hydroxy-6-methylheptanoic acid;dibenzyl (2S)-2-aminopentanedioate;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

COc1c(Br)cccc1C1=NOC(C)(C)C1=O

3-(3-bromo-2-methoxyphenyl)-5,5-dimethyl-1,2-oxazol-4-one

C=CC(C)(C)OC[C@H]1O[C@H](O[C@@H]2C3=C([C@H](C)COC(C)=O)C[C@H](O)C3(C)/C=C3/[C@@H](COC)CC[C@H]3[C@@H](C)C2O)C(O)C(OC(C)=O)C1O

[(2S)-2-[(1E,4S,8R,10R,11S,14S)-8-[(2S,6R)-4-acetyloxy-3,5-dihydroxy-6-(2-methylbut-3-en-2-yloxymethyl)oxan-2-yl]oxy-4,9-dihydroxy-14-(methoxymethyl)-3,10-dimethyl-6-tricyclo[9.3.0.03,7]tetradeca-1,6-dienyl]propyl] acetate

Cc1ccc(C(=O)Nc2cc(C3CCOCC3)cc(C(F)(F)F)c2)cc1C#Cc1cnc(NC(=O)C2CC2)cn1

3-[2-[5-(cyclopropanecarbonylamino)pyrazin-2-yl]ethynyl]-4-methyl-N-[3-(oxan-4-yl)-5-(trifluoromethyl)phenyl]benzamide

CCOC(=O)C=Cc1c(-c2ccccc2)nc2c(cnn2CC)c1C(C)C

ethyl 3-(1-ethyl-6-phenyl-4-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)prop-2-enoate

Cc1ccc(OC(F)F)c(-c2csc(-c3cnccn3)n2)c1

4-[2-(difluoromethoxy)-5-methylphenyl]-2-pyrazin-2-yl-1,3-thiazole

C[C@@H](OC(=O)CCn1c(=O)oc2ccccc21)C(=O)N(C)CCC#N

[(2R)-1-[2-cyanoethyl(methyl)amino]-1-oxopropan-2-yl] 3-(2-oxo-1,3-benzoxazol-3-yl)propanoate

Cc1cccc([N+](=O)[O-])c1NC(=O)COc1ccc(Br)cc1Br

2-(2,4-dibromophenoxy)-N-(2-methyl-6-nitrophenyl)acetamide

N#C/C(=C/N1CCN(C(=O)c2ccco2)CC1)C(=O)NC1CCCCC1

(Z)-2-cyano-N-cyclohexyl-3-[4-(furan-2-carbonyl)piperazin-1-yl]prop-2-enamide

CCC(C)(C#N)C(=O)N1CCC2(CCCC2)C1

2-(2-azaspiro[4.4]nonane-2-carbonyl)-2-methylbutanenitrile

C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C3[C@@H](S[C@H]4CCNC4)CCC[C@@H]3C12

(1S,5S,8aS)-1-[(1R)-1-hydroxyethyl]-2-oxo-5-[(3S)-pyrrolidin-3-yl]sulfanyl-5,6,7,8,8a,8b-hexahydro-1H-azeto[1,2-b]isoindole-4-carboxylic acid

Cc1ccc(-c2cccc(-c3ccccc3)c2)cc1Cl.ClCCl.Oc1ccc(-c2cccc(-c3ccccc3)c2)cc1Cl

2-chloro-1-methyl-4-(3-phenylphenyl)benzene;2-chloro-4-(3-phenylphenyl)phenol;dichloromethane

N#CC(N)COCC(F)(F)F

2-amino-3-(2,2,2-trifluoroethoxy)propanenitrile

Cc1cc(C)n(Cc2cc(C(=O)NN)sc2C)n1

4-[(3,5-dimethylpyrazol-1-yl)methyl]-5-methylthiophene-2-carbohydrazide

O.O=C(/C=C/c1cccs1)N1CCCC1

(E)-1-pyrrolidin-1-yl-3-thiophen-2-ylprop-2-en-1-one;hydrate

COCCOCC[N+]1=C(C=C2C(=O)C(C=C3N(CCCC(=O)ON4C(=O)CCC4=O)c4ccc(S(=O)(=O)O)cc4C3(C)CCOC)=C2O)C(C)(CCCS(=O)(=O)O)c2cc(S(=O)(=O)O)ccc21

