Name: T-448 free base
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212670560
Cas No:1597426-52-2
常用名:T-448 free base
IUPAC:3-[(1S,2R)-2-(cyclobutylamino)cyclopropyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide
IUPAC:3-[(1S,2R)-2-(cyclobutylamino)cyclopropyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide
InChI key:HQRYNOVKRKLADI-LSDHHAIUSA-N

分子式:C17H20N4OS
分子量:328.43
氢键供体数 (HBD):2
氢键受体数 (HBA):4
LogP:2.130325
SMILES:Cc1nnc(NC(=O)c2cccc(c2)[C@@H]2C[C@H]2NC2CCC2)s1
SMILES:Cc1nnc(NC(=O)c2cccc(c2)[C@@H]2C[C@H]2NC2CCC2)s1

T-448 free base is a specific, orally active and irreversible lysine-specific demethylase 1 (LSD1, an H3K4 demethylase) inhibitor(IC50 of 22 nM).

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