Ligand id: 4025

Name: amthamine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 93.17
Molecular weight 157.07
XLogP -0.04
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Kraus A, Ghorai P, Birnkammer T, Schnell D, Elz S, Seifert R, Dove S, Bernhardt G, Buschauer A. (2009)
N(G)-acylated aminothiazolylpropylguanidines as potent and selective histamine H(2) receptor agonists.
ChemMedChem, 4 (2): 232-40. [PMID:19072936]