compound 23 [PMID: 8709131]

Ligand id: 3095

Name: compound 23 [PMID: 8709131]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 1
Topological polar surface area 23.47
Molecular weight 303.16
XLogP 6.94
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

1. Brown GR, Clarke DS, Foubister AJ, Freeman S, Harrison PJ, Johnson MC, Mallion KB, McCormick J, McTaggart F, Reid AC et al.. (1996)
Synthesis and activity of a novel series of 3-biarylquinuclidine squalene synthase inhibitors.
J. Med. Chem., 39 (15): 2971-9. [PMID:8709131]