alimemazine   Click here for help

GtoPdb Ligand ID: 7237

Synonyms: Nedeltran® | trimeprazine
Approved drug Immunopharmacology Ligand
alimemazine is an approved drug
Compound class: Synthetic organic
Comment: Alimemazine is a phenothiazine derivative antihistamine.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 4
Topological polar surface area 31.78
Molecular weight 298.15
XLogP 4.6
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES CN(CC(CN1c2ccccc2Sc2c1cccc2)C)C
Isomeric SMILES CN(CC(CN1c2ccccc2Sc2c1cccc2)C)C
InChI InChI=1S/C18H22N2S/c1-14(12-19(2)3)13-20-15-8-4-6-10-17(15)21-18-11-7-5-9-16(18)20/h4-11,14H,12-13H2,1-3H3
InChI Key ZZHLYYDVIOPZBE-UHFFFAOYSA-N
References
1. Kubo N, Shirakawa O, Kuno T, Tanaka C. (1987)
Antimuscarinic effects of antihistamines: quantitative evaluation by receptor-binding assay.
Jpn. J. Pharmacol., 43 (3): 277-82. [PMID:2884340]