vortioxetine

Ligand id: 7351

Name: vortioxetine

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 40.57
Molecular weight 298.15
XLogP 4.66
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA and EMA (2013))
IUPAC Name
1-{2-[(2,4-dimethylphenyl)sulfanyl]phenyl}piperazine
International Nonproprietary Names
INN number INN
9279 vortioxetine
Synonyms
Brintellix® (discontinued brand name) | Lu AA21004 | Trintellix®
Database Links
CAS Registry No. 508233-74-7 (source: Scifinder)
ChEMBL Ligand CHEMBL2104993
GtoPdb PubChem SID 178103923
PubChem CID 9966051
Search Google for chemical match using the InChIKey YQNWZWMKLDQSAC-UHFFFAOYSA-N
Search Google for chemicals with the same backbone YQNWZWMKLDQSAC
Search PubMed clinical trials vortioxetine
Search PubMed titles vortioxetine
Search PubMed titles/abstracts vortioxetine
Search UniChem for chemical match using the InChIKey YQNWZWMKLDQSAC-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone YQNWZWMKLDQSAC
Wikipedia Vortioxetine
Comments
Vortioxetine is a novel atypical antidepressant.