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CHEBI:70707 - vilazodone

Default Structure
ChEBI IDCHEBI:70707
ChEBI Namevilazodone
Stars
DefinitionA 1-benzofuran that is 5-(piperazin-1-yl}-1-benzofuran-2-carboxamide having a (5-cyanoindol-3-yl)butyl group attached at position N-4 on the piperazine ring. Used for the treatment of major depressive disorder.
Last Modified22 February 2017
SubmitterSteve
DownloadsMolfile
FormulaC26H27N5O2
Net Charge0
Average Mass441.535
Monoisotopic Mass441.21648
SMILESN#Cc1ccc2ncc(CCCCN3CCN(c4ccc5oc(C(N)=O)cc5c4)CC3)c2c1
InChIInChI=1S/C26H27N5O2/c27-16-18-4-6-23-22(13-18)19(17-29-23)3-1-2-8-30-9-11-31(12-10-30)21-5-7-24-20(14-21)15-25(33-24)26(28)32/h4-7,13-15,17,29H,1-3,8-12H2,(H2,28,32)
InChIKeySGEGOXDYSFKCPT-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
serotonin uptake inhibitor  A compound that specifically inhibits the reuptake of serotonin in the brain. This increases the serotonin concentration in the synaptic cleft which then activates serotonin receptors to a greater extent.
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.
Applications:
serotonin uptake inhibitor  A compound that specifically inhibits the reuptake of serotonin in the brain. This increases the serotonin concentration in the synaptic cleft which then activates serotonin receptors to a greater extent.
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.
antidepressant  Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions.
ChEBI Ontology
Outgoing Relation(s)
vilazodone (CHEBI:70707) has role antidepressant (CHEBI:35469)
vilazodone (CHEBI:70707) has role serotonergic agonist (CHEBI:35941)
vilazodone (CHEBI:70707) has role serotonin uptake inhibitor (CHEBI:50949)
vilazodone (CHEBI:70707) is a N-alkylpiperazine (CHEBI:46845)
vilazodone (CHEBI:70707) is a N-arylpiperazine (CHEBI:46848)
vilazodone (CHEBI:70707) is a 1-benzofurans (CHEBI:38830)
vilazodone (CHEBI:70707) is a indoles (CHEBI:24828)
vilazodone (CHEBI:70707) is a monocarboxylic acid amide (CHEBI:29347)
vilazodone (CHEBI:70707) is a nitrile (CHEBI:18379)
vilazodone (CHEBI:70707) is conjugate base of vilazodone(1+) (CHEBI:70706)
Incoming Relation(s)
vilazodone(1+) (CHEBI:70706) is conjugate acid of vilazodone (CHEBI:70707)
IUPAC Name 
5-{4-[4-(5-cyano-1H-indol-3-yl)butyl]piperazin-1-yl}-1-benzofuran-2-carboxamide
INNs  Source
vilazodonaWHO MedNet
vilazodoneWHO MedNet
vilazodoneKEGG DRUG
vilazodonumWHO MedNet
Manual XrefsDatabases
4223DrugCentral
D09698KEGG DRUG
DB06684DrugBank
HMDB0015637HMDB
US5532241Patent
US6531503Patent
VilazodoneWikipedia
WO2004113326Patent
WO2005018676Patent
WO2005023243Patent
WO2005056056Patent
Registry NumbersSources
Reaxys:9830698Reaxys
CAS:163521-12-8ChemIDplus
CAS:163521-12-8KEGG DRUG
Citations