5,6-dihydroxy-3-methylbenzo[b]thiophene-2-carboxylic acid | 1380695-54-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并噻吩类
• 英文名称: 5,6-dihydroxy-3-methylbenzo[b]thiophene-2-carboxylic acid
• 英文别名: 3-methyl-DHTCA；5,6-dihydroxy-3-methyl-1-benzothiophene-2-carboxylic acid
• CAS: 1380695-54-4
• 化学式: C₁₀H₈O₄S
• 分子量: 224.237
• InChiKey: VLRACFLLFIANHE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  15
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  106
• 氢给体数：
  3
• 氢受体数：
  5

文献信息

• [EN] GPR35 LIGANDS AND THE USES THEREOF<br/>[FR] LIGANDS DE GPR35 ET LEURS UTILISATIONS
  申请人：CORNING INC

  公开号：WO2013022740A2

  公开（公告）日：2013-02-14

  Disclosed are compositions and methods for reducing the risk of and/or treatment of diseases which are pathophysiologically related to GPR35, and/or GPR35-hERG signaling complex. For example, disclosed are compounds for reducing the risk of and/or treating diseases which are pathophysiologically related to GPR35 in a subject.