Name: HER2-IN-6
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT214433547
Cas No:2691891-38-8
常用名:HER2-IN-6
IUPAC:4-amino-N-{4-[(dimethylcarbamoyl)methyl]-2,3-dimethylphenyl}-7-[(3R)-1-(prop-2-enoyl)piperidin-3-yl]imidazo[4,3-f][1,2,4]triazine-5-carboxamide
IUPAC:4-amino-N-{4-[(dimethylcarbamoyl)methyl]-2,3-dimethylphenyl}-7-[(3R)-1-(prop-2-enoyl)piperidin-3-yl]imidazo[4,3-f][1,2,4]triazine-5-carboxamide
InChI key:WWWVHEGCRMRPIM-GOSISDBHSA-N

分子式:C26H32N8O3
分子量:504.595
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CN(C)C(=O)Cc1ccc(NC(=O)c2nc([C@@H]3CCCN(C3)C(=O)C=C)n3ncnc(N)c23)c(C)c1C
SMILES:CN(C)C(=O)Cc1ccc(NC(=O)c2nc([C@@H]3CCCN(C3)C(=O)C=C)n3ncnc(N)c23)c(C)c1C

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