metoclopramide

Ligand id: 241

Name: metoclopramide

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 8
Topological polar surface area 67.59
Molecular weight 299.14
XLogP 1.14
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Brady CA, Stanford IM, Ali I, Lin L, Williams JM, Dubin AE, Hope AG, Barnes NM. (2001)
Pharmacological comparison of human homomeric 5-HT3A receptors versus heteromeric 5-HT3A/3B receptors.
Neuropharmacology41 (2): 282-4. [PMID:11489465]
2. Claeysen S, Sebben M, Journot L, Bockaert J, Dumuis A. (1996)
Cloning, expression and pharmacology of the mouse 5-HT(4L) receptor.
FEBS Lett398: 19-25. [PMID:8946946]
3. Hope AG, Peters JA, Brown AM, Lambert JJ, Blackburn TP. (1996)
Characterization of a human 5-hydroxytryptamine3 receptor type A (h5-HT3R-AS) subunit stably expressed in HEK 293 cells.
Br. J. Pharmacol.118 (5): 1237-45. [PMID:8818349]
4. Matsui A, Matsuo H, Takanaga H, Sasaki S, Maeda M, Sawada Y. (1998)
Prediction of catalepsies induced by amiodarone, aprindine and procaine: similarity in conformation of diethylaminoethyl side chain.
J. Pharmacol. Exp. Ther.287 (2): 725-32. [PMID:9808703]