Compound Search
化合物数据库
基于 PubChem CID 索引,支持名称 / 同义词 / CAS / SMILES 检索。
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Cc1c2c(nn1C)C(C1CC1)OCCCCn1c(C(=O)O)c(CCCOc3cccc4ccccc34)c3ccc(Cl)c-2c31 -
CCc1c2c(nn1C)C(CCC(C)(C)O)OCCCCn1c(C(=O)O)c(CCCOc3cccc4cc(F)ccc34)c3ccc(Cl)c-2c31 -
5-Chloro-2-ethyl-N-(((1s,4S)-1-hydroxy-4-(methylsulfonyl)cyclohexyl)methyl)-1-((S*)-4-isobutyl-2-methoxyphenyl)-1H-imidazole-4-carboxamide PubChem CID 146286524
CCc1nc(C(=O)NCC2(O)CCC(S(C)(=O)=O)CC2)c(Cl)n1-c1ccc(CC(C)C)cc1OC -
(R,E)-5-(*R)-(2-Methyl-4-phenoxyphenyl)-N-(1-(4- (methylamino)but-2-enoyl)piperidin-3-yl)-4-oxo-4,5-dihydro-3H-1- thia-3,5,8-triazaacenaphthylene-2-carboxamide; PubChem CID 155922498
CNC/C=C/C(=O)N1CCC[C@@H](NC(=O)C2=C3NC(=O)N(c4ccc(Oc5ccccc5)cc4C)C4CCNC(S2)C34)C1 -
2-(4-(2-(4-chloro- 2-fluorophenyl)-2- methylbenzo[d][1, 3]dioxol-4-yl)-2,6- difluorobenzyl)-1- (((S)-oxetan-2- yl)methyl)-1H- benzo[d]imidazole- 6-carboxylic acid PubChem CID 156813705
CC1(c2ccc(Cl)cc2F)Oc2cccc(-c3cc(F)c(Cc4nc5ccc(C(=O)O)cc5n4C[C@@H]4CCO4)c(F)c3)c2O1 -
CNc1ncc2cc(-c3cc(NC(=O)N4CC[C@H](CC(F)(F)F)C4)c(F)cc3C)c(C)nc2n1 -
2-(1-((4- carboxyphenyl)amino)-3-(2- fluorocyclopropyl)-1- oxopropan-2-yl)-5-(3- chloro-6-(difluoromethyl)- 2-fluorophenyl)pyridine 1- oxide PubChem CID 134261924
O=C(O)c1ccc(NC(=O)C(CC2CC2F)c2ccc(-c3c(C(F)F)ccc(Cl)c3F)c[n+]2[O-])cc1 -
2-(1-((4- carboxyphenyl)amino)-1- oxo-3-(2- (trifluoromethyl)cyclo- propyl) propan-2-yl)-5-(3-chloro- 6-(difluoromethyl)-2- fluorophenyl)pyridine 1- oxide PubChem CID 137554360
O=C(O)c1ccc(NC(=O)C(CC2CC2C(F)(F)F)c2ccc(-c3c(C(F)F)ccc(Cl)c3F)c[n+]2[O-])cc1 -
(+)-2-(1-Ethyl-propyl)-6,7-dimethoxy-1-oxo-1,2-dihydro-isoquinoline-4-carboxylic acid (6,7-dihydro-5H-[1]pyrindin-5-yl)-amide PubChem CID 140606594
CCC(CC)n1cc(C(=O)NC2CCc3ncccc32)c2cc(OC)c(OC)cc2c1=O -
2-fluoro-5-methyl-4-(methyl((S)-1-((1r,3S)-3-phenylcyclobutyl)-pyrrolidin-3-yl)amino)-N-(thiazol-4-yl)benzenesulfonamide formate PubChem CID 132141584
Cc1cc(S(=O)(=O)Nc2cscn2)c(F)cc1N(C)[C@H]1CCN(C2CC(c3ccccc3)C2)C1 -
(5S)-2-((4R)-4-hydroxy-1-(3-methyl-2-(1-methyl-1H-1,2,3-triazol-4-yl)butanoyl)pyrrolidin-2-yl)-5-methyl-5-(4-(4-methylthiazol-5-yl)phenyl)-1,5-dihydro-4H-imidazol-4-one PubChem CID 142572548
