compound 7 [PMID: 21334791]

Ligand id: 8785

Name: compound 7 [PMID: 21334791]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 0
Hydrogen bond donors 4
Rotatable bonds 3
Topological polar surface area 80.92
Molecular weight 246.09
XLogP 1.62
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Download 2D Structure
Canonical SMILES Download
Isomeric SMILES Download
InChI standard identifier Download
InChI standard key Download

Molecular structure representations generated using Open Babel