HIT ID: HIT214433461
Cas No: 1612191-95-3
分子式: C18H16FN5O3
分子量: 369.356
常用名: 9-(3-Deoxy-3-fluoro-β-D-ribofuranosyl)-6-[5-(propyn-1-yl)pyridin-3-yl]purine
常用名: 9-(3-Deoxy-3-fluoro-β-D-ribofuranosyl)-6-[5-(propyn-1-yl)pyridin-3-yl]purine
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2R,3S,4S,5R)-4-fluoro-5-(hydroxymethyl)-2-{6-[5-(prop-1-yn-1-yl)pyridin-3-yl]-9H-purin-9-yl}oxolan-3-ol
IUPAC: (2R,3S,4S,5R)-4-fluoro-5-(hydroxymethyl)-2-{6-[5-(prop-1-yn-1-yl)pyridin-3-yl]-9H-purin-9-yl}oxolan-3-ol
SMILES: CC#Cc1cncc(c1)-c1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](F)[C@H]1O
SMILES: CC#Cc1cncc(c1)-c1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](F)[C@H]1O
InChI key: CGCIVQJBWZRBCA-ZHCAMHROSA-N
