Name: GS-9851
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT212001416
Cas No:1190307-88-0;1064684-44-1;1190308-01-0
常用名:GS-9851
别名:PSI-7851, PSI7851, PSI 7851, GS9851, GS 9851
别名:PSI-7851, PSI7851, PSI 7851, GS9851, GS 9851
IUPAC:propan-2-yl (2S)-2-[({[(2R,3R,4R,5R)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-4-fluoro-3-hydroxy-4-methyloxolan-2-yl]methoxy}(phenoxy)phosphoryl)amino]propanoate
IUPAC:propan-2-yl (2S)-2-[({[(2R,3R,4R,5R)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-4-fluoro-3-hydroxy-4-methyloxolan-2-yl]methoxy}(phenoxy)phosphoryl)amino]propanoate
InChI key:TTZHDVOVKQGIBA-IAAJYNJHSA-N

分子式:C22H29FN3O9P
分子量:529.458
氢键供体数 (HBD):3
氢键受体数 (HBA):6
LogP:1.2836041
SMILES:CC(C)OC(=O)[C@H](C)NP(=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](C)(F)[C@@H]1O)Oc1ccccc1
SMILES:CC(C)OC(=O)[C@H](C)NP(=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](C)(F)[C@@H]1O)Oc1ccccc1

GS-9851, a HCV nonstructural protein 5B (NS5B) inhibitor, is used potentially for the treatment of HCV infection.

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