edrophonium

Ligand id: 9073

Name: edrophonium

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 0
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 20.23
Molecular weight 166.12
XLogP 1.66
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Boyle NA, Talesa V, Giovannini E, Rosi G, Norton SJ. (1997)
Synthesis and study of thiocarbonate derivatives of choline as potential inhibitors of acetylcholinesterase.
J. Med. Chem.40 (19): 3009-13. [PMID:9301662]