2-(1-oxophthalazin-2-yl)ethyl N-[4-(trifluoromethoxy)phenyl]carbamate

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二氮杂萘
• 英文名称: 2-(1-oxophthalazin-2-yl)ethyl N-[4-(trifluoromethoxy)phenyl]carbamate
• 化学式: C₁₈H₁₄F₃N₃O₄
• 分子量: 393.3
• InChiKey: IWMDZZAATFKAOP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.3
• 重原子数：
  28
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  80.2
• 氢给体数：
  1
• 氢受体数：
  8

文献信息

• REL INHIBITORS AND METHODS OF USE THEREOF
  申请人：Chen Youhai H.

  公开号：US20110118325A1

  公开（公告）日：2011-05-19

  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.