4-[2-(2-oxoindol-3-yl)hydrazinyl]benzoic 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: 4-[2-(2-oxoindol-3-yl)hydrazinyl]benzoic acid
• 化学式: C₁₅H₁₁N₃O₃
• 分子量: 281.27
• InChiKey: FPXPKITXJXKODA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  21
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  90.8
• 氢给体数：
  3
• 氢受体数：
  5

文献信息

• Crystals and structures of PAK4KD kinase PAK4KD
  申请人：——

  公开号：US20030229453A1

  公开（公告）日：2003-12-11

  The present invention provides machine readable media embedded with the three-dimensional molecular structure coordinates of PAK4KD kinase, and subsets thereof, including binding pockets, methods of using the structure to identify and design affecters, including inhibitors and activator, mutants of PAK4KD, PAK4KD crystals, and compounds and compositions that affect PAK4KD activity.

  本发明提供了嵌入 PAK4KD 激酶及其子集（包括结合口袋）三维分子结构坐标的机器可读介质、利用该结构识别和设计影响因子（包括抑制剂和激活剂）的方法、PAK4KD 的突变体、PAK4KD 晶体以及影响 PAK4KD 活性的化合物和组合物。
• [EN] CRYSTALS AND STRUCTURES OF PAK4KD KINASE PAK4KD<br/>[FR] CRISTAUX ET STRUCTURES DE PAK4KD KINASE PAK4KD
  申请人：STRUCTURAL GENOMIX INC

  公开号：WO2003087816A1

  公开（公告）日：2003-10-23

  The present invention provides machine readable media embedded with the three-dimensional molecular structure coordinates of PAK4KD kinase,and subsets thereof, including binding pockets, methods of using the structure to identify and design affecters, including inhibitors and activator, mutants of PAK4KD, PAK4KD crystals, and compounds and compositions that affect PAK4KD activity.