Name: PI3K-IN-51
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT218848717
Cas No:2055765-77-8
常用名:PI3K-IN-51
IUPAC:4,8-dichloro-3-[(1S)-1-({5-oxo-1H,5H-pyrido[2,3-d]pyrimidin-4-yl}amino)ethyl]-2-phenyl-1,2-dihydroisoquinolin-1-one
IUPAC:4,8-dichloro-3-[(1S)-1-({5-oxo-1H,5H-pyrido[2,3-d]pyrimidin-4-yl}amino)ethyl]-2-phenyl-1,2-dihydroisoquinolin-1-one
InChI key:HIXUFHUKIOTXLJ-ZDUSSCGKSA-N

分子式:C24H17Cl2N5O2
分子量:478.33
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:C[C@H](Nc1nc[nH]c2nccc(=O)c12)c1c(Cl)c2cccc(Cl)c2c(=O)n1-c1ccccc1
SMILES:C[C@H](Nc1nc[nH]c2nccc(=O)c12)c1c(Cl)c2cccc(Cl)c2c(=O)n1-c1ccccc1

PI3K-IN-51, characterized as a PI3K inhibitor, exhibits IC50 values below 500 nM for p120γ and p110δ/p85α (WO2016204429A1; Example 10) [1].

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