RET-IN-9
HIT214432897
sdf文件结构编辑类似物检索
HIT ID: HIT214432897
Cas No: 2649418-11-9
分子式: C26H27N9O
分子量: 481.564
常用名: RET-IN-9
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 6-(ethylamino)-4-(5-{6-[(6-methoxypyridin-3-yl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl}pyrazin-2-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile
IUPAC: 6-(ethylamino)-4-(5-{6-[(6-methoxypyridin-3-yl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl}pyrazin-2-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile
SMILES: CCNc1cc(-c2cnc(cn2)N2CC3CC(C2)N3Cc2ccc(OC)nc2)c2c(cnn2c1)C#N
SMILES: CCNc1cc(-c2cnc(cn2)N2CC3CC(C2)N3Cc2ccc(OC)nc2)c2c(cnn2c1)C#N
InChI key: RKEAFVWCUHIUGH-UHFFFAOYSA-N
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