TRIHEXYPHENIDYL

Search structure
Synonyms:
Status: Approved (1949)
Entry Type: Small molecule
Molecule Category: Parent
ATC: N04AA01
UNII: 6RC5V8B7PO

Structure
InChI Key HWHLPVGTWGOCJO-UHFFFAOYSA-N
Smile OC(CCN1CCCCC1)(c1ccccc1)C1CCCCC1
InChI
InChI=1S/C20H31NO/c22-20(18-10-4-1-5-11-18,19-12-6-2-7-13-19)14-17-21-15-8-3-9-16-21/h1,4-5,10-11,19,22H,2-3,6-9,12-17H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C20H31NO
Molecular Weight 301.47
AlogP 4.33
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 5.0
Polar Surface Area 23.47
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 22.0

Pharmacology

Primary Target
M1 receptor
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC22 family of organic cation and anion transporters
- - - - 79

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Dystonic Disorders 2 D020821 ClinicalTrials

Related Entries

Scaffolds

Salt

Cross References

Resources Reference
CAS NUMBER 144-11-6
ChEBI 9720
ChEMBL CHEMBL1490
DrugBank DB00376
DrugCentral 2745
EPA CompTox DTXSID4023705
FDA SRS 6RC5V8B7PO
Human Metabolome Database HMDB0014520
Guide to Pharmacology 7315
KEGG C07171
PharmGKB PA164747026
PubChem 5572
SureChEMBL SCHEMBL34645
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