Name: Mutated EGFR-IN-2
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT212666148
Cas No:2050906-97-1
常用名:Mutated EGFR-IN-2
IUPAC:N-(2-{[2-(dimethylamino)ethyl](methyl)amino}-5-({4-[5-fluoro-2-oxo-3-(propan-2-yl)-2,3-dihydro-1H-1,3-benzodiazol-1-yl]pyrimidin-2-yl}amino)-4-methoxyphenyl)prop-2-enamide
IUPAC:N-(2-{[2-(dimethylamino)ethyl](methyl)amino}-5-({4-[5-fluoro-2-oxo-3-(propan-2-yl)-2,3-dihydro-1H-1,3-benzodiazol-1-yl]pyrimidin-2-yl}amino)-4-methoxyphenyl)prop-2-enamide
InChI key:ZISPMWTYPDYENI-UHFFFAOYSA-N

分子式:C29H35FN8O3
分子量:562.65
氢键供体数 (HBD):2
氢键受体数 (HBA):8
LogP:4.562131
SMILES:COc1cc(N(C)CCN(C)C)c(NC(=O)C=C)cc1Nc1nccc(n1)-n1c2ccc(F)cc2n(C(C)C)c1=O
SMILES:COc1cc(N(C)CCN(C)C)c(NC(=O)C=C)cc1Nc1nccc(n1)-n1c2ccc(F)cc2n(C(C)C)c1=O

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