compound 3 [PMID: 14640538]

Ligand id: 8675

Name: compound 3 [PMID: 14640538]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 7
Topological polar surface area 165.8
Molecular weight 237.06
XLogP 0.21
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Barrow JC, Nantermet PG, Stauffer SR, Ngo PL, Steinbeiser MA, Mao SS, Carroll SS, Bailey C, Colussi D, Bosserman M et al.. (2003)
Synthesis and evaluation of imidazole acetic acid inhibitors of activated thrombin-activatable fibrinolysis inhibitor as novel antithrombotics.
J. Med. Chem., 46 (25): 5294-7. [PMID:14640538]