compound 8a [PMID: 22861813]

Ligand id: 7891

Name: compound 8a [PMID: 22861813]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 3
Rotatable bonds 7
Topological polar surface area 98.74
Molecular weight 383.13
XLogP 4.65
No. Lipinski's rules broken 0

Molecular properties generated using the CDK