compound 40 [PMID: 10602705]

Ligand id: 8630

Name: compound 40 [PMID: 10602705]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 12
Hydrogen bond donors 5
Rotatable bonds 13
Topological polar surface area 251.58
Molecular weight 483.13
XLogP -3.83
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

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

Selectivity at enzymes
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
Glutamyl aminopeptidase Mm Inhibitor Inhibition 9.1 pKi - 1
pKi 9.1 (Ki 8.73x10-10 M) [1]