compound 14j [PMID: 27050842]

Ligand id: 9147

Name: compound 14j [PMID: 27050842]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 7
Topological polar surface area 63.83
Molecular weight 284.2
XLogP 2.88
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Wang HY, Qin Y, Li H, Roman LJ, Mart├ísek P, Poulos TL, Silverman RB. (2016)
Potent and Selective Human Neuronal Nitric Oxide Synthase Inhibition by Optimization of the 2-Aminopyridine-Based Scaffold with a Pyridine Linker.
J. Med. Chem., 59 (10): 4913-25. [PMID:27050842]