AdrianM0/SMILES-to-IUPAC-BOOTSTRAP-ROUND-34

SMILES stringlengths 2 1.07k	IUPAC stringlengths 6 1.79k
c1cc(-[n+]2coc3cccnc32)cc(-[n+]2coc3ccc[nH+]c32)c1	3-[3-([1,3]oxazolo[4,5-b]pyridine-3,4-diium-3-yl)phenyl]-[1,3]oxazolo[4,5-b]pyridin-3-ium
CCCCN(C)CCCC(=O)Nc1ccccc1C#N	4-[butyl(methyl)amino]-N-(2-cyanophenyl)butanamide
COc1ncnc2c1nc(N)n2Cc1cccc(F)c1	9-[(3-fluorophenyl)methyl]-6-methoxypurin-8-amine
C1CCC(NC2CC2)CNC1	N-cyclopropylazepan-3-amine
CC(C)NC(=O)c1nc(C(=O)Nc2ccc(Cl)cc2)n2ccccc12	3-N-(4-chlorophenyl)-1-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide
O=c1cc(-c2ccc(Cl)cc2O)oc2c(Cl)cccc12	8-chloro-2-(4-chloro-2-hydroxyphenyl)chromen-4-one
Cc1cc2ccccc2n2c(=O)n(CCNC(=O)[C@@H]3[C@H]4C(=O)N(C)C[C@@]45C=C[C@H]3O5)nc12	(1R,5R,6R,7R)-3-methyl-N-[2-(4-methyl-1-oxo-[1,2,4]triazolo[4,3-a]quinolin-2-yl)ethyl]-4-oxo-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene-6-carboxamide
CC[C@H](NC(=O)CSc1nncs1)c1ccc(C)cc1	N-[(1S)-1-(4-methylphenyl)propyl]-2-(1,3,4-thiadiazol-2-ylsulfanyl)acetamide
CCNC(=NCc1ccccc1CN1CCCC1=O)NCCCOCC1CC1.I	1-[3-(cyclopropylmethoxy)propyl]-3-ethyl-2-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]guanidine;hydroiodide
CCOC(=O)c1cc(Br)cc(S(=O)(=O)NCc2ccc(-c3nccs3)cc2)c1	ethyl 3-bromo-5-[[4-(1,3-thiazol-2-yl)phenyl]methylsulfamoyl]benzoate
CC(C(=O)Nc1ccncc1)n1nc(-c2ccc(F)cc2)ccc1=O	2-[3-(4-fluorophenyl)-6-oxopyridazin-1-yl]-N-pyridin-4-ylpropanamide
CN=C(NCCc1cc(F)cc(F)c1)NCC1COc2ccccc2O1.I	1-[2-(3,5-difluorophenyl)ethyl]-3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-methylguanidine;hydroiodide
CN=C(NCCc1ccc2c(c1)OCO2)NCC(C)Oc1ccccc1OC	1-[2-(1,3-benzodioxol-5-yl)ethyl]-3-[2-(2-methoxyphenoxy)propyl]-2-methylguanidine
CCCC(N)(C=CP(=O)(OC)OC)CCCc1ccc(Sc2cccc(OCc3ccccc3)c2)cc1Cl	1-[2-chloro-4-(3-phenylmethoxyphenyl)sulfanylphenyl]-4-(2-dimethoxyphosphorylethenyl)heptan-4-amine
O=C(NCC#CCOc1ccc2c(c1)OCO2)c1cc(C2CC2)on1	N-[4-(1,3-benzodioxol-5-yloxy)but-2-ynyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide
CCOc1ccc(C2(CNC(=NC)N(C)Cc3ccccc3OC)CCOCC2)cc1.I	3-[[4-(4-ethoxyphenyl)oxan-4-yl]methyl]-1-[(2-methoxyphenyl)methyl]-1,2-dimethylguanidine;hydroiodide
COCCn1ncc(NCCC(=O)N(C)C)c(Br)c1=O	3-[[5-bromo-1-(2-methoxyethyl)-6-oxopyridazin-4-yl]amino]-N,N-dimethylpropanamide
CCC(C)(CN)OCCC(=O)O	3-(1-amino-2-methylbutan-2-yl)oxypropanoic acid
COc1cc([N+](=O)[O-])ccc1NC(=O)NCC#N	1-(cyanomethyl)-3-(2-methoxy-4-nitrophenyl)urea
COCc1nc(C)cc(N2CCC[C@H]3C(=O)NC[C@H]32)n1.I	(4aR,7aS)-1-[2-(methoxymethyl)-6-methylpyrimidin-4-yl]-3,4,4a,6,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridin-5-one;hydroiodide
CC(C)(C)C(=O)Nc1cccc(NC(=O)c2cnc(C(C)(C)C)s2)c1	2-tert-butyl-N-[3-(2,2-dimethylpropanoylamino)phenyl]-1,3-thiazole-5-carboxamide
COc1cc(S(C)(=O)=O)ccc1NC(N)=Nc1ccc(-c2ccc(NC(=O)[C@H](N)c3ccc(F)cc3)cc2)cn1	(2R)-2-amino-N-[4-[6-[[amino-(2-methoxy-4-methylsulfonylanilino)methylidene]amino]pyridin-3-yl]phenyl]-2-(4-fluorophenyl)acetamide
CCCC(=O)OCC(COC(=O)NCC)OCCCC(=O)ON1C(=O)CCC1=O	(2,5-dioxopyrrolidin-1-yl) 4-[1-butanoyloxy-3-(ethylcarbamoyloxy)propan-2-yl]oxybutanoate
CC(=O)c1cnc2ccc(-c3cc(F)c(O)c(Cl)c3)nc2c1NC1CCC(NC(=O)C(C(C)C)N(C(=O)O)C(C)(C)C)CC1	[1-[[4-[[3-acetyl-6-(3-chloro-5-fluoro-4-hydroxyphenyl)-1,5-naphthyridin-4-yl]amino]cyclohexyl]amino]-3-methyl-1-oxobutan-2-yl]-tert-butylcarbamic acid
Cc1cc2c(cc1S(N)(=O)=O)S(=O)(=O)NC1(CCN(C(=O)CC(CO[N+](=O)[O-])O[N+](=O)[O-])CC1)N2	[4-(6-methyl-1,1-dioxo-7-sulfamoylspiro[2,4-dihydro-1λ6,2,4-benzothiadiazine-3,4'-piperidine]-1'-yl)-1-nitrooxy-4-oxobutan-2-yl] nitrate
C(=C/c1ccc2c(c1)OCCCO2)\CN1CCNCC1	1-[(E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enyl]piperazine
COc1cc(C)c(S(=O)(=O)[C@H]2CS(=O)(=O)C[C@@H]2N2CCC(Cc3ccccc3)CC2)cc1C	(3S,4R)-3-(4-benzylpiperidin-1-yl)-4-(4-methoxy-2,5-dimethylphenyl)sulfonylthiolane 1,1-dioxide
CC(=O)c1ccccc1N1CCc2ccccc21	1-[2-(2,3-dihydroindol-1-yl)phenyl]ethanone
