compound 4q [PMID: 7650673]

Ligand id: 3108

Name: compound 4q [PMID: 7650673]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 9
Topological polar surface area 36.26
Molecular weight 444.26
XLogP 7.84
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

1. Gotteland JP, Brunel I, Gendre F, Désiré J, Delhon A, Junquéro D, Oms P, Halazy S. (1995)
(Aryloxy)methylsilane derivatives as new cholesterol biosynthesis inhibitors: synthesis and hypocholesterolemic activity of a new class of squalene epoxidase inhibitors.
J. Med. Chem., 38 (17): 3207-16. [PMID:7650673]