N-methyl scopolamine

Ligand id: 316

Name: N-methyl scopolamine

Abbreviated name: NMS

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 59.06
Molecular weight 318.17
XLogP 2.31
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Dowling MR, Charlton SJ. (2006)
Quantifying the association and dissociation rates of unlabelled antagonists at the muscarinic M(3) receptor.
Br J Pharmacol148: 927-937. [PMID:16847442]
2. Fruchart-Gaillard C, Mourier G, Marquer C, Ménez A, Servent D. (2006)
Identification of various allosteric interaction sites on M1 muscarinic receptor using 125I-Met35-oxidized muscarinic toxin 7.
Mol Pharmacol69: 1641-1651. [PMID:16439611]