O=C1CCN(c2ncc(C(F)(F)F)cc2Cl)C(=O)N1	1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1,3-diazinane-2,4-dione
O[C@H]1[C@@H]2OC[C@H](O2)[C@@H](O)[C@@H]1OCc1ccccc1	(1S,2R,3S,4R,5R)-3-phenylmethoxy-6,8-dioxabicyclo[3.2.1]octane-2,4-diol
c1ccc(C2=NC(c3ccccc3)=NC(c3ccccc3)C2)cc1	2,4,6-triphenyl-4,5-dihydropyrimidine
Cc1cc(C)c(NC(C)(C)C)c(Cl)c1	N-tert-butyl-2-chloro-4,6-dimethylaniline
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3ccc(-n4ccnc4)nc3)cc2)cc1[N+](=O)[O-]	N-(6-imidazol-1-ylpyridin-3-yl)-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzamide
CCNC(=NCc1cc(OC)ccc1O)NC1CCN(Cc2ccccc2)CC1.I	1-(1-benzylpiperidin-4-yl)-3-ethyl-2-[(2-hydroxy-5-methoxyphenyl)methyl]guanidine;hydroiodide
CCCCN(CC(F)(F)F)C(=O)/C=C/c1ccc(N2CCCC2=O)cc1	(E)-N-butyl-3-[4-(2-oxopyrrolidin-1-yl)phenyl]-N-(2,2,2-trifluoroethyl)prop-2-enamide
C[C@]12CC(O)C(O)CC1CC[C@@H]1[C@H]2C(NC2CCCCC2)C[C@]2(C)C(C(=O)O)CC[C@@H]12	(8S,9R,10S,13S,14S)-11-(cyclohexylamino)-2,3-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid
Cc1cc(F)ccc1-c1noc(CC(N)C(C)C)n1	1-[3-(4-fluoro-2-methylphenyl)-1,2,4-oxadiazol-5-yl]-3-methylbutan-2-amine
CCCC1CCN(c2cnc(C(C)C)nc2C(=O)O)C1	2-propan-2-yl-5-(3-propylpyrrolidin-1-yl)pyrimidine-4-carboxylic acid
CCCC[C@H]1C(=O)N(C)[C@@H](CCCC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)NCC(N)=O)CSCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](CCN)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC2=CN=CC2)C(=O)N[C@@H](CCC(=O)O)C(=O)N2C[C@H](O)C[C@H]2C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2cn(CC(=O)O)c3ccccc23)C(=O)N1C	3-[(3S,6S,9S,15S,18S,21S,27R,30S,33S,36S,39S,42S,45S,48S,50R)-15-(2-aminoethyl)-27-[(2-amino-2-oxoethyl)carbamoyl]-33,36-dibutyl-30-(3-carbamimidamidopropyl)-39-[[1-(carboxymethyl)indol-3-yl]methyl]-50-hydroxy-42-(hydroxymethyl)-21-[(4-hydroxyphenyl)methyl]-45-(1H-indol-3-ylmethyl)-18,19,34,37-tetramethyl-2,5,8,14,17,20,23,29,32,35,38,41,44,47-tetradecaoxo-6-(3H-pyrrol-4-ylmethyl)-25-thia-1,4,7,13,16,19,22,28,31,34,37,40,43,46-tetradecazatricyclo[46.3.0.09,13]henpentacontan-3-yl]propanoic acid
CC1CN(CC(C)C(N)=O)c2ccccc2CN1	2-methyl-3-(3-methyl-2,3,4,5-tetrahydro-1,4-benzodiazepin-1-yl)propanamide
CCCOc1ccc(OCC(=O)O)c(C(=O)N(F)Cc2ccccc2)c1	2-[2-[benzyl(fluoro)carbamoyl]-4-propoxyphenoxy]acetic acid
CC(=O)O.CC1=CC(=NO)CC(C)(C)C1	acetic acid;N-(3,5,5-trimethylcyclohex-2-en-1-ylidene)hydroxylamine
COc1c(C)cc(C(=O)N2CCC3(CN(C)C3)C2)cc1C	(4-methoxy-3,5-dimethylphenyl)-(2-methyl-2,6-diazaspiro[3.4]octan-6-yl)methanone
COC(=NO)c1ccc(C2=NOC(C(F)(F)F)C=N2)cc1	methyl N-hydroxy-4-[6-(trifluoromethyl)-6H-1,2,4-oxadiazin-3-yl]benzenecarboximidate
Nc1cc(-c2cc(Cl)cc(Cl)c2)c[nH]c1=O	3-amino-5-(3,5-dichlorophenyl)-1H-pyridin-2-one
Cc1cc(C)cc(-c2nnc(SCCC(N)=O)o2)c1	3-[[5-(3,5-dimethylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide
CS(=O)(=O)c1ccc(CNCCn2ccccc2=O)cc1	1-[2-[(4-methylsulfonylphenyl)methylamino]ethyl]pyridin-2-one
O=C(NC1CCCNC1)c1cncc2ccsc12	N-piperidin-3-ylthieno[3,2-c]pyridine-7-carboxamide
FC(F)(Oc1ccc(CBr)cc1)C(Cl)Cl	1-(bromomethyl)-4-(2,2-dichloro-1,1-difluoroethoxy)benzene
[2H][C@@]1(c2cc(OC)c(O)c(OC)c2)c2cc3c(cc2[C@@H](O[C@@H]2O[C@@H]4CO[C@@H](C)O[C@H]4[C@H](O)[C@H]2O)[C@H]2COC(=O)[C@@H]21)OCO3	(5R,5aR,8aR,9S)-9-[[(2R,4aR,6R,7R,8R,8aS)-7,8-dihydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-5-deuterio-5-(4-hydroxy-3,5-dimethoxyphenyl)-5a,8,8a,9-tetrahydro-[2]benzofuro[6,5-f][1,3]benzodioxol-6-one
CCc1nnc(SCC(=O)Nc2sc(C(N)=O)c(C)c2C(=O)OC)n1CC1CCCO1	methyl 5-carbamoyl-2-[[2-[[5-ethyl-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-4-methylthiophene-3-carboxylate
C=C(C)c1ccc(OCc2ccccc2)c(=O)cc1	2-phenylmethoxy-5-prop-1-en-2-ylcyclohepta-2,4,6-trien-1-one
O=C(O)CN1C[C@]2(C[C@H]2F)c2cc(Br)ccc2C1=O	2-[(2'R,4S)-6-bromo-2'-fluoro-1-oxospiro[3H-isoquinoline-4,1'-cyclopropane]-2-yl]acetic acid
