Name: GNE-207
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212670233
Cas No:2158266-58-9
常用名:GNE-207
IUPAC:5-{8-[5-acetyl-1-(oxan-4-yl)-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridin-3-yl]isoquinolin-3-yl}-N-methylpyridine-2-carboxamide
IUPAC:5-{8-[5-acetyl-1-(oxan-4-yl)-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridin-3-yl]isoquinolin-3-yl}-N-methylpyridine-2-carboxamide
InChI key:MUJXZEDIWKGKQD-UHFFFAOYSA-N

分子式:C29H30N6O3
分子量:510.598
氢键供体数 (HBD):1
氢键受体数 (HBA):6
LogP:1.3422213
SMILES:CNC(=O)c1ccc(cn1)-c1cc2cccc(-c3nn(C4CCOCC4)c4CCN(Cc34)C(C)=O)c2cn1
SMILES:CNC(=O)c1ccc(cn1)-c1cc2cccc(-c3nn(C4CCOCC4)c4CCN(Cc34)C(C)=O)c2cn1

GNE-207 is a selective and orally bioavailable inhibitor of the bromodomain of CBP (IC50: 1 nM). It has a selective index of >2500-fold against BRD4 (1). GNE-207 displays excellent CBP potency (EC50: 18 nM for MYC expression in MV-4-11 cells).

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