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基于 PubChem CID 索引,支持名称 / 同义词 / CAS / SMILES 检索。
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3-[1-(2-Fluoro-6-methyl-phenyl)-piperidin-4-yl]-1-(2-trifluoromethyl-benzyl)-3,4-dihydro-1H-quinazolin-2-one PubChem CID 139330311
Cc1cccc(F)c1N1CCC(N2Cc3ccccc3N(Cc3ccccc3C(F)(F)F)C2=O)CC1 -
4-oxo-6-(2-(3- (trifluoromethyl)- 1H-pyrazol-1- yl)cyclobutyl)-1- ((S)-1-(6- (trifluoromethyl) pyridin-3-yl)ethyl)- 4,5-dihydro-1H- pyrazolo[3,4- d]pyrimidine-3- carbonitrile PubChem CID 153608129
C[C@@H](c1ccc(C(F)(F)F)nc1)n1nc(C#N)c2c(=O)[nH]c(C3CCC3n3ccc(C(F)(F)F)n3)nc21 -
(+)-6-[(1R)-1-[4-(5-methyl-1,3,4-oxadiazol-2-yl)-1-piperidyl]ethyl]-2,3-dihydrofuro[2,3-b]pyridine PubChem CID 156135200
Cc1nnc(C2CCN(C(C)c3ccc4c(n3)OCC4)CC2)o1 -
9-(4-((1-(3-fluoropropyl)azetidin-3- ylidene)methyl)phenyl)-8-(spiro[2.3]hexan-1- yl)-6,7-dihydro-5H-benzo[7]annulene-3- carboxylic acid, Isomer 1 PubChem CID 163263072
O=C(O)c1ccc2c(c1)CCCC(C1CC13CCC3)=C2c1ccc(C=C2CN(CCCF)C2)cc1 -
1-((R)-1-(4-(5-oxa-1-azaspiro[2.3]hexan-1-yl)cyclohexyl)ethyl)-2-methyl-N-((6-methyl-4-(methylthio)-2-oxo-1,2-dihydropyridin-3-yl)methyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide PubChem CID 166177814
CSC1=CC(C)=NC(=O)C1CNC(=O)c1c(C)n([C@H](C)C2CCC(N3CC34COC4)CC2)c2ncccc12 -
Single Diastereomer 1 of (1S,2S)-2-((6-(4-(((1-(2-fluoropyridin-3-yl)ethoxy) carbonyl)amino)-3-methylisoxazol-5-yl)pyridin-3-yl)carbamoyl)cyclohexane-1-carboxylic acid PubChem CID 168158099
Cc1noc(-c2ccc(NC(=O)[C@H]3CCCC[C@@H]3C(=O)O)cn2)c1NC(=O)OC(C)c1cccnc1F -
Single Diastereomer 1 of Cis-2-((6-(4-((((R)-1-(2-chlorophenyl) ethoxy)carbonyl)amino)-3-methylisoxazol-5-yl)-2-methylpyridin-3-yl)carbamoyl) cyclohexane-1-carboxylic acid PubChem CID 169756997
Cc1nc(-c2onc(C)c2NC(=O)O[C@H](C)c2ccccc2Cl)ccc1NC(=O)C1CCCCC1C(=O)O -
1-(2-(4-(9- benzyl-6-(1- methylcyclo- propoxy)- 9H-purin-8- yl)-3- chlorophenoxy) ethyl)-3- methylpiperazin- 2-one (Isomer 2) PubChem CID 171791335
CC1NCCN(CCOc2ccc(-c3nc4c(OC5(C)CC5)ncnc4n3Cc3ccccc3)c(Cl)c2)C1=O -
1-benzyl-2-(2- chloro-4-(2-(1- methylpyrrolidin-2- yl)ethoxy)phenyl)- 5-isopropoxy- 1H- benzo[d]imidazole (Isomer 2) PubChem CID 171791391
CC(C)Oc1ccc2c(c1)nc(-c1ccc(OCCC3CCCN3C)cc1Cl)n2Cc1ccccc1 -