CCCN1CCN(c2nc(CC)nc(Nc3ncc(C(=O)Nc4c(C)cc(C)cc4C)s3)n2)CC1.CCc1nc(NCCCN2CCOCC2)nc(Nc2ncc(C(=O)Nc3c(C)cc(C)cc3C)s2)n1.CCc1nc(NCCN(C)C)nc(Nc2ncc(C(=O)Nc3ccccc3)s2)n1.CCc1nc(NCCN(CC)CC)nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)n1.CCc1nc(Nc2ncc(C(=O)Nc3c(C)cc(C)cc3C)s2)nc(N2CCC(CO)CC2)n1.CCc1nc(Nc2ncc(C(=O)Nc3c(C)cc(C)cc3C)s2)nc(N2CCN(c3ccc(F)cc3)CC2)n1.Cc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)nc(N2CCN(c3cnccn3)CC2)n1.Cc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)nc(N2CCN(c3ncccn3)CC2)n1	N-(2-chloro-6-methylphenyl)-2-[[4-[2-(diethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-methyl-6-(4-pyrazin-2-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-methyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;2-[[4-[2-(dimethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-phenyl-1,3-thiazole-5-carboxamide;2-[[4-ethyl-6-[4-(4-fluorophenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-thiazole-5-carboxamide;2-[[4-ethyl-6-[4-(hydroxymethyl)piperidin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-thiazole-5-carboxamide;2-[[4-ethyl-6-(3-morpholin-4-ylpropylamino)-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-thiazole-5-carboxamide;2-[[4-ethyl-6-(4-propylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-thiazole-5-carboxamide
[O-]p1oc2ccc3ccccc3c2c2c(ccc3ccccc32)o1	13-oxido-12,14-dioxa-13-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaene
N#CCN(C(=O)COC(=O)C1=CN2CCS(=O)(=O)N=C2C=C1)c1ccccc1	[2-[N-(cyanomethyl)anilino]-2-oxoethyl] 2,2-dioxo-3,4-dihydropyrido[2,1-c][1,2,4]thiadiazine-7-carboxylate
O=C(O)COc1ccc(/C=N\n2c(-c3ccccc3F)n[nH]c2=S)cc1	2-[4-[(Z)-[3-(2-fluorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenoxy]acetic acid
CCC(=O)N1CCCc2cc(S(=O)(=O)N(C)c3cccc(C)c3)ccc21	N-methyl-N-(3-methylphenyl)-1-propanoyl-3,4-dihydro-2H-quinoline-6-sulfonamide
CC(=O)C(Cc1cccc2cc3cccc(CC(C(C)=O)C(C)=O)c3cc12)C(C)=O	3-[[8-(2-acetyl-3-oxobutyl)anthracen-1-yl]methyl]pentane-2,4-dione
Cc1ccc(C2OC3(C(=O)c4ccccc4C3=O)C(C(=O)O)C2C(=O)Nc2cc3ccccc3cn2)cc1C	5'-(3,4-dimethylphenyl)-4'-(isoquinolin-3-ylcarbamoyl)-1,3-dioxospiro[indene-2,2'-oxolane]-3'-carboxylic acid
CCC(C)C1NC(=O)CN(c2cc(Cl)ccc2OC)C1=O	3-butan-2-yl-1-(5-chloro-2-methoxyphenyl)piperazine-2,5-dione
CC(C)(C)N1C=Cc2c(N)cccc2C1	2-tert-butyl-1H-isoquinolin-5-amine
C=C/C=C\c1c(NC)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c(C)c1N(CC)C1CCC(N2CC(OCC(F)(F)F)C2)CC1	4-[(1Z)-buta-1,3-dienyl]-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-3-[ethyl-[4-[3-(2,2,2-trifluoroethoxy)azetidin-1-yl]cyclohexyl]amino]-2-methyl-5-(methylamino)benzamide
Cc1cc(Br)cc(N)c1NC(=O)c1ccc(Cl)cc1F	N-(2-amino-4-bromo-6-methylphenyl)-4-chloro-2-fluorobenzamide
CN(C(=O)CNC(=O)c1ccc(Cl)c(Cl)c1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C	3,4-dichloro-N-[2-[[(1S,5R,6R)-7,7-dimethyl-2-oxabicyclo[3.2.0]heptan-6-yl]-methylamino]-2-oxoethyl]benzamide
CCCCCCCC/C=C\CCCCCCCCCC(=O)N[C@@H](CCCN)C(=O)O	(2S)-5-amino-2-[[(Z)-icos-11-enoyl]amino]pentanoic acid
COC1OC(CO)C(=O)C(OOC2COC(C(=O)O)C(O)[C@@H]2C2CC2C2OC(CO)C(O)C(OC3OC(C(=O)O)C(O)C(OC)C3O)C2O)C1OC	6-[2-[2-[(4S)-2-carboxy-3-hydroxy-5-[2-(hydroxymethyl)-5,6-dimethoxy-3-oxooxan-4-yl]peroxyoxan-4-yl]cyclopropyl]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3,5-dihydroxy-4-methoxyoxane-2-carboxylic acid
CC(=O)NCc1ccc(S(=O)(=O)N2CCc3sccc3[C@H]2c2ccccc2)s1	N-[[5-[[(4R)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]sulfonyl]thiophen-2-yl]methyl]acetamide
COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1nc2ccc(-c3ccc4c(=O)c5cc(-c6cnc([C@@H]7CCCN7C(=O)[C@H](NC(=O)OC)c7ccccc7)[nH]6)ccc5oc4c3)cc2[nH]1)C(C)C	methyl N-[(1R)-2-[(2S)-2-[5-[6-[2-[(2S)-1-[(2S)-2-(methoxycarbonylamino)-3-methylbutanoyl]pyrrolidin-2-yl]-3H-benzimidazol-5-yl]-9-oxoxanthen-2-yl]-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-oxo-1-phenylethyl]carbamate
O=C(CSc1nnc(-c2cccs2)n1-c1ccccc1Cl)Nc1cccc(C(=O)[O-])c1	3-[[2-[[4-(2-chlorophenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate
