trifluoperazine   Click here for help

GtoPdb Ligand ID: 214

Synonyms: Eskazinyl® | Stelazine® | trifluoperazine hydrochloride
Approved drug PDB Ligand
trifluoperazine is an approved drug (FDA (1959))
Compound class: Synthetic organic
Comment: Trifluoperazine is a phenothiazine class typical antipsychotic drug, acting principally as a dopamine D2 receptor antagonist.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 5
Topological polar surface area 35.02
Molecular weight 407.16
XLogP 4.87
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F
Isomeric SMILES CN1CCN(CC1)CCCN1c2ccccc2Sc2c1cc(cc2)C(F)(F)F
InChI InChI=1S/C21H24F3N3S/c1-25-11-13-26(14-12-25)9-4-10-27-17-5-2-3-6-19(17)28-20-8-7-16(15-18(20)27)21(22,23)24/h2-3,5-8,15H,4,9-14H2,1H3
InChI Key ZEWQUBUPAILYHI-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (1959))
IUPAC Name Click here for help
10-[3-(4-methylpiperazin-1-yl)propyl]-2-(trifluoromethyl)phenothiazine
International Nonproprietary Names Click here for help
INN number INN
718 trifluoperazine
Synonyms Click here for help
Eskazinyl® | Stelazine® | trifluoperazine hydrochloride
Database Links Click here for help
BindingDB Ligand 50001886
CAS Registry No. 117-89-5 (source: Scifinder)
ChEBI CHEBI:45951
ChEMBL Ligand CHEMBL422
DrugBank Ligand DB00831
DrugCentral Ligand 2740
GtoPdb PubChem SID 135651279
PubChem CID 5566
RCSB PDB Ligand TFP
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Wikipedia Trifluoperazine