RD-23
HIT219250874
sdf文件结构编辑类似物检索
HIT ID: HIT219250874
Cas No: 3053537-06-4
分子式: C52H56N12O4
分子量: 913.1
常用名: RD-23
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 6-[4-(4-{5-[2-(2,6-dioxopiperidin-3-yl)-1-oxo-2,3-dihydro-1H-isoindol-4-yl]pent-4-yn-1-yl}piperazin-1-yl)piperidin-1-yl]-4-(6-{6-[(6-methoxypyridin-3-yl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl}pyridin-3-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile
IUPAC: 6-[4-(4-{5-[2-(2,6-dioxopiperidin-3-yl)-1-oxo-2,3-dihydro-1H-isoindol-4-yl]pent-4-yn-1-yl}piperazin-1-yl)piperidin-1-yl]-4-(6-{6-[(6-methoxypyridin-3-yl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl}pyridin-3-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile
SMILES: COc1ccc(CN2C3CC2CN(C3)c2ccc(cn2)-c2cc(cn3ncc(C#N)c23)N2CCC(CC2)N2CCN(CCCC#Cc3cccc4C(=O)N(Cc34)C3CCC(=O)NC3=O)CC2)cn1
SMILES: COc1ccc(CN2C3CC2CN(C3)c2ccc(cn2)-c2cc(cn3ncc(C#N)c23)N2CCC(CC2)N2CCN(CCCC#Cc3cccc4C(=O)N(Cc34)C3CCC(=O)NC3=O)CC2)cn1
InChI key: YMWXRYMHVVNQIJ-UHFFFAOYSA-N
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