HIT ID: HIT101330481
Cas No: 13484-66-7
分子式: C17H20N5O7P
分子量: 437.349
常用名: IST5-002
氢键受体数 (HBA): 12
氢键供体数 (HBD): 5
LogP: -9.460000000000004e-001
IUPAC: {[(2R,3S,4R,5R)-5-[6-(benzylamino)-9H-purin-9-yl]-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid
IUPAC: {[(2R,3S,4R,5R)-5-[6-(benzylamino)-9H-purin-9-yl]-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid
SMILES: O[C@@H]1[C@@H](COP(O)(O)=O)O[C@H]([C@@H]1O)n1cnc2c(NCc3ccccc3)ncnc12
SMILES: O[C@@H]1[C@@H](COP(O)(O)=O)O[C@H]([C@@H]1O)n1cnc2c(NCc3ccccc3)ncnc12
InChI key: DWVANBHPEPSMOV-LSCFUAHRSA-N
