compound 15a [PMID: 16242323]

Ligand id: 6724

Name: compound 15a [PMID: 16242323]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 3
Rotatable bonds 11
Topological polar surface area 109.58
Molecular weight 577.28
XLogP 8.13
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

1. Ban H, Muraoka M, Ioriya K, Ohashi N. (2006)
Synthesis and biological activity of novel 4-phenyl-1,8-naphthyridin-2(1H)-on-3-yl ureas: potent acyl-CoA:cholesterol acyltransferase inhibitor with improved aqueous solubility.
Bioorg. Med. Chem. Lett., 16 (1): 44-8. [PMID:16242323]