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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N#Cc1cncc2c1OCCN(C(=O)[C@@H]1CCN(c3ccnc4c(F)cnn34)C[C@H]1F)C2 -
2-butyl-1-(2,6- diethylphenyl)-6-hydroxy- 5-{[(1r,4r)-4- (benzyloxy)cyclohexyl] sulfonyl}-1,4- dihydropyrimidin-4-one PubChem CID 137251343
CCCCc1nc(O)c(S(=O)(=O)C2CCC(OCc3ccccc3)CC2)c(=O)n1-c1c(CC)cccc1CC -
(R)-4-(4-(aminomethyl)piperidin-1-yl)-N1-(pyrrolidin-3-yl)-3-(2H-tetrazol-5-yl)benzene-1,2-disulfonamide dihydrochloride PubChem CID 137424796
NCC1CCN(c2ccc(S(=O)(=O)N[C@@H]3CCNC3)c(S(N)(=O)=O)c2-c2nn[nH]n2)CC1 -
8-(2-amino-6-((R)- 2,2,2-trifluoro-1-(3'- methoxy-[1,1'- biphenyl]-4- yl)ethoxy)pyrimidine-4- yl)-2-azaspiro[4.5]dec- 7-ene-3-carboxylic acid hydrochloride PubChem CID 137531876
COc1cccc(-c2ccc([C@@H](Oc3cc(C4=CCC5(CC4)CNC(C(=O)O)C5)nc(N)n3)C(F)(F)F)cc2)c1 -
Tert-butyl 4-[2-cyano-4-[6-[[6-methoxy-5-(4-methylpiperazin-1-yl)pyridin-2-yl]amino]pyrimidin-4-yl]phenoxy]-3,3-difluoropiperidine-1-carboxylate PubChem CID 138571189
COc1nc(Nc2cc(-c3ccc(OC4CCN(C(=O)OC(C)(C)C)CC4(F)F)c(C#N)c3)ncn2)ccc1N1CCN(C)CC1 -
2-butyl-1-(2,6- dimethoxyphenyl)-6- hydroxy-5-{[(1r,4r)-4- (benzyloxy)cyclohexyl] sulfonyl}-1,4- dihydropyrimidin-4-one PubChem CID 138697813
CCCCc1nc(O)c(S(=O)(=O)C2CCC(OCc3ccccc3)CC2)c(=O)n1-c1c(OC)cccc1OC -
2-butyl-1-(2,6- dimethoxyphenyl)-6- hydroxy-5-{[(1r,4r)-4- hydroxycyclohexyl]sulfonyl}- 1,4-dihydropyrimidin-4- one PubChem CID 138698192
CCCCc1nc(O)c(S(=O)(=O)C2CCC(O)CC2)c(=O)n1-c1c(OC)cccc1OC -
N-(1-(trans-5-((4-(3-oxa-8- azabicyclo[3.2.1]octan-8-yl)-3- (trifluoromethyl)benzyl)(methyl)amino) octahydrocyclopenta[c]pyrrole-2- carbonyl)-1H-pyrazol-4-yl)-N- methylacetamide PubChem CID 138716572
CC(=O)N(C)c1cnn(C(=O)N2C[C@H]3CC(N(C)Cc4ccc(N5C6CCC5COC6)c(C(F)(F)F)c4)C[C@H]3C2)c1 -
N-(1-(trans-5-((4- chlorobenzyl)(methyl)amino) octahydrocyclopenta[c]pyrrole-2- carbonyl)-1H-pyrazol-4-yl)-N- methylacetamide PubChem CID 138716802
CC(=O)N(C)c1cnn(C(=O)N2C[C@H]3CC(N(C)Cc4ccc(Cl)cc4)C[C@H]3C2)c1 -
Isomer A and B of N-((3R,4S)-1-(2-amino-3,3,3-trifluoro-2-methylpropanoyl)-4-fluoropyrrolidin-3-yl)-5-(4-amino-5-(trifluoromethyl)pyrrolo[2,1-f][1,2,4]triazin-7-yl)-2-methoxynicotinamide PubChem CID 139348687
COc1ncc(-c2cc(C(F)(F)F)c3c(N)ncnn23)cc1C(=O)N[C@@H]1CN(C(=O)C(C)(N)C(F)(F)F)C[C@@H]1F -
5-{4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl}-N- [(3R,4S)-4-fluoro-1-[(2R)-3,3,3-trifluoro-2- hydroxy-2-methylpropanoyl]pyrrolidin-3-yl]-2- methoxypyridine-3-carboxamide PubChem CID 139348783
