compound 28xvii [PMID: 8809154]

Ligand id: 8764

Name: compound 28xvii [PMID: 8809154]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 10
Topological polar surface area 111.1
Molecular weight 470.18
XLogP 7.8
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

1. Hagishita S, Yamada M, Shirahase K, Okada T, Murakami Y, Ito Y, Matsuura T, Wada M, Kato T, Ueno M et al.. (1996)
Potent inhibitors of secretory phospholipase A2: synthesis and inhibitory activities of indolizine and indene derivatives.
J. Med. Chem., 39 (19): 3636-58. [PMID:8809154]