etoricoxib

Ligand id: 2896

Name: etoricoxib

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 3
Topological polar surface area 68.3
Molecular weight 358.05
XLogP 4.06
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Riendeau D, Percival MD, Brideau C, Charleson S, DubĂ© D, Ethier D, Falgueyret JP, Friesen RW, Gordon R, Greig G et al.. (2001)
Etoricoxib (MK-0663): preclinical profile and comparison with other agents that selectively inhibit cyclooxygenase-2.
J. Pharmacol. Exp. Ther.296 (2): 558-66. [PMID:11160644]