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CHEBI:90865 - flibanserin

ChEBI IDCHEBI:90865
ChEBI Nameflibanserin
Stars
DefinitionAn N-alkylpiperazine that is 1-[2-(1,3-dihydro-2-oxobenzimidazol-1-yl)ethyl]piperazine in which the remaining amino proton is replaced by a 3-(trifluoromethyl)phenyl group. A multifunctional serotonin agonist and antagonist which is used for the treatment of pre-menopausal women with hypoactive sexual desire disorder.
Last Modified22 February 2017
SubmitterSteve
DownloadsMolfile
FormulaC20H21F3N4O
Net Charge0
Average Mass390.409
Monoisotopic Mass390.16675
SMILESO=c1nc2ccccc2n1CCN1CCN(c2cccc(C(F)(F)F)c2)CC1
InChIInChI=1S/C20H21F3N4O/c21-20(22,23)15-4-3-5-16(14-15)26-11-8-25(9-12-26)10-13-27-18-7-2-1-6-17(18)24-19(27)28/h1-7,14H,8-13H2,(H,24,28)
InChIKeyPPRRDFIXUUSXRA-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
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.
serotonergic antagonist  Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
Applications:
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.
serotonergic antagonist  Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
antidepressant  Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions.
ChEBI Ontology
Outgoing Relation(s)
flibanserin (CHEBI:90865) has role antidepressant (CHEBI:35469)
flibanserin (CHEBI:90865) has role serotonergic agonist (CHEBI:35941)
flibanserin (CHEBI:90865) has role serotonergic antagonist (CHEBI:48279)
flibanserin (CHEBI:90865) is a N-alkylpiperazine (CHEBI:46845)
flibanserin (CHEBI:90865) is a N-arylpiperazine (CHEBI:46848)
flibanserin (CHEBI:90865) is a benzimidazoles (CHEBI:22715)
flibanserin (CHEBI:90865) is a organofluorine compound (CHEBI:37143)
IUPAC Name 
1-(2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-1,3-dihydro-2H-benzimidazol-2-one
INN  Source
flibanserinKEGG DRUG
Synonyms  Source
1-(2-(4-alpha,alpha,alpha-Trifluoro-m-tolyl)-1-(piperazinyl)ethyl)-2-benzimidazolinoneChemIDplus
Female Viagra (Street Name)ChemIDplus
Bimt 17ChemIDplus
1,3-Dihydro-1-(2-(4-(3-(trifluoromethyl)phenyl)-1-piperazinyl)ethyl)-2H-benzimidazol-2-oneChemIDplus
Bimt-17ChemIDplus
BIMT 17 BSChemIDplus
Brand Name  Source
AddyiKEGG DRUG
Manual XrefsDatabases
D02577KEGG DRUG
FlibanserinWikipedia
5022DrugCentral
Registry NumbersSources
Reaxys:8942243Reaxys
CAS:167933-07-5KEGG DRUG
CAS:167933-07-5ChemIDplus
Citations