Ligand id: 9625

Name: rovazolac

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 8
Topological polar surface area 86.64
Molecular weight 452.1
XLogP 6.13
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

1. Mohan R. (2013)
Liver x receptor (lxr) modulators for the treatment of dermal diseases, disorders and conditions.
Patent number: WO2013130892. Assignee: Anayaderm, Inc. Priority date: 02/03/2012. Publication date: 06/09/2013.
2. Schmuth M, Moosbrugger-Martinz V, Blunder S, Dubrac S. (2014)
Role of PPAR, LXR, and PXR in epidermal homeostasis and inflammation.
Biochim. Biophys. Acta, 1841 (3): 463-73. [PMID:24315978]
3. Steffensen KR, Jakobsson T, Gustafsson JÅ. (2013)
Targeting liver X receptors in inflammation.
Expert Opin. Ther. Targets, 17 (8): 977-90. [PMID:23738533]
4. Xu P, Li D, Tang X, Bao X, Huang J, Tang Y, Yang Y, Xu H, Fan X. (2013)
LXR agonists: new potential therapeutic drug for neurodegenerative diseases.
Mol. Neurobiol., 48 (3): 715-28. [PMID:23625315]