2-[[4-[(2-amino-4-oxo-3H-pteridin-7-yl)methylimino]-3-(3,6-dimethyl-9,10-dihydroanthracen-9-yl)cyclohexa-1,5-diene-1-carbonyl]amino]pentanedioic acid;[4-[bis[4-(diethylamino)phenyl]methylidene]-8-(diethylamino)naphthalen-1-ylidene]-diethylazanium;8-[bis[4-(diethylamino)phenyl]methylidene]-5-hydroxy-3-phenylchromene-4,7-dione

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: 2-[[4-[(2-amino-4-oxo-3H-pteridin-7-yl)methylimino]-3-(3,6-dimethyl-9,10-dihydroanthracen-9-yl)cyclohexa-1,5-diene-1-carbonyl]amino]pentanedioic acid;[4-[bis[4-(diethylamino)phenyl]methylidene]-8-(diethylamino)naphthalen-1-ylidene]-diethylazanium;8-[bis[4-(diethylamino)phenyl]methylidene]-5-hydroxy-3-phenylchromene-4,7-dione
• 化学式: C110H122N13O10+
• 分子量: 1786.2
• InChiKey: VAQZYUIOKALXHP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  19.17
• 重原子数：
  133
• 可旋转键数：
  31
• 环数：
  15.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  292
• 氢给体数：
  6
• 氢受体数：
  18