thiothixene

Ligand id: 212

Name: thiothixene

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 5
Topological polar surface area 77.54
Molecular weight 443.17
XLogP 3.22
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (1967))
IUPAC Name
(9Z)-N,N-dimethyl-9-[3-(4-methylpiperazin-1-yl)propylidene]thioxanthene-2-sulfonamide
International Nonproprietary Names
INN number INN
2114 tiotixene
Synonyms
Navane®
Database Links
CAS Registry No. 3313-26-6 (source: Scifinder)
ChEMBL Ligand CHEMBL1201
DrugBank Ligand DB01623
GtoPdb PubChem SID 135651260
PubChem CID 941651
Search Google for chemical match using the InChIKey GFBKORZTTCHDGY-UWVJOHFNSA-N
Search Google for chemicals with the same backbone GFBKORZTTCHDGY
Search PubMed clinical trials tiotixene
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Search UniChem for chemical match using the InChIKey GFBKORZTTCHDGY-UWVJOHFNSA-N
Search UniChem for chemicals with the same backbone GFBKORZTTCHDGY
Wikipedia Thiothixene
Comments
Thiothixene is a thioxanthene class typical antipsychotic drug acting principally as a 5-HT2A receptor antagonist.