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CHEBI:134716 - brexpiprazole

Default Structure
ChEBI IDCHEBI:134716
ChEBI Namebrexpiprazole
Stars
Last Modified23 February 2017
DownloadsMolfile
FormulaC25H27N3O2S
Net Charge0
Average Mass433.577
Monoisotopic Mass433.18240
SMILESO=c1ccc2ccc(OCCCCN3CCN(c4cccc5sccc45)CC3)cc2n1
InChIInChI=1S/C25H27N3O2S/c29-25-9-7-19-6-8-20(18-22(19)26-25)30-16-2-1-11-27-12-14-28(15-13-27)23-4-3-5-24-21(23)10-17-31-24/h3-10,17-18H,1-2,11-16H2,(H,26,29)
InChIKeyZKIAIYBUSXZPLP-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Applications:
antidepressant  Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions.
antipsychotic agent  Antipsychotic drugs are agents that control agitated psychotic behaviour, alleviate acute psychotic states, reduce psychotic symptoms, and exert a quieting effect.
ChEBI Ontology
Outgoing Relation(s)
brexpiprazole (CHEBI:134716) has role antidepressant (CHEBI:35469)
brexpiprazole (CHEBI:134716) has role antipsychotic agent (CHEBI:35476)
brexpiprazole (CHEBI:134716) is a N-arylpiperazine (CHEBI:46848)
INN  Source
brexpiprazolWHO MedNet
Synonyms  Source
BrexpiprazoleChEMBL
OPC 34712DrugCentral
OPC-34712DrugCentral
rexultiDrugCentral
Brand Name  Source
RxultiChEMBL
Manual XrefsDatabases
5014DrugCentral
Registry NumbersSources
CAS:913611-97-9DrugCentral
Citations