VORTIOXETINE HYDROBROMIDE

Search structure
Trade Names:
Synonyms:
Status: Approved (2013)
Entry Type: Small molecule
Molecule Category: Salt
UNII: TKS641KOAY
Parent Compound: VORTIOXETINE

Structure
InChI Key VNGRUFUIHGGOOM-UHFFFAOYSA-N
Smile Br.Cc1ccc(Sc2ccccc2N2CCNCC2)c(C)c1
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

Physicochemical Descriptors

Property Name Value
Molecular Formula C18H23BrN2S
Molecular Weight 379.37
AlogP 3.86
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 3.0
Polar Surface Area 15.27
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 21.0

Pharmacology

Action Mechanism of Action Reference
AGONIST Serotonin 1a (5-HT1a) receptor agonist DailyMed PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

Scaffolds

Parent

Adverse Reactions

SOC By Demographic Distribution
System Organ Classification (SOC)
Relative Frequency (%)
Psychiatric disorders
23.99
Nervous system disorders
15.14
General disorders and administration site conditions
14.52
Gastrointestinal disorders
12.63
Injury, poisoning and procedural complications
5.32
Skin and subcutaneous tissue disorders
5.25
Vascular disorders
3.56
Investigations
3.09
Cardiac disorders
2.89
Musculoskeletal and connective tissue disorders
2.55

Cross References

Resources Reference
ChEBI 76015
ChEMBL CHEMBL2107387
FDA SRS TKS641KOAY
PubChem 56843850
SureChEMBL SCHEMBL237653
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