compound 9 [PMID: 22533316]

Ligand id: 6718

Name: compound 9 [PMID: 22533316]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 12
Topological polar surface area 69.23
Molecular weight 464.23
XLogP 5.32
No. Lipinski's rules broken 2

Molecular properties generated using the CDK