Ligand Id: 1669
Ligand name GNTI

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 5
Rotatable bonds 3
Topological polar surface area 133.12
Molecular weight 471.23
XLogP 1.85
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Summary Biological activity References Structure Similar ligands
References
1. Payza, K. (2003)
Binding and activity of opioid ligands at the cloned human delta, mu and kappa receptors.  in  The Delta Receptor
Edited by Chang, K-J. Marcel Dekker Inc. 261-275  [ISBN:0824740319]
2. Jones, R. M. and Portoghese, P. S. (2000)
5'-Guanidinonaltrindole, a highly selective and potent kappa-opioid receptor antagonist.
Eur J Pharmacol, 396: 49-52. [PMID:10822054]
3. Stevens, WC; Jones, RM; Subramanian, G; Metzger, TG; Ferguson, DM; Portoghese, PS. (2000)
Potent and selective indolomorphinan antagonists of the kappa-opioid receptor.
J. Med. Chem., 43 (14): 2759-69. [PMID:10893314]