Ligand id: 2897

Name: lumiracoxib

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 4
Topological polar surface area 49.33
Molecular weight 293.06
XLogP 4.31
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Blobaum AL, Marnett LJ. (2007)
Molecular determinants for the selective inhibition of cyclooxygenase-2 by lumiracoxib.
J. Biol. Chem., 282 (22): 16379-90. [PMID:17434872]