Ligand id: 4054

Name: AC261066

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 9
Topological polar surface area 96.89
Molecular weight 353.11
XLogP 3.6
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Lund BW, Piu F, Gauthier NK, Eeg A, Currier E, Sherbukhin V, Brann MR, Hacksell U, Olsson R. (2005)
Discovery of a potent, orally available, and isoform-selective retinoic acid beta2 receptor agonist.
J. Med. Chem., 48 (24): 7517-9. [PMID:16302793]