O=P(c1ccccc1)(c1ccccc1)c1ccc2c(c1)[Si](c1ccccc1)(c1ccccc1)c1cc3c4ccccc4c4ccccc4c3cc1-2	20-diphenylphosphoryl-23,23-diphenyl-23-silahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaene
O=C(O)NCCOc1cccc(N2CCCC2)n1	2-(6-pyrrolidin-1-ylpyridin-2-yl)oxyethylcarbamic acid
CCOC(=O)c1csc(CNC(=O)CC2CC3CCC(C2)N3)n1.Cl.Cl	ethyl 2-[[[2-(8-azabicyclo[3.2.1]octan-3-yl)acetyl]amino]methyl]-1,3-thiazole-4-carboxylate;dihydrochloride
CC(NC(=O)C1(c2ccccc2Cl)CCOCC1)C(=O)O	2-[[4-(2-chlorophenyl)oxane-4-carbonyl]amino]propanoic acid
CN(C(=O)CCC(=O)c1ccc(F)cc1)[C@@H]1CCS(=O)(=O)C1	N-[(3R)-1,1-dioxothiolan-3-yl]-4-(4-fluorophenyl)-N-methyl-4-oxobutanamide
Cc1nn2c(Cl)c3c(nc2c1-c1cccs1)CCCC3	9-chloro-2-methyl-3-thiophen-2-yl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazoline
CC(CO)(CO)NC(=O)c1n[nH]c(C(C)(C)C)n1	5-tert-butyl-N-(1,3-dihydroxy-2-methylpropan-2-yl)-1H-1,2,4-triazole-3-carboxamide
Cc1nnc2c(NCCCCCC(=O)OCC(C)C)nc3cc4c(cc3n12)OCCO4	2-methylpropyl 6-[(12-methyl-4,7-dioxa-11,13,14,17-tetrazatetracyclo[8.7.0.03,8.011,15]heptadeca-1,3(8),9,12,14,16-hexaen-16-yl)amino]hexanoate
CCC1CCCN(C(=O)c2ccc(F)c(C(F)(F)F)c2)C1	(3-ethylpiperidin-1-yl)-[4-fluoro-3-(trifluoromethyl)phenyl]methanone
CC(OC=O)OCCOC(=O)C12CC3CC(CC(C3)C1)C2	2-(1-formyloxyethoxy)ethyl adamantane-1-carboxylate
COCCOc1ccc(NC(=O)NC(C)(C)CCC(=O)OC(C)(C)C)cn1	tert-butyl 4-[[6-(2-methoxyethoxy)pyridin-3-yl]carbamoylamino]-4-methylpentanoate
O=C(CCN1Cc2ccccc2C1=O)N1CCC[C@H](c2ccn[nH]2)C1	2-[3-oxo-3-[(3S)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propyl]-3H-isoindol-1-one
O=C(Nc1ccccc1C1CCCC(=S)C1)c1ccc(OCCN2CCCCC2)cc1	4-(2-piperidin-1-ylethoxy)-N-[2-(3-sulfanylidenecyclohexyl)phenyl]benzamide
CC(C)(C)c1cccc(C(N)CCC(=O)O)c1	4-amino-4-(3-tert-butylphenyl)butanoic acid
COCCC(C)N(C)c1ccccc1C#N	2-[4-methoxybutan-2-yl(methyl)amino]benzonitrile
COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4ccc(-c5nc([C@@H]6CCCN6C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]c5Br)cc4)n3-c3ccc(C4CC4)cc3)cc2)[nH]1)C(C)C	methyl N-[(2S)-1-[(2S)-2-[5-bromo-4-[4-[1-(4-cyclopropylphenyl)-5-[4-[2-[(2S)-1-[(2S)-2-(methoxycarbonylamino)-3-methylbutanoyl]pyrrolidin-2-yl]-1H-imidazol-5-yl]phenyl]pyrrol-2-yl]phenyl]-1H-imidazol-2-yl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate
C[C@H](Cc1cccc(N)c1)NCC(C)(C)F	3-[(2R)-2-[(2-fluoro-2-methylpropyl)amino]propyl]aniline
O=C(Nc1ccc(C(F)(F)F)cc1)N1C2CCC1CNC2	N-[4-(trifluoromethyl)phenyl]-3,8-diazabicyclo[3.2.1]octane-8-carboxamide
ONc1ccccc1S(F)(F)(F)(F)F	N-[2-(pentafluoro-λ6-sulfanyl)phenyl]hydroxylamine
Cc1ccc(N(C)Cc2cccnc2C(=N)N)c(C)c1	3-[(N,2,4-trimethylanilino)methyl]pyridine-2-carboximidamide
CC(=O)Nc1sc2c(c1C(=O)OC(C)C(=O)NCC(F)(F)F)CCCC2	[1-oxo-1-(2,2,2-trifluoroethylamino)propan-2-yl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
CC.CN=C(C)C(=O)O.COc1ccc(/C(C=O)=C(/NCC(C)C)c2ccc(OC)cc2)cc1	(Z)-2,3-bis(4-methoxyphenyl)-3-(2-methylpropylamino)prop-2-enal;ethane;2-methyliminopropanoic acid
Cc1c(OCC(F)(F)F)ccnc1COSc1nc2ccccc2n1COC(=O)c1ccccc1.[HH]	[2-[[3-methyl-4-(2,2,2-trifluoroethoxy)pyridin-2-yl]methoxysulfanyl]benzimidazol-1-yl]methyl benzoate;molecular hydrogen
CCCCCNC(=O)NC(C(=O)O)C(C)O	3-hydroxy-2-(pentylcarbamoylamino)butanoic acid
CC(C)[Si](OC[C@H]1OC(n2cnc3c(N)ncnc32)[C@@H](O)[C@@H]1O)(C(C)C)C(C)C	(3S,4S,5R)-2-(6-aminopurin-9-yl)-5-[tri(propan-2-yl)silyloxymethyl]oxolane-3,4-diol
CS(=O)(=O)Nc1cc(Cl)cc(-c2nc(C3CC3)oc2-c2ccnc(N)n2)c1F	N-[3-[5-(2-aminopyrimidin-4-yl)-2-cyclopropyl-1,3-oxazol-4-yl]-5-chloro-2-fluorophenyl]methanesulfonamide
O=C(NCCc1cccc2cccnc12)c1cscn1	N-(2-quinolin-8-ylethyl)-1,3-thiazole-4-carboxamide
Cl.N[C@@H](c1cc(I)c(O)c(I)c1)C(F)F	4-[(1S)-1-amino-2,2-difluoroethyl]-2,6-diiodophenol;hydrochloride
CNCCS(=O)(=O)NC(COC)C(C)C	N-(1-methoxy-3-methylbutan-2-yl)-2-(methylamino)ethanesulfonamide
CCOC(=O)C[P@@]1[P@]2C(c3ccccc3)=C(c3ccccc3)[C@]1(c1ccccc1)[C@@H]1C(=O)N(c3ccccc3)C(=O)[C@@H]12	ethyl 2-[(1R,2R,6R,7R,10S)-3,5-dioxo-4,7,8,9-tetraphenyl-4-aza-1,10-diphosphatricyclo[5.2.1.02,6]dec-8-en-10-yl]acetate

