alvespimycin

Ligand id: 9828

Name: alvespimycin

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 12
Hydrogen bond donors 4
Rotatable bonds 8
Topological polar surface area 169.52
Molecular weight 616.35
XLogP 1.03
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

View interactive charts of activity data from GtoPdb and ChEMBL (where available) across species

Selectivity at other protein targets
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Value Parameter Concentration range (M) Reference
heat shock protein 90 alpha family class A member 1 Hs Inhibitor Inhibition 8.4 pIC50 - 2
pIC50 8.4 (IC50 4.5x10-9 M) [2]