Name: PARP14 inhibitor H10
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212666414
Cas No:2084811-68-5
常用名:PARP14 inhibitor H10
IUPAC:3-({2-[4-(2-{3-[(3-carbamoylphenyl)carbamoyl]propanamido}ethyl)-1H-1,2,3-triazol-1-yl]ethyl}sulfamoyl)benzoic acid
IUPAC:3-({2-[4-(2-{3-[(3-carbamoylphenyl)carbamoyl]propanamido}ethyl)-1H-1,2,3-triazol-1-yl]ethyl}sulfamoyl)benzoic acid
InChI key:MUOMSHSMJCWQFH-UHFFFAOYSA-N

分子式:C24H27N7O7S
分子量:557.58
氢键供体数 (HBD):5
氢键受体数 (HBA):9
LogP:-0.31785473
SMILES:NC(=O)c1cccc(NC(=O)CCC(=O)NCCc2cn(CCNS(=O)(=O)c3cccc(c3)C(O)=O)nn2)c1
SMILES:NC(=O)c1cccc(NC(=O)CCC(=O)NCCc2cn(CCNS(=O)(=O)c3cccc(c3)C(O)=O)nn2)c1

PARP14 inhibitor H10 is a selective inhibitor against PARP14 with IC50 of 490 nM

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