c1cc(-[n+]2coc3cccnc32)cc(-[n+]2coc3ccc[nH+]c32)c1

3-[3-([1,3]oxazolo[4,5-b]pyridine-3,4-diium-3-yl)phenyl]-[1,3]oxazolo[4,5-b]pyridin-3-ium

CCCCN(C)CCCC(=O)Nc1ccccc1C#N

4-[butyl(methyl)amino]-N-(2-cyanophenyl)butanamide

COc1ncnc2c1nc(N)n2Cc1cccc(F)c1

9-[(3-fluorophenyl)methyl]-6-methoxypurin-8-amine

C1CCC(NC2CC2)CNC1

N-cyclopropylazepan-3-amine

CC(C)NC(=O)c1nc(C(=O)Nc2ccc(Cl)cc2)n2ccccc12

3-N-(4-chlorophenyl)-1-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide

O=c1cc(-c2ccc(Cl)cc2O)oc2c(Cl)cccc12

8-chloro-2-(4-chloro-2-hydroxyphenyl)chromen-4-one

Cc1cc2ccccc2n2c(=O)n(CCNC(=O)[C@@H]3[C@H]4C(=O)N(C)C[C@@]45C=C[C@H]3O5)nc12

(1R,5R,6R,7R)-3-methyl-N-[2-(4-methyl-1-oxo-[1,2,4]triazolo[4,3-a]quinolin-2-yl)ethyl]-4-oxo-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene-6-carboxamide

CC[C@H](NC(=O)CSc1nncs1)c1ccc(C)cc1

N-[(1S)-1-(4-methylphenyl)propyl]-2-(1,3,4-thiadiazol-2-ylsulfanyl)acetamide

CCNC(=NCc1ccccc1CN1CCCC1=O)NCCCOCC1CC1.I

1-[3-(cyclopropylmethoxy)propyl]-3-ethyl-2-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]guanidine;hydroiodide

CCOC(=O)c1cc(Br)cc(S(=O)(=O)NCc2ccc(-c3nccs3)cc2)c1

ethyl 3-bromo-5-[[4-(1,3-thiazol-2-yl)phenyl]methylsulfamoyl]benzoate

CC(C(=O)Nc1ccncc1)n1nc(-c2ccc(F)cc2)ccc1=O

2-[3-(4-fluorophenyl)-6-oxopyridazin-1-yl]-N-pyridin-4-ylpropanamide

CN=C(NCCc1cc(F)cc(F)c1)NCC1COc2ccccc2O1.I

1-[2-(3,5-difluorophenyl)ethyl]-3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-methylguanidine;hydroiodide

CN=C(NCCc1ccc2c(c1)OCO2)NCC(C)Oc1ccccc1OC

1-[2-(1,3-benzodioxol-5-yl)ethyl]-3-[2-(2-methoxyphenoxy)propyl]-2-methylguanidine

CCCC(N)(C=CP(=O)(OC)OC)CCCc1ccc(Sc2cccc(OCc3ccccc3)c2)cc1Cl

1-[2-chloro-4-(3-phenylmethoxyphenyl)sulfanylphenyl]-4-(2-dimethoxyphosphorylethenyl)heptan-4-amine

O=C(NCC#CCOc1ccc2c(c1)OCO2)c1cc(C2CC2)on1

N-[4-(1,3-benzodioxol-5-yloxy)but-2-ynyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide

CCOc1ccc(C2(CNC(=NC)N(C)Cc3ccccc3OC)CCOCC2)cc1.I

3-[[4-(4-ethoxyphenyl)oxan-4-yl]methyl]-1-[(2-methoxyphenyl)methyl]-1,2-dimethylguanidine;hydroiodide

COCCn1ncc(NCCC(=O)N(C)C)c(Br)c1=O

3-[[5-bromo-1-(2-methoxyethyl)-6-oxopyridazin-4-yl]amino]-N,N-dimethylpropanamide

CCC(C)(CN)OCCC(=O)O

3-(1-amino-2-methylbutan-2-yl)oxypropanoic acid

COc1cc([N+](=O)[O-])ccc1NC(=O)NCC#N

1-(cyanomethyl)-3-(2-methoxy-4-nitrophenyl)urea

COCc1nc(C)cc(N2CCC[C@H]3C(=O)NC[C@H]32)n1.I

(4aR,7aS)-1-[2-(methoxymethyl)-6-methylpyrimidin-4-yl]-3,4,4a,6,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridin-5-one;hydroiodide

CC(C)(C)C(=O)Nc1cccc(NC(=O)c2cnc(C(C)(C)C)s2)c1

2-tert-butyl-N-[3-(2,2-dimethylpropanoylamino)phenyl]-1,3-thiazole-5-carboxamide

COc1cc(S(C)(=O)=O)ccc1NC(N)=Nc1ccc(-c2ccc(NC(=O)[C@H](N)c3ccc(F)cc3)cc2)cn1

(2R)-2-amino-N-[4-[6-[[amino-(2-methoxy-4-methylsulfonylanilino)methylidene]amino]pyridin-3-yl]phenyl]-2-(4-fluorophenyl)acetamide

CCCC(=O)OCC(COC(=O)NCC)OCCCC(=O)ON1C(=O)CCC1=O

(2,5-dioxopyrrolidin-1-yl) 4-[1-butanoyloxy-3-(ethylcarbamoyloxy)propan-2-yl]oxybutanoate

CC(=O)c1cnc2ccc(-c3cc(F)c(O)c(Cl)c3)nc2c1NC1CCC(NC(=O)C(C(C)C)N(C(=O)O)C(C)(C)C)CC1

[1-[[4-[[3-acetyl-6-(3-chloro-5-fluoro-4-hydroxyphenyl)-1,5-naphthyridin-4-yl]amino]cyclohexyl]amino]-3-methyl-1-oxobutan-2-yl]-tert-butylcarbamic acid

Cc1cc2c(cc1S(N)(=O)=O)S(=O)(=O)NC1(CCN(C(=O)CC(CO[N+](=O)[O-])O[N+](=O)[O-])CC1)N2

[4-(6-methyl-1,1-dioxo-7-sulfamoylspiro[2,4-dihydro-1λ6,2,4-benzothiadiazine-3,4'-piperidine]-1'-yl)-1-nitrooxy-4-oxobutan-2-yl] nitrate

C(=C/c1ccc2c(c1)OCCCO2)\CN1CCNCC1

1-[(E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enyl]piperazine

COc1cc(C)c(S(=O)(=O)[C@H]2CS(=O)(=O)C[C@@H]2N2CCC(Cc3ccccc3)CC2)cc1C

(3S,4R)-3-(4-benzylpiperidin-1-yl)-4-(4-methoxy-2,5-dimethylphenyl)sulfonylthiolane 1,1-dioxide

