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。
-
3-Amino-6-(5-(1,1-difluoro-2,3- dihydroxypropan-2-yl)-2-methylphenyl)-N- (4-hydroxybicyclo[2.2.1]heptan-1- yl)pyrazine-2-carboxamide, trifluoroacetate salt (single enantiomer) PubChem CID 139465741
Cc1ccc(C(O)(CO)C(F)F)cc1-c1cnc(N)c(C(=O)NC23CCC(O)(CC2)C3)n1 -
N-(4-(4,4-Difluoropiperidin-1-yl)-6-fluoropyridin-3-yl)-2-phenylimidazo[1,2-b]pyridazine-8-carboxamide PubChem CID 139465948
O=C(Nc1cnc(F)cc1N1CCC(F)(F)CC1)c1ccnn2cc(-c3ccccc3)nc12 -
(2S)-1-((2S,4R)-4-hydroxy-2-(5-methyl-5-(4-(4-methylthiazol-5-yl)phenyl)-4,5-dihydro-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl)-3-methyl-2-(3-methylisoxazol-5-yl)butan-1-one PubChem CID 142572399
Cc1cc([C@@H](C(=O)N2C[C@H](O)C[C@H]2C2=NC(C)(c3ccc(-c4scnc4C)cc3)ON2)C(C)C)on1 -
(2R)-1-((2S,4R)-4-hydroxy-2-(5-methyl-5-(4-(4-methylthiazol-5-yl)phenyl)-4,5-dihydro-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl)-3-methyl-2-(3-methylisoxazol-5-yl)butan-1-one PubChem CID 142572686
Cc1cc([C@H](C(=O)N2C[C@H](O)C[C@H]2C2=NC(C)(c3ccc(-c4scnc4C)cc3)ON2)C(C)C)on1 -
N-((2S)-1-((4R)-2-(5-(4-Bromophenyl)-5-methyl-4-oxo-4,5-dihydro-1H-imidazol-2-yl)-4-hydroxypyrrolidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl)acetamide (2 Single Stereoisomers) PubChem CID 142572725
CC(=O)N[C@H](C(=O)N1C[C@H](O)CC1C1=NC(C)(c2ccc(B3OC(C)(C)C(C)(C)O3)cc2)C(=O)N1)C(C)(C)C -
CCc1c2c(nn1C)CCCN(CC(F)F)CCn1c(C(=O)O)c(CCCOc3cccc4cc(F)ccc34)c3ccc(Cl)c-2c31 -
CCc1c2c(nn1C)CN(CC(F)(F)F)CCCCn1c(C(=O)O)c(CCCOc3cccc4cc(F)ccc34)c3ccc(Cl)c-2c31 -
N-((S)-1-(((S)-4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl)amino)-4-methyl-1-oxopentan-2-yl)-4-methoxybenzamide PubChem CID 146222490
COc1ccc(C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)C(=O)NC2CC2)cc1 -
N—((S)-4-fluorobicyclo[4.2.0]octa-1(6),2,4-trien-7-yl)-N'-hydroxy-4-(((1S,3r)-1-imino-1-oxido-1lambda6-thietan-3-yl)amino)-1,2,5-oxadiazole-3-carboximidamide PubChem CID 146474042
N=S1(=O)CC(Nc2nonc2C(=N[C@H]2Cc3ccc(F)cc32)NO)C1 -
COCCn1c(CN2CCC(c3cccc4c3OC(c3ccc(Cl)cc3F)O4)CC2)nc2ccc(C(=O)O)cc21 -
