(3R,4R,5S)-4-hydroxy-3-methyl-5-(methylamino)-2-[methyl(pyridin-4-ylmethyl)amino]hexanoic acid

• 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: (3R,4R,5S)-4-hydroxy-3-methyl-5-(methylamino)-2-[methyl(pyridin-4-ylmethyl)amino]hexanoic acid
• 化学式: C₁₅H₂₅N₃O₃
• 分子量: 295.38
• InChiKey: DVRYQTPBFYSKIR-ZZWXXDIBSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1.8
• 重原子数：
  21
• 可旋转键数：
  8
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.6
• 拓扑面积：
  85.7
• 氢给体数：
  3
• 氢受体数：
  6

文献信息

• CYCLOSPORIN A ANALOGS
  申请人：ALLERGAN, INC.

  公开号：EP2855508A2

  公开（公告）日：2015-04-08
• [EN] CYCLOSPORIN A ANALOGS<br/>[FR] ANALOGUES DE CYCLOSPORINE A
  申请人：ALLERGAN INC

  公开号：WO2013181339A2

  公开（公告）日：2013-12-05

  The present invention relates to novel cyclosporin analogs, processes for preparing them, pharmaceutical compositions containing them, and methods for using these analogs and the compositions containing them for the treatment of medical conditions, including but not limited to ocular conditions such as dry eye.