ML351

Ligand id: 10263

Name: ML351

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 61.85
Molecular weight 249.09
XLogP 3.26
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

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

Bioactivity Comments
ML351 is >250-fold selective for human 15-LOX-1 compared to the 5-LOX, platelet 12-LOX, 15-LOX-2 and COX-2 enzymes [1].
Selectivity at enzymes
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Target Sp. Type Action Value Parameter Concentration range (M) Reference
15-LOX-1 Hs Inhibitor Inhibition 6.7 pIC50 - 1
pIC50 6.7 (IC50 2x10-7 M) [1]