CC(=O)c1ccccc1N1CCc2ccccc21

1-[2-(2,3-dihydroindol-1-yl)phenyl]ethanone

O=C1CCN(c2ncc(C(F)(F)F)cc2Cl)C(=O)N1

1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1,3-diazinane-2,4-dione

O[C@H]1[C@@H]2OC[C@H](O2)[C@@H](O)[C@@H]1OCc1ccccc1

(1S,2R,3S,4R,5R)-3-phenylmethoxy-6,8-dioxabicyclo[3.2.1]octane-2,4-diol

c1ccc(C2=NC(c3ccccc3)=NC(c3ccccc3)C2)cc1

2,4,6-triphenyl-4,5-dihydropyrimidine

Cc1cc(C)c(NC(C)(C)C)c(Cl)c1

N-tert-butyl-2-chloro-4,6-dimethylaniline

Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3ccc(-n4ccnc4)nc3)cc2)cc1[N+](=O)[O-]

N-(6-imidazol-1-ylpyridin-3-yl)-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzamide

CCNC(=NCc1cc(OC)ccc1O)NC1CCN(Cc2ccccc2)CC1.I

1-(1-benzylpiperidin-4-yl)-3-ethyl-2-[(2-hydroxy-5-methoxyphenyl)methyl]guanidine;hydroiodide

CCCCN(CC(F)(F)F)C(=O)/C=C/c1ccc(N2CCCC2=O)cc1

(E)-N-butyl-3-[4-(2-oxopyrrolidin-1-yl)phenyl]-N-(2,2,2-trifluoroethyl)prop-2-enamide

C[C@]12CC(O)C(O)CC1CC[C@@H]1[C@H]2C(NC2CCCCC2)C[C@]2(C)C(C(=O)O)CC[C@@H]12

(8S,9R,10S,13S,14S)-11-(cyclohexylamino)-2,3-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid

Cc1cc(F)ccc1-c1noc(CC(N)C(C)C)n1

1-[3-(4-fluoro-2-methylphenyl)-1,2,4-oxadiazol-5-yl]-3-methylbutan-2-amine

CCCC1CCN(c2cnc(C(C)C)nc2C(=O)O)C1

2-propan-2-yl-5-(3-propylpyrrolidin-1-yl)pyrimidine-4-carboxylic acid

CCCC[C@H]1C(=O)N(C)[C@@H](CCCC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)NCC(N)=O)CSCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](CCN)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC2=CN=CC2)C(=O)N[C@@H](CCC(=O)O)C(=O)N2C[C@H](O)C[C@H]2C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2cn(CC(=O)O)c3ccccc23)C(=O)N1C

3-[(3S,6S,9S,15S,18S,21S,27R,30S,33S,36S,39S,42S,45S,48S,50R)-15-(2-aminoethyl)-27-[(2-amino-2-oxoethyl)carbamoyl]-33,36-dibutyl-30-(3-carbamimidamidopropyl)-39-[[1-(carboxymethyl)indol-3-yl]methyl]-50-hydroxy-42-(hydroxymethyl)-21-[(4-hydroxyphenyl)methyl]-45-(1H-indol-3-ylmethyl)-18,19,34,37-tetramethyl-2,5,8,14,17,20,23,29,32,35,38,41,44,47-tetradecaoxo-6-(3H-pyrrol-4-ylmethyl)-25-thia-1,4,7,13,16,19,22,28,31,34,37,40,43,46-tetradecazatricyclo[46.3.0.09,13]henpentacontan-3-yl]propanoic acid

CC1CN(CC(C)C(N)=O)c2ccccc2CN1

2-methyl-3-(3-methyl-2,3,4,5-tetrahydro-1,4-benzodiazepin-1-yl)propanamide

CCCOc1ccc(OCC(=O)O)c(C(=O)N(F)Cc2ccccc2)c1

2-[2-[benzyl(fluoro)carbamoyl]-4-propoxyphenoxy]acetic acid

CC(=O)O.CC1=CC(=NO)CC(C)(C)C1

acetic acid;N-(3,5,5-trimethylcyclohex-2-en-1-ylidene)hydroxylamine

COc1c(C)cc(C(=O)N2CCC3(CN(C)C3)C2)cc1C

(4-methoxy-3,5-dimethylphenyl)-(2-methyl-2,6-diazaspiro[3.4]octan-6-yl)methanone

COC(=NO)c1ccc(C2=NOC(C(F)(F)F)C=N2)cc1

methyl N-hydroxy-4-[6-(trifluoromethyl)-6H-1,2,4-oxadiazin-3-yl]benzenecarboximidate

Nc1cc(-c2cc(Cl)cc(Cl)c2)c[nH]c1=O

3-amino-5-(3,5-dichlorophenyl)-1H-pyridin-2-one

Cc1cc(C)cc(-c2nnc(SCCC(N)=O)o2)c1

3-[[5-(3,5-dimethylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide

CS(=O)(=O)c1ccc(CNCCn2ccccc2=O)cc1

1-[2-[(4-methylsulfonylphenyl)methylamino]ethyl]pyridin-2-one

O=C(NC1CCCNC1)c1cncc2ccsc12

N-piperidin-3-ylthieno[3,2-c]pyridine-7-carboxamide

FC(F)(Oc1ccc(CBr)cc1)C(Cl)Cl

1-(bromomethyl)-4-(2,2-dichloro-1,1-difluoroethoxy)benzene

[2H][C@@]1(c2cc(OC)c(O)c(OC)c2)c2cc3c(cc2[C@@H](O[C@@H]2O[C@@H]4CO[C@@H](C)O[C@H]4[C@H](O)[C@H]2O)[C@H]2COC(=O)[C@@H]21)OCO3

(5R,5aR,8aR,9S)-9-[[(2R,4aR,6R,7R,8R,8aS)-7,8-dihydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-5-deuterio-5-(4-hydroxy-3,5-dimethoxyphenyl)-5a,8,8a,9-tetrahydro-[2]benzofuro[6,5-f][1,3]benzodioxol-6-one

CCc1nnc(SCC(=O)Nc2sc(C(N)=O)c(C)c2C(=O)OC)n1CC1CCCO1

methyl 5-carbamoyl-2-[[2-[[5-ethyl-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-4-methylthiophene-3-carboxylate

C=C(C)c1ccc(OCc2ccccc2)c(=O)cc1

2-phenylmethoxy-5-prop-1-en-2-ylcyclohepta-2,4,6-trien-1-one

O=C(O)CN1C[C@]2(C[C@H]2F)c2cc(Br)ccc2C1=O

2-[(2'R,4S)-6-bromo-2'-fluoro-1-oxospiro[3H-isoquinoline-4,1'-cyclopropane]-2-yl]acetic acid

