carbocyclic thromboxane A2

Ligand id: 1970

Name: carbocyclic thromboxane A2

Abbreviated name: CTA2

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 12
Topological polar surface area 57.53
Molecular weight 348.27
XLogP 7.21
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

1. Miki I, Kishibayashi N, Nonaka H, Ohshima E, Takami H, Obase H, Ishii A. (1992)
Effects of KW-3635, a novel dibenzoxepin derivative of a selective thromboxane A2 antagonist, on human, guinea pig and rat platelets.
Jpn J Pharmacol, 59: 357-364. [PMID:1434130]