9-benzyl-8-(2- chloro-4-(2-(1- methyl- pyrrolidin-2-yl) ethoxy)phenyl)- 6-(1-methyl- cyclopropoxy)- 9H-purine (Isomer 1) PubChem CID 172486002
CN1CCCC1CCOc1cc(Cl)c(-c2nc3c(OC4(C)CC4)ncnc3n2Cc2ccccc2)cn1 -
5-amino-1-(1-cyanopiperidin-3-yl)-3-(4-phenoxyphenyl)-1H-pyrazole carboxamide PubChem CID 90118971
N#CN1CCCC(n2nc(-c3ccc(Oc4ccccc4)cc3)c(C(N)=O)c2N)C1 -
rac-(E)-1-(3-Fluoropiperidin-1-yl)-3-(2-((5-methyl-2H-tetrazol-2-yl)methyl)-4-(trifluoromethyl)phenyl)prop-2-en-1-one PubChem CID 90646976
Cc1nnn(Cc2cc(C(F)(F)F)ccc2/C=C/C(=O)N2CCCC(F)C2)n1 -
Ethyl 2-[5-[4-(aminomethyl)-6-(trifluoromethyl)pyridin-2-yl]oxy-2-oxo-3,4-dihydroquinolin-1-yl]acetate PubChem CID 122536418
CCOC(=O)CN1C(=O)CCc2c(Oc3cc(CN)cc(C(F)(F)F)n3)cccc21 -
(1R,2R)-N-(4-(2,6-dimethoxyphenyl)-5-(6-methoxypyridin-2-yl)-4H-1,2,4-triazol-3-yl)-1-(3-methoxyazetidin-1-yl)-1-(5-methylpyrimidin-2-yl)propane-2-sulfonamide PubChem CID 122701499
COc1cccc(-c2nnc(NS(=O)(=O)[C@@H](C)[C@H](c3ncc(C)cn3)N3CC(OC)C3)n2-c2c(OC)cccc2OC)n1 -
2-(1-((4- carboxyphenyl)amino)-3- (2,3-dimethylcyclopropyl)- 1-oxopropan-2-yl)-5-(3- chloro-6-(difluoromethoxy)- 2-fluorophenyl)pyridine 1- oxide PubChem CID 134262025
CC1C(C)C1CC(C(=O)Nc1ccc(C(=O)O)cc1)c1ccc(-c2c(OC(F)F)ccc(Cl)c2F)c[n+]1[O-] -
CN1CCc2c(nc(C(=O)Nc3cccc(-c4cccc(NC(=O)c5nc6c(n5C)CCN(CCC5CCC(C(=O)O)CC5)C6)c4Cl)c3Cl)n2C)C1 -
2-(2- chloropyridin-3- yl)-1-(7-fluoro- 5-(2-((3- hydroxylcyclobutyl) amino)pyridin-4- yl)indolin-1-yl) ethan-1-one PubChem CID 138514300
O=C(Cc1cccnc1Cl)N1CCc2cc(-c3ccnc(NC4CC(O)C4)c3)cc(F)c21 -
(rac)-12-ethyl-13-fluoro-1-(3-((6-fluoronaphthalen-1-yl)oxy)propyl)-10-methyl-4,5,6,7,9,10-hexahydropyrazolo[4',3':9,10][1]oxa[6]azacycloundecino[8,7,6-hi]indole-2-carboxylic acid PubChem CID 142591530
CCc1nn(C)c2c1-c1c(F)ccc3c(CCCOc4cccc5cc(F)ccc45)c(C(=O)O)n(c13)CCCCOC2 -
(rac)-13-fluoro-1-(3-((6-fluoronaphthalen-1-yl)oxy)propyl)-11,12-dimethyl-4,5,6,7,9,11-hexahydropyrazolo[4',3':9,10][1]oxa[6]azacycloundecino[8,7,6-hi]indole-2-carboxylic acid PubChem CID 142591554
Cc1c2c(nn1C)COCCCCn1c(C(=O)O)c(CCCOc3cccc4cc(F)ccc34)c3ccc(F)c-2c31 -
racemic, trans-2-(4-(3-(5-amino-9-fluoro-8-methoxy-[1,2,4]triazolo[1,5-c] quinazolin-2-yl)-5-methylpiperidin-1-yl)-1H-pyrazol-1-yl)-2-methylpropan-1-ol PubChem CID 146650495
COc1cc2nc(N)n3nc(C4CC(C)CN(c5cnn(C(C)(C)CO)c5)C4)nc3c2cc1F