compound 12e [PMID: 18605714]

Ligand id: 8787

Name: compound 12e [PMID: 18605714]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 8
Topological polar surface area 111.62
Molecular weight 430.15
XLogP 5.01
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

References
1. Oslund RC, Cermak N, Gelb MH. (2008)
Highly specific and broadly potent inhibitors of mammalian secreted phospholipases A2.
J. Med. Chem.51 (15): 4708-14. [PMID:18605714]