compound 1 [PMID: 25719566]

Ligand id: 8302

Name: compound 1 [PMID: 25719566]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 5
Topological polar surface area 72.32
Molecular weight 354.16
XLogP 4.83
No. Lipinski's rules broken 0

Molecular properties generated using the CDK