CHEBI:76015 - vortioxetine hydrobromide

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ChEBI Name vortioxetine hydrobromide
ChEBI ID CHEBI:76015
Definition A hydrobromide obtained by combining vortioxetine with one molar equivalent of hydrobromic acid. Used for treatment of major depressive disorder.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C18H23BrN2S
Net Charge 0
Average Mass 379.35800
Monoisotopic Mass 378.07653
InChI InChI=1S/C18H22N2S.BrH/c1-14-7-8-17(15(2)13-14)21-18-6-4-3-5-16(18)20-11-9-19-10-12-20;/h3-8,13,19H,9-12H2,1-2H3;1H
InChIKey VNGRUFUIHGGOOM-UHFFFAOYSA-N
SMILES Br.Cc1ccc(Sc2ccccc2N2CCNCC2)c(C)c1
Roles Classification
Biological Role(s): serotonergic antagonist
Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
serotonergic agonist
An agent that has an affinity for serotonin receptors and is able to mimic the effects of serotonin by stimulating the physiologic activity at the cell receptors. Serotonin agonists are used as antidepressants, anxiolytics, and in the treatment of migraine disorders.
Application(s): antidepressant
Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions.
anxiolytic drug
Anxiolytic drugs are agents that alleviate anxiety, tension, and anxiety disorders, promote sedation, and have a calming effect without affecting clarity of consciousness or neurologic conditions.
serotonergic antagonist
Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
serotonergic agonist
An agent that has an affinity for serotonin receptors and is able to mimic the effects of serotonin by stimulating the physiologic activity at the cell receptors. Serotonin agonists are used as antidepressants, anxiolytics, and in the treatment of migraine disorders.
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ChEBI Ontology
Outgoing vortioxetine hydrobromide (CHEBI:76015) has part vortioxetine(1+) (CHEBI:76017)
vortioxetine hydrobromide (CHEBI:76015) has role antidepressant (CHEBI:35469)
vortioxetine hydrobromide (CHEBI:76015) has role anxiolytic drug (CHEBI:35474)
vortioxetine hydrobromide (CHEBI:76015) has role serotonergic agonist (CHEBI:35941)
vortioxetine hydrobromide (CHEBI:76015) has role serotonergic antagonist (CHEBI:48279)
vortioxetine hydrobromide (CHEBI:76015) is a hydrobromide (CHEBI:48367)
IUPAC Names
1-{2-[(2,4-dimethylphenyl)sulfanyl]phenyl}piperazine hydrobromide
4-{2-[(2,4-dimethylphenyl)sulfanyl]phenyl}piperazin-1-ium bromide
Synonyms Sources
1-(2-((2,4-Dimethylphenyl)sulfanyl)phenyl)piperazine monohydrobromide ChemIDplus
vortioxetine monohydrobromide ChemIDplus
Brand Name Source
Brintellix ChEBI
Manual Xrefs Databases
D10185 KEGG DRUG
Vortioxetine Wikipedia
WO2007144005 Patent
View more database links
Registry Numbers Types Sources
15607074 Reaxys Registry Number Reaxys
960203-27-4 CAS Registry Number ChemIDplus
960203-27-4 CAS Registry Number KEGG DRUG
Last Modified
06 November 2013