Ligand id: 7597

Name: pralidoxime

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 0
Hydrogen bond donors 1
Rotatable bonds 1
Topological polar surface area 36.47
Molecular weight 137.07
XLogP 1.81
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Musilek K, Komloova M, Holas O, Horova A, Pohanka M, Gunn-Moore F, Dohnal V, Dolezal M, Kuca K. (2011)
Mono-oxime bisquaternary acetylcholinesterase reactivators with prop-1,3-diyl linkage-Preparation, in vitro screening and molecular docking.
Bioorg. Med. Chem., 19 (2): 754-62. [PMID:21215642]