compound 5 [Noble et al., 1992]

Ligand id: 8844

Name: compound 5 [Noble et al., 1992]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 13
Hydrogen bond donors 9
Rotatable bonds 6
Topological polar surface area 320.44
Molecular weight 451.92
XLogP -3.39
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
INPP5A Hs Inhibitor Inhibition 5.9 pKi - 1
pKi 5.9 (Ki 1.3x10-6 M) [1]
Description: Using 5-phosphatase from human erythrocyte membranes.