| Trade Names: | |
| Synonyms: | |
| Status: | Approved (1949) |
| Entry Type: | Small molecule |
| Molecule Category: | Salt |
| UNII: | AO61G82577 |
| Parent Compound: | TRIHEXYPHENIDYL |
Structure
| InChI Key | QDWJJTJNXAKQKD-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C20H32ClNO |
| Molecular Weight | 337.94 |
| 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
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Membrane receptor
Family A G protein-coupled receptor
Small molecule receptor (family A GPCR)
Monoamine receptor
Acetylcholine receptor
|
- | 10 | - | - | - | |
|
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC21/SLCO family of organic anion transporting polypeptides
|
- | - | - | - | 74 |
Metabolites
Related Entries
Scaffolds
Adverse Reactions
System Organ Classification (SOC)
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 9721 |
| ChEMBL | CHEMBL1092 |
| EPA CompTox | DTXSID8045802 |
| FDA SRS | AO61G82577 |
| Guide to Pharmacology | 7315 |
| KEGG | C07171 |
| PubChem | 66007 |
| SureChEMBL | SCHEMBL42410 |
| ZINC | ZINC00968274 |
CONTENTS