| Synonyms: | |
| Status: | Approved (1979) |
| Entry Type: | Small molecule |
| Molecule Category: | Parent |
| ATC: | N02AF02 |
| UNII: | L2T84IQI2K |
Structure
| InChI Key | NETZHAKZCGBWSS-CEDHKZHLSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C21H27NO4 |
| Molecular Weight | 357.45 |
| AlogP | 1.71 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 73.16 |
| Molecular species | BASE |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 26.0 |
Pharmacology
| Primary Target | |
|---|---|
| δ receptor | |
| κ receptor | |
| μ receptor |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Membrane receptor
Family A G protein-coupled receptor
Peptide receptor (family A GPCR)
Short peptide receptor (family A GPCR)
Opioid receptor
|
27-250 | 1-110 | - | 1-2 | - | |
|
Unclassified protein
|
- | - | - | - | 98-102 |
Indications
Related Entries
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 20594-83-6 |
| ChEBI | 7454 |
| ChEMBL | CHEMBL895 |
| DrugBank | DB00844 |
| DrugCentral | 1874 |
| EPA CompTox | DTXSID8023345 |
| FDA SRS | L2T84IQI2K |
| Human Metabolome Database | HMDB0014982 |
| Guide to Pharmacology | 1663 |
| KEGG | C07251 |
| PubChem | 5311304 |
| SureChEMBL | SCHEMBL3766 |
| ZINC | ZINC000003812989 |
CONTENTS