COc1ncc(-c2ccc3c(N)ncnn23)cc1C(=O)N[C@@H]1CN(C(=O)[C@@](C)(O)C(F)(F)F)C[C@@H]1F -
(unassigned diastereomers) (5-(4-amino-5-(trifluoromethyl)pyrrolo[2,1-f][1,2,4]triazin-7-yl)-2-methoxypyridin-3-yl)(3-((4-fluorophenyl)(hydroxy)methyl)piperidin-1-yl)methanone PubChem CID 139349025
COc1ncc(-c2cc(C(F)(F)F)c3c(N)ncnn23)cc1C(=O)N1CCCC(C(O)c2ccc(F)cc2)C1 -
(unassigned diastereomers) (5-(4-amino-5-(trifluoromethyl)pyrrolo[2,1-f][1,2,4]triazin-7-yl)-2-methylpyridin-3-yl)(3-((4-fluorophenyl)(hydroxy)methyl)piperidin-1-yl)methanone PubChem CID 139349096
Cc1ncc(-c2cc(C(F)(F)F)c3c(N)ncnn23)cc1C(=O)N1CCCC(C(O)c2ccc(F)cc2)C1 -
(unassigned diastereomers) (5-(4-amino-5-(trifluoromethyl)pyrrolo[2,1-f][1,2,4]triazin-7-yl)-2-methylpyridin-3-yl)(3-((4-fluorophenyl)(hydroxy)methyl)-3-hydroxypiperidin-1-yl)methanone PubChem CID 139349194
Cc1ncc(-c2cc(C(F)(F)F)c3c(N)ncnn23)cc1C(=O)N1CCCC(O)(C(O)c2ccc(F)cc2)C1 -
(2S,4S)-1-[(2R)-3-cyclohexyl-2-[[4-(difluoromethylsulfonyl)benzoyl]amino]propanoyl]-4-[5-(2-hydroxypropan-2-yl)triazol-1-yl]-N-(4-oxamoylthian-4-yl)pyrrolidine-2-carboxamide PubChem CID 141725530
CC(C)(O)c1cnnn1[C@H]1C[C@@H](C(=O)NC2(C(=O)C(N)=O)CCSCC2)N(C(=O)[C@@H](CC2CCCCC2)NC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)C1 -
N-[2-[[5-chloro-2-[2-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]anilino]pyrimidin-4-yl]amino]phenyl]methanesulfonamide CAS 2254805-44-0 PubChem CID 142497307
COc1cc(N2CCC(N3CCN(C)CC3)CC2)ccc1Nc1ncc(Cl)c(Nc2ccccc2NS(C)(=O)=O)n1 -
(5S)-2-((4R)-4-hydroxy-1-((S)-1-(methylsulfonyl)piperidine-2-carbonyl)pyrrolidin-2-yl)-5-methyl-5-(4-(4-methylthiazol-5-yl)phenyl)-1,5-dihydro-4H-imidazol-4-one PubChem CID 142572827
Cc1ncsc1-c1ccc([C@]2(C)N=C(C3C[C@@H](O)CN3C(=O)[C@@H]3CCCCN3S(C)(=O)=O)NC2=O)cc1 -
2-(((3R,4S)-3-fluoro-1-((R)-pyrrolidine-2-carbonyl)piperidin-4-yl)oxy)-5-(4-((4-(4-(oxetan-3-yl)piperazin-1-yl)phenyl)amino)-1,3,5-triazin-2-yl)benzonitrile PubChem CID 145866267
N#Cc1cc(-c2ncnc(Nc3ccc(N4CCN(C5COC5)CC4)cc3)n2)ccc1O[C@H]1CCC(C(=O)C2CCCN2)C[C@H]1F -
(R or S)-methyl 4- (cyanomethyl)-4-(4-oxo-3- ((4-(1,1,1-trifluoro-2- hydroxypropan-2-yl) phenyl)amino)-4,5-dihydro- 1H-pyrazolo[4,3-c]pyridin- 1-yl)piperidine-1- carboxylate (from I-32A) PubChem CID 146011853
COC(=O)N1CCC(CC#N)(N2NC(Nc3ccc(C(C)(O)C(F)(F)F)cc3)C3C(=O)NCCC32)CC1 -
CC(C)OC(=O)C(C)(C)C(O)(c1ccc(NC2NN([C@]3(CC#N)CC[C@@H](C(=O)OC(C)(C)C)OC3)C3CCNC(=O)C23)cc1)C(F)(F)F