Ligand id: 5139

Name: APA

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 2
Rotatable bonds 3
Topological polar surface area 61.27
Molecular weight 90.08
XLogP -1.43
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Stanek J, Frei J, Mett H, Schneider P, Regenass U. (1992)
2-substituted 3-(aminooxy)propanamines as inhibitors of ornithine decarboxylase: synthesis and biological activity.
J. Med. Chem., 35 (8): 1339-44. [PMID:1573631]