anastrozole

Ligand id: 5137

Name: anastrozole

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 4
Topological polar surface area 78.29
Molecular weight 293.16
XLogP 1.89
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

View interactive charts of activity data from ChEMBL and GtoPdb across species (New!)

Selectivity at human enzymes
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
CYP19A1 Inhibitor Inhibition 7.8 pIC50 - 2
pIC50 7.8 (IC50 1.5x10-8 M) [2]
Targets where the ligand is described in the comment field
Target Comment