CCCN1CCN(c2nc(CC)nc(Nc3ncc(C(=O)Nc4c(C)cc(C)cc4C)s3)n2)CC1.CCc1nc(NCCCN2CCOCC2)nc(Nc2ncc(C(=O)Nc3c(C)cc(C)cc3C)s2)n1.CCc1nc(NCCN(C)C)nc(Nc2ncc(C(=O)Nc3ccccc3)s2)n1.CCc1nc(NCCN(CC)CC)nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)n1.CCc1nc(Nc2ncc(C(=O)Nc3c(C)cc(C)cc3C)s2)nc(N2CCC(CO)CC2)n1.CCc1nc(Nc2ncc(C(=O)Nc3c(C)cc(C)cc3C)s2)nc(N2CCN(c3ccc(F)cc3)CC2)n1.Cc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)nc(N2CCN(c3cnccn3)CC2)n1.Cc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)nc(N2CCN(c3ncccn3)CC2)n1

N-(2-chloro-6-methylphenyl)-2-[[4-[2-(diethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-methyl-6-(4-pyrazin-2-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2-chloro-6-methylphenyl)-2-[[4-methyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;2-[[4-[2-(dimethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-phenyl-1,3-thiazole-5-carboxamide;2-[[4-ethyl-6-[4-(4-fluorophenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-thiazole-5-carboxamide;2-[[4-ethyl-6-[4-(hydroxymethyl)piperidin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-thiazole-5-carboxamide;2-[[4-ethyl-6-(3-morpholin-4-ylpropylamino)-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-thiazole-5-carboxamide;2-[[4-ethyl-6-(4-propylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-thiazole-5-carboxamide

[O-]p1oc2ccc3ccccc3c2c2c(ccc3ccccc32)o1

13-oxido-12,14-dioxa-13-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaene

N#CCN(C(=O)COC(=O)C1=CN2CCS(=O)(=O)N=C2C=C1)c1ccccc1

[2-[N-(cyanomethyl)anilino]-2-oxoethyl] 2,2-dioxo-3,4-dihydropyrido[2,1-c][1,2,4]thiadiazine-7-carboxylate

O=C(O)COc1ccc(/C=N\n2c(-c3ccccc3F)n[nH]c2=S)cc1

2-[4-[(Z)-[3-(2-fluorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenoxy]acetic acid

CCC(=O)N1CCCc2cc(S(=O)(=O)N(C)c3cccc(C)c3)ccc21

N-methyl-N-(3-methylphenyl)-1-propanoyl-3,4-dihydro-2H-quinoline-6-sulfonamide

CC(=O)C(Cc1cccc2cc3cccc(CC(C(C)=O)C(C)=O)c3cc12)C(C)=O

3-[[8-(2-acetyl-3-oxobutyl)anthracen-1-yl]methyl]pentane-2,4-dione

Cc1ccc(C2OC3(C(=O)c4ccccc4C3=O)C(C(=O)O)C2C(=O)Nc2cc3ccccc3cn2)cc1C

5'-(3,4-dimethylphenyl)-4'-(isoquinolin-3-ylcarbamoyl)-1,3-dioxospiro[indene-2,2'-oxolane]-3'-carboxylic acid

CCC(C)C1NC(=O)CN(c2cc(Cl)ccc2OC)C1=O

3-butan-2-yl-1-(5-chloro-2-methoxyphenyl)piperazine-2,5-dione

CC(C)(C)N1C=Cc2c(N)cccc2C1

2-tert-butyl-1H-isoquinolin-5-amine

C=C/C=C\c1c(NC)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c(C)c1N(CC)C1CCC(N2CC(OCC(F)(F)F)C2)CC1

4-[(1Z)-buta-1,3-dienyl]-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-3-[ethyl-[4-[3-(2,2,2-trifluoroethoxy)azetidin-1-yl]cyclohexyl]amino]-2-methyl-5-(methylamino)benzamide

Cc1cc(Br)cc(N)c1NC(=O)c1ccc(Cl)cc1F

N-(2-amino-4-bromo-6-methylphenyl)-4-chloro-2-fluorobenzamide

CN(C(=O)CNC(=O)c1ccc(Cl)c(Cl)c1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C

3,4-dichloro-N-[2-[[(1S,5R,6R)-7,7-dimethyl-2-oxabicyclo[3.2.0]heptan-6-yl]-methylamino]-2-oxoethyl]benzamide

CCCCCCCC/C=C\CCCCCCCCCC(=O)N[C@@H](CCCN)C(=O)O

(2S)-5-amino-2-[[(Z)-icos-11-enoyl]amino]pentanoic acid

COC1OC(CO)C(=O)C(OOC2COC(C(=O)O)C(O)[C@@H]2C2CC2C2OC(CO)C(O)C(OC3OC(C(=O)O)C(O)C(OC)C3O)C2O)C1OC

6-[2-[2-[(4S)-2-carboxy-3-hydroxy-5-[2-(hydroxymethyl)-5,6-dimethoxy-3-oxooxan-4-yl]peroxyoxan-4-yl]cyclopropyl]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3,5-dihydroxy-4-methoxyoxane-2-carboxylic acid

CC(=O)NCc1ccc(S(=O)(=O)N2CCc3sccc3[C@H]2c2ccccc2)s1

N-[[5-[[(4R)-4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]sulfonyl]thiophen-2-yl]methyl]acetamide

COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1nc2ccc(-c3ccc4c(=O)c5cc(-c6cnc([C@@H]7CCCN7C(=O)[C@H](NC(=O)OC)c7ccccc7)[nH]6)ccc5oc4c3)cc2[nH]1)C(C)C

methyl N-[(1R)-2-[(2S)-2-[5-[6-[2-[(2S)-1-[(2S)-2-(methoxycarbonylamino)-3-methylbutanoyl]pyrrolidin-2-yl]-3H-benzimidazol-5-yl]-9-oxoxanthen-2-yl]-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-oxo-1-phenylethyl]carbamate

O=C(CSc1nnc(-c2cccs2)n1-c1ccccc1Cl)Nc1cccc(C(=O)[O-])c1

3-[[2-[[4-(2-chlorophenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate

O=P(c1ccccc1)(c1ccccc1)c1ccc2c(c1)[Si](c1ccccc1)(c1ccccc1)c1cc3c4ccccc4c4ccccc4c3cc1-2

20-diphenylphosphoryl-23,23-diphenyl-23-silahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaene

O=C(O)NCCOc1cccc(N2CCCC2)n1

2-(6-pyrrolidin-1-ylpyridin-2-yl)oxyethylcarbamic acid

CCOC(=O)c1csc(CNC(=O)CC2CC3CCC(C2)N3)n1.Cl.Cl

ethyl 2-[[[2-(8-azabicyclo[3.2.1]octan-3-yl)acetyl]amino]methyl]-1,3-thiazole-4-carboxylate;dihydrochloride

CC(NC(=O)C1(c2ccccc2Cl)CCOCC1)C(=O)O

2-[[4-(2-chlorophenyl)oxane-4-carbonyl]amino]propanoic acid

CN(C(=O)CCC(=O)c1ccc(F)cc1)[C@@H]1CCS(=O)(=O)C1

N-[(3R)-1,1-dioxothiolan-3-yl]-4-(4-fluorophenyl)-N-methyl-4-oxobutanamide

Cc1nn2c(Cl)c3c(nc2c1-c1cccs1)CCCC3

9-chloro-2-methyl-3-thiophen-2-yl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazoline

CC(CO)(CO)NC(=O)c1n[nH]c(C(C)(C)C)n1

5-tert-butyl-N-(1,3-dihydroxy-2-methylpropan-2-yl)-1H-1,2,4-triazole-3-carboxamide

Cc1nnc2c(NCCCCCC(=O)OCC(C)C)nc3cc4c(cc3n12)OCCO4

2-methylpropyl 6-[(12-methyl-4,7-dioxa-11,13,14,17-tetrazatetracyclo[8.7.0.03,8.011,15]heptadeca-1,3(8),9,12,14,16-hexaen-16-yl)amino]hexanoate

CCC1CCCN(C(=O)c2ccc(F)c(C(F)(F)F)c2)C1

(3-ethylpiperidin-1-yl)-[4-fluoro-3-(trifluoromethyl)phenyl]methanone

CC(OC=O)OCCOC(=O)C12CC3CC(CC(C3)C1)C2

2-(1-formyloxyethoxy)ethyl adamantane-1-carboxylate

COCCOc1ccc(NC(=O)NC(C)(C)CCC(=O)OC(C)(C)C)cn1

tert-butyl 4-[[6-(2-methoxyethoxy)pyridin-3-yl]carbamoylamino]-4-methylpentanoate

O=C(CCN1Cc2ccccc2C1=O)N1CCC[C@H](c2ccn[nH]2)C1

2-[3-oxo-3-[(3S)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propyl]-3H-isoindol-1-one

O=C(Nc1ccccc1C1CCCC(=S)C1)c1ccc(OCCN2CCCCC2)cc1

4-(2-piperidin-1-ylethoxy)-N-[2-(3-sulfanylidenecyclohexyl)phenyl]benzamide

CC(C)(C)c1cccc(C(N)CCC(=O)O)c1

4-amino-4-(3-tert-butylphenyl)butanoic acid

COCCC(C)N(C)c1ccccc1C#N

2-[4-methoxybutan-2-yl(methyl)amino]benzonitrile

COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4ccc(-c5nc([C@@H]6CCCN6C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]c5Br)cc4)n3-c3ccc(C4CC4)cc3)cc2)[nH]1)C(C)C

methyl N-[(2S)-1-[(2S)-2-[5-bromo-4-[4-[1-(4-cyclopropylphenyl)-5-[4-[2-[(2S)-1-[(2S)-2-(methoxycarbonylamino)-3-methylbutanoyl]pyrrolidin-2-yl]-1H-imidazol-5-yl]phenyl]pyrrol-2-yl]phenyl]-1H-imidazol-2-yl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate

C[C@H](Cc1cccc(N)c1)NCC(C)(C)F

3-[(2R)-2-[(2-fluoro-2-methylpropyl)amino]propyl]aniline

O=C(Nc1ccc(C(F)(F)F)cc1)N1C2CCC1CNC2

N-[4-(trifluoromethyl)phenyl]-3,8-diazabicyclo[3.2.1]octane-8-carboxamide

ONc1ccccc1S(F)(F)(F)(F)F

N-[2-(pentafluoro-λ6-sulfanyl)phenyl]hydroxylamine

Cc1ccc(N(C)Cc2cccnc2C(=N)N)c(C)c1

3-[(N,2,4-trimethylanilino)methyl]pyridine-2-carboximidamide

CC(=O)Nc1sc2c(c1C(=O)OC(C)C(=O)NCC(F)(F)F)CCCC2

[1-oxo-1-(2,2,2-trifluoroethylamino)propan-2-yl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

CC.CN=C(C)C(=O)O.COc1ccc(/C(C=O)=C(/NCC(C)C)c2ccc(OC)cc2)cc1

(Z)-2,3-bis(4-methoxyphenyl)-3-(2-methylpropylamino)prop-2-enal;ethane;2-methyliminopropanoic acid

Cc1c(OCC(F)(F)F)ccnc1COSc1nc2ccccc2n1COC(=O)c1ccccc1.[HH]

[2-[[3-methyl-4-(2,2,2-trifluoroethoxy)pyridin-2-yl]methoxysulfanyl]benzimidazol-1-yl]methyl benzoate;molecular hydrogen

CCCCCNC(=O)NC(C(=O)O)C(C)O

3-hydroxy-2-(pentylcarbamoylamino)butanoic acid

CC(C)[Si](OC[C@H]1OC(n2cnc3c(N)ncnc32)[C@@H](O)[C@@H]1O)(C(C)C)C(C)C

(3S,4S,5R)-2-(6-aminopurin-9-yl)-5-[tri(propan-2-yl)silyloxymethyl]oxolane-3,4-diol

CS(=O)(=O)Nc1cc(Cl)cc(-c2nc(C3CC3)oc2-c2ccnc(N)n2)c1F

N-[3-[5-(2-aminopyrimidin-4-yl)-2-cyclopropyl-1,3-oxazol-4-yl]-5-chloro-2-fluorophenyl]methanesulfonamide

O=C(NCCc1cccc2cccnc12)c1cscn1

N-(2-quinolin-8-ylethyl)-1,3-thiazole-4-carboxamide

Cl.N[C@@H](c1cc(I)c(O)c(I)c1)C(F)F

4-[(1S)-1-amino-2,2-difluoroethyl]-2,6-diiodophenol;hydrochloride

CNCCS(=O)(=O)NC(COC)C(C)C

N-(1-methoxy-3-methylbutan-2-yl)-2-(methylamino)ethanesulfonamide

CCOC(=O)C[P@@]1[P@]2C(c3ccccc3)=C(c3ccccc3)[C@]1(c1ccccc1)[C@@H]1C(=O)N(c3ccccc3)C(=O)[C@@H]12

ethyl 2-[(1R,2R,6R,7R,10S)-3,5-dioxo-4,7,8,9-tetraphenyl-4-aza-1,10-diphosphatricyclo[5.2.1.02,6]dec-8-en-10-yl]acetate