1-[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutyl]-2-[[2-hydroxy-3-[[1-[2-(2-methoxyethoxy)ethyl]-3-methyl-5-sulfo-3-(3-sulfopropyl)indol-1-ium-2-yl]methylidene]-4-oxocyclobuten-1-yl]methylidene]-3-(2-methoxyethyl)-3-methylindole-5-sulfonic acid

CC(CO)CNCC1CSc2ccccc21

3-(2,3-dihydro-1-benzothiophen-3-ylmethylamino)-2-methylpropan-1-ol

COc1cccc(CCNC(=O)N(CCN)C(=O)OC(C)(C)C)c1

tert-butyl N-(2-aminoethyl)-N-[2-(3-methoxyphenyl)ethylcarbamoyl]carbamate

CCOCC(C)OCC(=O)Nc1ccccc1C#N

N-(2-cyanophenyl)-2-(1-ethoxypropan-2-yloxy)acetamide

CCNC(c1cc(C)ccc1OCC)c1scc(C)c1Cl

N-[(3-chloro-4-methylthiophen-2-yl)-(2-ethoxy-5-methylphenyl)methyl]ethanamine

CCCCCCCC(=O)OCC(CCO[C@H]1COC(COC(=O)CCN(C)C)[C@@H]1OCCC(COC(=O)CCCCCCC)COC(=O)CCCCCCC)COC(=O)CCCCCCC

[4-[(3S,4R)-5-[3-(dimethylamino)propanoyloxymethyl]-4-[4-octanoyloxy-3-(octanoyloxymethyl)butoxy]oxolan-3-yl]oxy-2-(octanoyloxymethyl)butyl] octanoate

CS(=O)(=O)C1CCN(C(=O)c2cc(-c3ccccc3)no2)C1

(3-methylsulfonylpyrrolidin-1-yl)-(3-phenyl-1,2-oxazol-5-yl)methanone

COCCOCCn1nc(C)c(CCl)c1C

4-(chloromethyl)-1-[2-(2-methoxyethoxy)ethyl]-3,5-dimethylpyrazole

COCCO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)[O-])=C(C[n+]3csc4c3CCCC4)CS[C@@H]12)c1csc(N)n1

(6S,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(2-methoxyethoxyimino)acetyl]amino]-8-oxo-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-3-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

CCNC(C#N)(CSc1ccncn1)C1CC1

2-cyclopropyl-2-(ethylamino)-3-pyrimidin-4-ylsulfanylpropanenitrile

C[Si]1(C)C=CC[Si](C)(C)CC1

1,1,4,4-tetramethyl-3,5-dihydro-2H-1,4-disilepine

C#C[C@@]12O/C=C/[C@H](C=C)[C@@H](C)[C@@H](OC(=O)CC(=O)NCC3CCCN(C)C3)[C@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@@H](C)/C=C/C=C(/C)C(=O)N=c3c(O)c4c(O)c(C)c(c(c4c4c3=NC3(CCN(CC(C)C)CC3)N4)C1=O)O2

[(7S,9E,11S,12R,13R,14R,15R,16R,17S,18S,19E,21Z)-11-ethenyl-7-ethynyl-2,15,17,32-tetrahydroxy-3,12,14,16,18,22-hexamethyl-1'-(2-methylpropyl)-6,23-dioxospiro[8,33-dioxa-24,27,29-triazapentacyclo[23.6.1.14,7.05,31.026,30]tritriaconta-1(32),2,4,9,19,21,24,26,30-nonaene-28,4'-piperidine]-13-yl] 3-[(1-methylpiperidin-3-yl)methylamino]-3-oxopropanoate

CCCc1ccc(S(=O)(=O)N2CC3CCCC(N)C3C2)cc1

2-(4-propylphenyl)sulfonyl-1,3,3a,4,5,6,7,7a-octahydroisoindol-4-amine

CCOC(=O)c1c(C(F)F)cc(C)nc1C

ethyl 4-(difluoromethyl)-2,6-dimethylpyridine-3-carboxylate

Cc1cc(NC(=O)c2ccc(NSCCO)cc2N2CCC3(CC2)CC3)nc(N2CCCC(O)C2)n1

2-(6-azaspiro[2.5]octan-6-yl)-4-(2-hydroxyethylsulfanylamino)-N-[2-(3-hydroxypiperidin-1-yl)-6-methylpyrimidin-4-yl]benzamide

