3-{3-bromo-4-[(2,4-difluorophenyl)methoxy]-6-methyl-2-oxopyridin-1-yl}-N-[4-(1-{3-[(4-{[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino}butyl)carbamoyl]propyl}-1,2,3-triazol-4-yl)butyl]-4-methylbenzamide, NR-7h
HIT218832998
sdf文件结构编辑类似物检索
HIT ID: HIT218832998
Cas No:
分子式: C48H50BrF2N9O8
分子量: 998.884
常用名: 3-{3-bromo-4-[(2,4-difluorophenyl)methoxy]-6-methyl-2-oxopyridin-1-yl}-N-[4-(1-{3-[(4-{[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino}butyl)carbamoyl]propyl}-1,2,3-triazol-4-yl)butyl]-4-methylbenzamide, NR-7h
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 3-{3-bromo-4-[(2,4-difluorophenyl)methoxy]-6-methyl-2-oxo-1,2-dihydropyridin-1-yl}-N-[4-(1-{3-[(4-{[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl]amino}butyl)carbamoyl]propyl}-1H-1,2,3-triazol-4-yl)butyl]-4-methylbenzamide
SMILES: Cc1ccc(cc1-n1c(C)cc(OCc2ccc(F)cc2F)c(Br)c1=O)C(=O)NCCCCc1cn(CCCC(=O)NCCCCNc2cccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c23)nn1
InChI key: BEMLUUUHZPFCBS-UHFFFAOYSA-N
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