Ligand id: 7337

Name: ELND006

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 4
Topological polar surface area 74.44
Molecular weight 455.07
XLogP 5.3
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

Bioactivity Comments
Gamma secretase inhibition reported as Notch-sparing
Selectivity at enzymes
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
presenilin 1 Hs Inhibitor Inhibition 9.5 pIC50 - 2
pIC50 9.5 (IC50 3.4x10-10 M) [2]
Description: A-beta release assay