evans blue dye

Ligand id: 4579

Name: evans blue dye

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 20
Hydrogen bond donors 4
Rotatable bonds 9
Topological polar surface area 397.28
Molecular weight 959.98
XLogP 3.64
No. Lipinski's rules broken 1

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