CD666

Ligand id: 2652

Name: CD666

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 4
Topological polar surface area 57.53
Molecular weight 364.2
XLogP 9.1
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

References
1. Bernard BA, Bernardon JM, Delescluse C, Martin B, Lenoir MC, Maignan J, Charpentier B, Pilgrim WR, Reichert U, Shroot B. (1992)
Identification of synthetic retinoids with selectivity for human nuclear retinoic acid receptor gamma.
Biochem. Biophys. Res. Commun.186 (2): 977-83. [PMID:1323296]