HIT ID: HIT212650419
Cas No: 212779-48-1
分子式: C16H19ClN6O
分子量: 346.82
常用名: NG 52
氢键受体数 (HBA): 6
氢键供体数 (HBD): 3
LogP: 2.8004048
IUPAC: 2-({6-[(3-chlorophenyl)amino]-9-(propan-2-yl)-9H-purin-2-yl}amino)ethan-1-ol
IUPAC: 2-({6-[(3-chlorophenyl)amino]-9-(propan-2-yl)-9H-purin-2-yl}amino)ethan-1-ol
SMILES: CC(C)n1cnc2c(Nc3cccc(Cl)c3)nc(NCCO)nc12
SMILES: CC(C)n1cnc2c(Nc3cccc(Cl)c3)nc(NCCO)nc12
InChI key: XZEFMZCNXDQXOZ-UHFFFAOYSA-N
