Name: AG311
Rating: 5 (10 reviews)

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sdf 文件

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HIT ID:HIT212712012
Cas No:1126602-42-3
常用名:AG311
别名:AG-311, AG 311
IUPAC:5-[(4-methylphenyl)sulfanyl]-9H-pyrimido[4,5-b]indole-2,4-diamine
IUPAC:5-[(4-methylphenyl)sulfanyl]-9H-pyrimido[4,5-b]indole-2,4-diamine
InChI key:IMNBYLUXBBXZIY-UHFFFAOYSA-N

分子式:C17H15N5S
分子量:321.4
氢键供体数 (HBD):3
氢键受体数 (HBA):4
LogP:3.8523998
SMILES:Cc1ccc(Sc2cccc3[nH]c4nc(N)nc(N)c4c23)cc1
SMILES:Cc1ccc(Sc2cccc3[nH]c4nc(N)nc(N)c4c23)cc1

AG311 is an inhibitor of complex I and hypoxia-induced HIF-1α stabilization. In vitro, AG311 induces rapid necrosis in numerous cancer cell lines. Within minutes, exposure to AG311 also results in mitochondrial depolarization, superoxide production, and increased intracellular calcium levels.

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