Ligand id: 6187

Name: E339-3D6

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 24
Hydrogen bond donors 10
Rotatable bonds 46
Topological polar surface area 448.44
Molecular weight 1746.68
XLogP 10.29
No. Lipinski's rules broken 4

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