1-(4-(1H-pyrazol-4- yl)phenyl)-4-benzyl- 3-(1-hydroxyethyl)- 1H-1,2,4-triazol- 5(4H)-one (nantiomer 1) PubChem CID 154826678
CC(O)c1nn(-c2ccc(C3CNNC3)cc2)c(=O)n1Cc1ccccc1 -
CNc1ncc2cc(-c3cc(NC(=O)N4CC[C@H](CC(F)(F)F)C4)c(F)cc3C)cnc2n1 -
(S)-1-(3-(4-(2-((1- (Methylsulfonyl) piperidin-4-yl) amino)-5- (trifluoromethyl) pyrimidin-4-yl)-1H- imidazol-1-yl)-2- (trifluoromethyl) benzyl)pyrrolidine-3- carbonitrile PubChem CID 156066376
CS(=O)(=O)N1CCC(Nc2ncc(C(F)(F)F)c(-c3cn(-c4cccc(CN5CC[C@H](C#N)C5)c4C(F)(F)F)cn3)n2)CC1 -
(S)-6-Chloro-4-(4-(2-chloroacetyl)-2-methylpiperazin-1-yl)-7-(2-fluorophenyl)-1-(2-isopropyl-4-methylpyridin-3-yl)pyrido[2,3-d]pyrimidin-2(1H)-one PubChem CID 156296403
Cc1ccnc(C(C)C)c1-n1c(=O)nc(N2CCN(C(=O)CCl)C[C@@H]2C)c2cc(Cl)c(-c3ccccc3F)nc21 -
N-(trans-3-{2-[4-(2,3-dichlorophenyl)piperazin-1-yl]ethyl}cyclobutyl)-1,3-oxazole-2-carboxamide CAS 2640663-79-0 PubChem CID 156316465
O=C(NC1CC(CCN2CCN(c3cccc(Cl)c3Cl)CC2)C1)c1ncco1 -
Isopropyl 2-((2R,5S)-4-(6-cyano-1-methyl-2-oxo-1,2-dihydro-1,5-naphthyridin-4-yl)-2,5-dimethylpiperazin-1-yl)-2-(4-fluorophenyl)acetate PubChem CID 156538847
CC(C)OC(=O)C(c1ccc(F)cc1)N1C[C@H](C)N(c2cc(=O)n(C)c3ccc(C#N)nc23)C[C@H]1C -
4-((2S,5R)-2,5-diethyl-4-(2-morpholino-2-oxo-1-(4-(trifluoromethyl)phenyl)ethyl)piperazin-1-yl)-1-methyl-2-oxo-1,2-dihydropyrido[3,2-d]pyrimidine-6-carbonitrile PubChem CID 156555625
CC[C@H]1CN(C(C(=O)N2CCOCC2)c2ccc(C(F)(F)F)cc2)[C@H](CC)CN1c1nc(=O)n(C)c2ccc(C#N)nc12 -
1-(4-(((2-((4-((2S,6R)-2,6- dimethylmorpholino)phenyl)amino)- 5-fluoropyrimidin-4- yl)oxy)methyl)-3-fluoropiperidin- 1-yl)ethan-1-one (1st eluting peak) PubChem CID 165385727
CC(=O)N1CCC(COc2nc(Nc3ccc(N4C[C@@H](C)O[C@@H](C)C4)cc3)ncc2F)C(F)C1 -
1-(3-fluoro-4-(((5-fluoro-2-((4- morpholinophenyl)amino)pyrimidin- 4-yl)oxy)methyl)piperidin-1- yl)ethan-1-one (1st eluting peak) PubChem CID 165385758
CC(=O)N1CCC(COc2nc(Nc3ccc(N4CCOCC4)cc3)ncc2F)C(F)C1 -
1-(6-(4-(5-Chloro-6-methyl-1H-indazol-4-yl)-5-methyl-3-(8-(tetrahydro-2H-pyran-4-yl)-5,8-diazaspiro[3.5]nonan-5-yl)-1H-pyrazol-1-yl)-2-azaspiro[3.3]heptan-2-yl)prop-2-en-1-one PubChem CID 166542886
C=CC(=O)N1CC2(CC(n3nc(N4CCN(C5CCOCC5)CC45CCC5)c(-c4c(Cl)c(C)cc5[nH]ncc45)c3C)C2)C1