compound 3 [PMID: 28603634]

Ligand id: 9628

Name: compound 3 [PMID: 28603634]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 6
Topological polar surface area 99.52
Molecular weight 390.16
XLogP 4.26
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Immunopharmacology Comments
EP4 antagonists are effective as analgesic and anti‐inflammatory molecules. Traditional NSAIDS and coxibs, while effective, exhibit significant liability because of a variety of side‐effects. EP4 antagonists would be expected to be a safer alternative since they are unlikely to have a direct effect on levels of other prostanoids.