GNE0877
HIT212651203
sdf文件结构编辑类似物检索
HIT ID: HIT212651203
Cas No: 1374828-69-9
分子式: C14H16F3N7
分子量: 339.326
常用名: GNE0877
氢键受体数 (HBA): 6
氢键供体数 (HBD): 2
LogP: 2.210224
IUPAC: 2-methyl-2-(3-methyl-4-{[4-(methylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino}-1H-pyrazol-1-yl)propanenitrile
IUPAC: 2-methyl-2-(3-methyl-4-{[4-(methylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino}-1H-pyrazol-1-yl)propanenitrile
SMILES: CNc1nc(Nc2cn(nc2C)C(C)(C)C#N)ncc1C(F)(F)F
SMILES: CNc1nc(Nc2cn(nc2C)C(C)(C)C#N)ncc1C(F)(F)F
InChI key: ZPPUMAMZIMPJGP-UHFFFAOYSA-N
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