2-[[4-[[[4-[[4-[2-[2-[2-[2-[2-[2-[2-[[2-[2-[2-[[2-amino-3-oxo-3-(2-phosphonooxyethylamino)propyl]disulfanyl]-5-[[(3-methoxy-2-methyl-16-oxo-18-phosphonooxy-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-4-yl)-methylcarbamoyl]oxymethyl]phenyl]ethoxy]acetyl]amino]ethoxy]ethoxy]ethyl-[2-[2-[[ethoxymethyl(hydroxy)phosphoryl]methoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]ethoxy]ethylamino]-1-carboxy-4-oxobutyl]carbamoyl]phenyl]-[(2-amino-4-oxo-3H-pteridin-6-yl)methyl]carbamoyl]oxymethyl]phenoxy]carbonyl-methylamino]ethyl-dimethyl-(phosphonooxymethyl)azanium

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 蝶啶及其衍生物
• 英文名称: 2-[[4-[[[4-[[4-[2-[2-[2-[2-[2-[2-[2-[[2-[2-[2-[[2-amino-3-oxo-3-(2-phosphonooxyethylamino)propyl]disulfanyl]-5-[[(3-methoxy-2-methyl-16-oxo-18-phosphonooxy-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-4-yl)-methylcarbamoyl]oxymethyl]phenyl]ethoxy]acetyl]amino]ethoxy]ethoxy]ethyl-[2-[2-[[ethoxymethyl(hydroxy)phosphoryl]methoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]ethoxy]ethylamino]-1-carboxy-4-oxobutyl]carbamoyl]phenyl]-[(2-amino-4-oxo-3H-pteridin-6-yl)methyl]carbamoyl]oxymethyl]phenoxy]carbonyl-methylamino]ethyl-dimethyl-(phosphonooxymethyl)azanium
• 化学式: C101H135N18O40P4S2+
• 分子量: 2429.3
• InChiKey: FDVBFBRUBKIBMT-UHFFFAOYSA-O

计算性质

• 辛醇/水分配系数(LogP)：
  -6.8
• 重原子数：
  165
• 可旋转键数：
  72
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.49
• 拓扑面积：
  811
• 氢给体数：
  16
• 氢受体数：
  46