compound NRA 4 [PMID: 25262941]

Ligand id: 9010

Name: compound NRA 4 [PMID: 25262941]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 1
Topological polar surface area 46.53
Molecular weight 333.96
XLogP 4.51
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Ma ML, Li M, Gou JJ, Ruan TY, Jin HS, Zhang LH, Wu LC, Li XY, Hu YH, Wen K et al.. (2014)
Design, synthesis and biological activity of flavonoid derivatives as selective agonists for neuromedin U 2 receptor.
Bioorg. Med. Chem., 22 (21): 6117-23. [PMID:25262941]