Name: Aloisine A
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212674177
Cas No:496864-16-5
常用名:Aloisine A
IUPAC:4-{7-butyl-5H-pyrrolo[2,3-b]pyrazin-6-yl}phenol
IUPAC:4-{7-butyl-5H-pyrrolo[2,3-b]pyrazin-6-yl}phenol
InChI key:PRIGRJPRGZCFAS-UHFFFAOYSA-N

分子式:C16H17N3O
分子量:267.332
氢键供体数 (HBD):2
氢键受体数 (HBA):3
LogP:3.834
SMILES:CCCCc1c([nH]c2nccnc12)-c1ccc(O)cc1
SMILES:CCCCc1c([nH]c2nccnc12)-c1ccc(O)cc1

Aloisine A is a potent and selective CDK/GSK-3 inhibitor. IC50 data of Aloisine A: Cdk1/cyclin B (IC50: 150nM), Cdk2/cyclin A (IC50: 120nM), Cdk2/cyclin E (IC50: 400nM), Cdk5/p25 (IC50: 200nM), Cdk5/p35 (IC50: 160nM), GSK-3α (IC50: 500nM), GSK-3β (IC50: 650nM), JNK (IC50~3-10μM).

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