thioridazine

Ligand id: 100

Name: thioridazine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 4
Topological polar surface area 57.08
Molecular weight 370.15
XLogP 5.63
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (1962))
IUPAC Name
10-[2-(1-methylpiperidin-2-yl)ethyl]-2-methylsulfanylphenothiazine
International Nonproprietary Names
INN number INN
818 thioridazine
Synonyms
Mellaril® | thioridazin | TP-21
Database Links
BindingDB Ligand 50002338
CAS Registry No. 50-52-2 (source: Scifinder)
ChEBI CHEBI:9566
ChEMBL Ligand CHEMBL479
DrugBank Ligand DB00679
PubChem CID 5452
Search Google for chemical match using the InChIKey KLBQZWRITKRQQV-UHFFFAOYSA-N
Search Google for chemicals with the same backbone KLBQZWRITKRQQV
Search PubMed clinical trials thioridazine
Search PubMed titles thioridazine
Search PubMed titles/abstracts thioridazine
Search UniChem for chemical match using the InChIKey KLBQZWRITKRQQV-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone KLBQZWRITKRQQV
Wikipedia Thioridazine
Comments
Marketed formulations may contain thioridazine hydrochloride (PubChem CID 66062).