compound 4 [PMID: 22533316]

Ligand id: 6712

Name: compound 4 [PMID: 22533316]

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 53.6
Molecular weight 430.07
XLogP 5.74
No. Lipinski's rules broken 1

Molecular properties generated using the CDK