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

1. Cesario RM, Klausing K, Razzaghi H, Crombie D, Rungta D, Heyman RA, Lala DS. (2001)
The rexinoid LG100754 is a novel RXR:PPARgamma agonist and decreases glucose levels in vivo.
Mol. Endocrinol., 15 (8): 1360-9. [PMID:11463859]
2. Forman BM. (2002)
The antidiabetic agent LG100754 sensitizes cells to low concentrations of peroxisome proliferator-activated receptor gamma ligands.
J. Biol. Chem., 277 (15): 12503-6. [PMID:11877384]
3. Lala DS, Mukherjee R, Schulman IG, Koch SS, Dardashti LJ, Nadzan AM, Croston GE, Evans RM, Heyman RA. (1996)
Activation of specific RXR heterodimers by an antagonist of RXR homodimers.
Nature, 383 (6599): 450-3. [PMID:8837780]