compound 1e [PMID: 2153213]

Ligand id: 2991

Name: compound 1e [PMID: 2153213]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 9
Topological polar surface area 85.52
Molecular weight 402.21
XLogP 3.61
No. Lipinski's rules broken 0

Molecular properties generated using the CDK