LG100754

Ligand id: 2814

Name: LG100754

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 46.53
Molecular weight 396.27
XLogP 7.86
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Selectivity at nuclear hormone receptors
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Value Parameter Concentration range (M) Reference
Retinoid X receptor-γ N/A Antagonist Antagonist 7.9 pKi - 3
pKi 7.9 (Ki 1.22x10-8 M) [3]
Retinoid X receptor-α Hs Antagonist Antagonist 8.5 pIC50 - 1
pIC50 8.5 [1]
Retinoid X receptor-β Hs Antagonist Antagonist 8.0 pIC50 - 1-3
pIC50 8.0 [1-3]
Peroxisome proliferator-activated receptor-γ Hs Agonist Full agonist - - - 1-2
[1-2]