ER-851
HIT218887510
sdf文件结构编辑类似物检索
HIT ID: HIT218887510
Cas No: 2685738-33-2
分子式: C36H41FN8O4
分子量: 668.774
常用名: ER-851
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
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
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
InChI key: SAIJSXPUPZBTMI-UHFFFAOYSA-N
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