compound 11d [PMID: 23981898]

Ligand id: 6946

Name: compound 11d [PMID: 23981898]

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 11
Topological polar surface area 113.02
Molecular weight 560.23
XLogP 4.51
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Bioactivity Comments
Potent IC50 against purified BACE1 of 5 nM compared to 820 nM vs Cathepsin D [1]
Selectivity at enzymes
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Value Parameter Concentration range (M) Reference
beta-secretase 1 Hs Inhibitor Competitive 8.4 pIC50 - 1
pIC50 8.4 (IC50 4x10-9 M) [1]