2-[[[(3R)-2-oxo-1-[(1R)-1-phenylethyl]piperidin-3-yl]methylamino]methyl]pyridine-4-carboxylic 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: 2-[[[(3R)-2-oxo-1-[(1R)-1-phenylethyl]piperidin-3-yl]methylamino]methyl]pyridine-4-carboxylic acid
• 化学式: C₂₁H₂₅N₃O₃
• 分子量: 367.4
• InChiKey: VROYSACMKZBUDU-CRAIPNDOSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.1
• 重原子数：
  27
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  82.5
• 氢给体数：
  2
• 氢受体数：
  5

文献信息

• INHIBITORS OF HISTONE DEMETHYLASES
  申请人：LABELLE Marc

  公开号：US20170369444A1

  公开（公告）日：2017-12-28

  Compounds of the form in which Q is selected from —COOH—CH═NR 12 , —W, —CH 2 NHR 13 , —CH=0 and —CH(OR 17 ) 2 capable of modulating the activity of histone demethylases (HDMEs), which are useful for prevention and/or treatment of diseases in which genomic dysregulation is involved in the pathogenesis, such as e.g. cancer and formulations and methods of use of such compounds.