CC(C)(C)c1cc(-c2ccccc2)c(Oc2ccc(Oc3c(-c4ccccc4)cc(C(C)(C)C)cc3-c3ccccc3)c3c4[nH]c(c23)N=c2[nH]c(c3ccccc23)=Nc2[nH]c(c3ccccc23)N=c2[nH]c(c3c(Oc5c(-c6ccccc6)cc(C(C)(C)C)cc5-c5ccccc5)ccc(Oc5c(-c6ccccc6)cc(C(C)(C)C)cc5-c5ccccc5)c23)=N4)c(-c2ccccc2)c1

5,8,14,17-tetrakis(4-tert-butyl-2,6-diphenylphenoxy)-2,11,20,29,37,38,39,40-octazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1(36),2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34-octadecaene

CCc1ccc(Cn2cc(C(Br)CC)nn2)s1

4-(1-bromopropyl)-1-[(5-ethylthiophen-2-yl)methyl]triazole

COc1ccc(NC(C)=O)cc1NC(=O)CSc1ncc(-c2ccccc2)n1-c1ccccc1

N-(5-acetamido-2-methoxyphenyl)-2-(1,5-diphenylimidazol-2-yl)sulfanylacetamide

Cc1ccc2c(c1)c1ccnc3c4ccccc4c(=O)n2c13

5-methyl-1,11-diazapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2(7),3,5,8(20),9,11,13,15,17-nonaen-19-one

COc1ccc([C@@H](O)CCN)c(O)c1

2-[(1S)-3-amino-1-hydroxypropyl]-5-methoxyphenol

COc1ccc(C(=O)NCCN2CCN(C(=O)C3(N)CCOCC3)CC2)cc1

N-[2-[4-(4-aminooxane-4-carbonyl)piperazin-1-yl]ethyl]-4-methoxybenzamide

CC/C=C(\C=C(C)C)c1ccc(C(=O)NCc2cccc(C(=O)NC(C)C)c2)cc1

3-[[[4-[(4E)-2-methylhepta-2,4-dien-4-yl]benzoyl]amino]methyl]-N-propan-2-ylbenzamide

NCC(O)c1ccc2occc2c1Cl

2-amino-1-(4-chloro-1-benzofuran-5-yl)ethanol

N=C(N)C(N)CCC[C@H](N)C(=O)O

(2S)-2,6,7-triamino-7-iminoheptanoic acid

Cc1ccc(Cl)cc1NC(=O)/C(C#N)=C/c1c(OCc2cccc([N+](=O)[O-])c2)ccc2ccccc12

(E)-N-(5-chloro-2-methylphenyl)-2-cyano-3-[2-[(3-nitrophenyl)methoxy]naphthalen-1-yl]prop-2-enamide

CC(C)C(C#N)(CCCN1CCN(c2nc3ccccc3[nH]2)CC1)c1cccc(F)c1

5-[4-(1H-benzimidazol-2-yl)piperazin-1-yl]-2-(3-fluorophenyl)-2-propan-2-ylpentanenitrile

COCCn1cc(NC(=O)c2ncccc2Br)ccc1=O

3-bromo-N-[1-(2-methoxyethyl)-6-oxopyridin-3-yl]pyridine-2-carboxamide

Cc1cccnc1CN1CCN(c2nc(C)c(C)c(C)n2)CC1

4,5,6-trimethyl-2-[4-[(3-methylpyridin-2-yl)methyl]piperazin-1-yl]pyrimidine

CC(C)(C)OC(C)(C)/C=C/c1ccccc1

[(E)-3-methyl-3-[(2-methylpropan-2-yl)oxy]but-1-enyl]benzene

CCCc1[nH]nc(C(=O)N(C)c2ccc(C)cc2C)c1N

4-amino-N-(2,4-dimethylphenyl)-N-methyl-5-propyl-1H-pyrazole-3-carboxamide

O=C(c1cc2c(F)cccc2s1)N1CCOC(c2ccc(F)cc2)C1

(4-fluoro-1-benzothiophen-2-yl)-[2-(4-fluorophenyl)morpholin-4-yl]methanone

CCCCC1CCCCCCC(CCCC)CCOC(=O)CCCCCCCCCC(OCCCCN2CCOCC2)CCCCCCCCCC(=O)OCC1

4,11-dibutyl-25-(4-morpholin-4-ylbutoxy)-1,14-dioxacyclopentatriacontane-15,35-dione

O=C(Nc1cc(Cl)ccc1O)c1ccn(COc2cccc(Cl)c2)n1

N-(5-chloro-2-hydroxyphenyl)-1-[(3-chlorophenoxy)methyl]pyrazole-3-carboxamide