Cc1ncsc1-c1ccc([C@]2(C)N=C(C3C[C@@H](O)CN3C(=O)C(c3cn(C)nn3)C(C)C)NC2=O)cc1 -
(endo)-2-((5-(2-fluoro-5-methylphenyl)-2,3- dihydro-1H-indol-1-yl)carbonyl)-7- azabicyclo[2.2.1]heptane-7-carbonitrile PubChem CID 167339639
Cc1ccc(F)c(-c2ccc3c(c2)CCN3C(=O)C2CC3CCC2N3C#N)c1 -
methyl (trans-4-{4-[4-(5-fluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-3,6-dihydropyridin-1(2H)-yl}cyclohexyl)acetate PubChem CID 90414211
COC(=O)CC1CCC(N2CC=C(c3cc4c(-c5cc(F)ccc5OC)ccnc4[nH]3)CC2)CC1 -
trans-4-{4-[5-fluoro-4-(5-fluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-3,6-dihydropyridin-1(2H)-yl})cyclohexanecarboxylic acid CAS 1628314-13-5 PubChem CID 90419627
COc1ccc(F)cc1-c1c(F)cnc2[nH]c(C3=CCN(C4CCC(C(=O)O)CC4)CC3)cc12 -
(trans-4-{4-[5-fluoro-4-(5-fluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]piperidin-1-yl}cyclohexyl)acetic acid PubChem CID 90419725
COc1ccc(F)cc1-c1c(F)cnc2[nH]c(C3CCN(C4CCC(CC(=O)O)CC4)CC3)cc12 -
2-((1R,4R)-4-(4-((2-(azepan-1-yl)-5-oxo- 5,6-dihydropyrimido[4,5-d]pyridazin-4- yl)amino)phenyl)cyclohexyl)acetic acid PubChem CID 138375478
O=C(O)CC1CCC(c2ccc(NC3NC(N4CCCCCC4)NC4CNNC(=O)C43)cc2)CC1 -
(E)-3-(4-(((1-(3''- Cyano-5''-(3- hydroxy-4- methoxyphenyl)- 6- (trifluoromethyl)- [3,4''-bipyridin]- 2''-yl)piperidin-4- yl)amino)methyl) phenyl)-N- hydroxyacrylamide formate PubChem CID 176296098
COc1ccc(-c2cnc(N3CCC(NCc4ccc(/C=C/C(=O)NO)cc4)CC3)c(C#N)c2-c2ccc(C#N)nc2)cc1O -
[1-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]-2-(3,5-dichloro-1-oxido-pyridin-1-ium-4-yl)ethyl]5-[[[2-[(1-methyl-4-piperidyl)methoxy]-2-oxo-1-phenyl-ethyl]amino]methyl]thiophene-2-carboxylate PubChem CID 124107929
COc1ccc(C(Cc2c(Cl)c[n+]([O-])cc2Cl)OC(=O)c2ccc(CNC(C(=O)OCC3CCN(C)CC3)c3ccccc3)s2)cc1OCC1CC1 -
8-Methyl-2-[4-(1-pyrimidin-2-ylethyl)piperazin-1-yl]-3,5,6,7-tetrahydropyrido[2,3-d]pyrimidin-4-one, Isomer 1 PubChem CID 138374297
CC(c1ncccn1)N1CCN(C2NC(=O)C3CCCN(C)C3N2)CC1 -
8-Methyl-2-[4-(1-pyrimidin-2-ylpropyl)piperazin-1-yl]-3,5,6,7-tetrahydropyrido[2,3-d]pyrimidin-4-one, Isomer 1 PubChem CID 138374298
CCC(c1ncccn1)N1CCN(C2NC(=O)C3CCCN(C)C3N2)CC1