trihexyphenidyl   Click here for help

GtoPdb Ligand ID: 7315

Synonyms: Artane® | benzhexol
Approved drug
trihexyphenidyl is an approved drug (FDA (1949))
Compound class: Synthetic organic
Comment: Trihexyphenidyl is an antispasmodic, antimuscarinic drug.
Marketed formulations may contain trihexyphenidyl hydrochloride (PubChem CID 66007).
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 23.47
Molecular weight 301.24
XLogP 4.52
No. Lipinski's rules broken 0
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Canonical SMILES OC(c1ccccc1)(C1CCCCC1)CCN1CCCCC1
Isomeric SMILES OC(c1ccccc1)(C1CCCCC1)CCN1CCCCC1
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
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (1949))
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
1318 trihexyphenidyl
Synonyms Click here for help
Artane® | benzhexol
Database Links Click here for help
Specialist databases
GPCRdb Ligand trihexyphenidyl
Other databases
CAS Registry No. 144-11-6
ChEMBL Ligand CHEMBL1490
DrugBank Ligand DB00376
DrugCentral Ligand 2745
GtoPdb PubChem SID 178103888
PubChem CID 5572
Search Google for chemical match using the InChIKey HWHLPVGTWGOCJO-UHFFFAOYSA-N
Search Google for chemicals with the same backbone HWHLPVGTWGOCJO
Search PubMed clinical trials trihexyphenidyl
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UniChem Compound Search for chemical match using the InChIKey HWHLPVGTWGOCJO-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey HWHLPVGTWGOCJO-UHFFFAOYSA-N
Wikipedia Trihexyphenidyl