Trade Names
Synonyms
Status
Molecule Category Salt-form
UNII 9E75N4A5HM
EPA CompTox DTXSID8045804
Parent Compound: TRIFLUPROMAZINE

Structure

InChI Key FTNWXGFYRHWUKG-UHFFFAOYSA-N
Smiles CN(C)CCCN1c2ccccc2Sc2ccc(C(F)(F)F)cc21.Cl
InChI
InChI=1S/C18H19F3N2S.ClH/c1-22(2)10-5-11-23-14-6-3-4-7-16(14)24-17-9-8-13(12-15(17)23)18(19,20)21;/h3-4,6-9,12H,5,10-11H2,1-2H3;1H

Physicochemical Descriptors

Property Name Value
Molecular Formula C18H20ClF3N2S
Molecular Weight 388.89
AlogP 5.26
Hydrogen Bond Acceptor 3.0
Number of Rotational Bond 4.0
Polar Surface Area 6.48
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 24.0

Pharmacology

Mechanism of Action Action Reference
Dopamine D2 receptor antagonist ANTAGONIST KEGG Other PubMed PubMed PubMed Wikipedia
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Cricetulus griseus
- - - - 83.79-185.58

Target Conservation

Protein: Dopamine D2 receptor

Description: D(2) dopamine receptor

Organism : Homo sapiens

P14416 ENSG00000149295

Cross References

Resources Reference
ChEBI 9712
ChEMBL CHEMBL1201102
FDA SRS 9E75N4A5HM
Guide to Pharmacology 4330
KEGG D00390
PubChem 66069
SureChEMBL SCHEMBL317144
ZINC ZINC00538507