Name: ER-851
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT218887510
Cas No:2685738-33-2
常用名:ER-851
IUPAC:1-cyclopentyl-N-[3-fluoro-4-({7-[(1-methylpiperidin-4-yl)methyl]-5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-4-yl}oxy)phenyl]-3-(5-methylpyridin-2-yl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
IUPAC:1-cyclopentyl-N-[3-fluoro-4-({7-[(1-methylpiperidin-4-yl)methyl]-5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-4-yl}oxy)phenyl]-3-(5-methylpyridin-2-yl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
InChI key:SAIJSXPUPZBTMI-UHFFFAOYSA-N

分子式:C36H41FN8O4
分子量:668.774
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CN1CCC(CN2CCc3c(C2)ncnc3Oc2ccc(NC(=O)c3cn(C4CCCC4)c(=O)n(-c4ccc(C)cn4)c3=O)cc2F)CC1
SMILES:CN1CCC(CN2CCc3c(C2)ncnc3Oc2ccc(NC(=O)c3cn(C4CCCC4)c(=O)n(-c4ccc(C)cn4)c3=O)cc2F)CC1

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