| Synonyms: | |
| Status: | Approved (1959) |
| Entry Type: | Small molecule |
| Molecule Category: | Parent |
| ATC: | N02AA11 |
| UNII: | 9VXA968E0C |
Structure
| InChI Key | UQCNKQCJZOAFTQ-ISWURRPUSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C17H19NO4 |
| Molecular Weight | 301.34 |
| AlogP | 0.75 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 0.0 |
| Polar Surface Area | 70.0 |
| Molecular species | NEUTRAL |
| 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
Peptide receptor (family A GPCR)
Short peptide receptor (family A GPCR)
Opioid receptor
|
1 | 0-0 | - | 1-26 | - |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Chronic Pain | 3 | D059350 | ClinicalTrials |
Related Entries
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 76-41-5 |
| ChEBI | 7865 |
| ChEMBL | CHEMBL963 |
| DrugBank | DB01192 |
| DrugCentral | 2034 |
| EPA CompTox | DTXSID5023409 |
| FDA SRS | 9VXA968E0C |
| Human Metabolome Database | HMDB0015323 |
| Guide to Pharmacology | 7094 |
| KEGG | C08019 |
| PubChem | 5284604 |
| SureChEMBL | SCHEMBL3571 |
| ZINC | ZINC000003875483 |
CONTENTS