(1-benzhydrylazetidin-3-yl) N-[4-(trifluoromethoxy)phenyl]carbamate

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: (1-benzhydrylazetidin-3-yl) N-[4-(trifluoromethoxy)phenyl]carbamate
• 化学式: C₂₄H₂₁F₃N₂O₃
• 分子量: 442.4
• InChiKey: QUDPFNRHCIUVKC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.8
• 重原子数：
  32
• 可旋转键数：
  7
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.21
• 拓扑面积：
  50.8
• 氢给体数：
  1
• 氢受体数：
  7

文献信息

• REL INHIBITORS AND METHODS OF USE THEREOF
  申请人：The Trustees of the University of Pennsylvania

  公开号：US20140066486A1

  公开（公告）日：2014-03-06

  This invention provides REL inhibitors which interfere with the DNA binding capacity of a REL protein. Additionally this invention provides methods of treating, abrogating, or preventing diseases which respond with a positive clinical score to a REL inhibitor. Methods of identifying REL inhibitor based on a REL protein three dimensional model are described.