FLUPHENAZINE

Search structure
Synonyms:
Status: Approved (1959)
Entry Type: Small molecule
Molecule Category: Parent
ATC: N05AB02
UNII: S79426A41Z

Structure
InChI Key PLDUPXSUYLZYBN-UHFFFAOYSA-N
Smile OCCN1CCN(CCCN2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1
InChI
InChI=1S/C22H26F3N3OS/c23-22(24,25)17-6-7-21-19(16-17)28(18-4-1-2-5-20(18)30-21)9-3-8-26-10-12-27(13-11-26)14-15-29/h1-2,4-7,16,29H,3,8-15H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C22H26F3N3OS
Molecular Weight 437.53
AlogP 4.31
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 6.0
Polar Surface Area 29.95
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 30.0

Pharmacology

Primary Target
D2 receptor
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Hydrolase
- 15000 - - -
Enzyme Lyase
- 80 - - -
Enzyme Oxidoreductase
- 73700 - 21200 -
Enzyme
- 15000 - 21200 -
Ion channel Voltage-gated ion channel Potassium channels Two-pore domain potassium channel
- 4700 - - -
Ion channel Voltage-gated ion channel Voltage-gated sodium channel
- 3700 - - 73
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Dopamine receptor
- - - 1 -
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Histamine receptor
- - - 40 -
Transcription factor Nuclear receptor Nuclear hormone receptor subfamily 3 Nuclear hormone receptor subfamily 3 group C Nuclear hormone receptor subfamily 3 group C member 4
- - - 800 -
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC22 family of organic cation and anion transporters
- - - - 62
Transporter Electrochemical transporter
- - - - 62
Transporter Primary active transporter ATP-binding cassette ABCB subfamily
- 25820 - - -
Transporter Primary active transporter P-type ATPase Calcium ATPase
- 15000 - - -
Transporter
- 15000 - - 62

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Schizophrenia 3 D012559 ClinicalTrials

Related Entries

MCS

Scaffolds

Salt
Salt

Cross References

Resources Reference
CAS NUMBER 69-23-8
ChEBI 5123
ChEMBL CHEMBL726
DrugBank DB00623
DrugCentral 1212
EPA CompTox DTXSID2023068
FDA SRS S79426A41Z
Human Metabolome Database HMDB0014761
Guide to Pharmacology 204
KEGG C07010
PharmGKB PA449676
PubChem 3372
SureChEMBL SCHEMBL19221
ZINC ZINC000019203912
CONTENTS