| Synonyms: | |
| Status: | Approved |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| ATC: | N02AC03 |
| UNII: | 4RP92LYZ2F |
Structure
| InChI Key | IHEHEFLXQFOQJO-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C27H34N4O |
| Molecular Weight | 430.6 |
| AlogP | 3.69 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 73.36 |
| Molecular species | BASE |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 32.0 |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Pain | 3 | D010146 | ClinicalTrials |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 302-41-0 |
| ChEBI | 135699 |
| ChEMBL | CHEMBL559288 |
| DrugBank | DB12492 |
| DrugCentral | 3478 |
| EPA CompTox | DTXSID00184293 |
| FDA SRS | 4RP92LYZ2F |
| Human Metabolome Database | HMDB0041990 |
| PubChem | 9331 |
| SureChEMBL | SCHEMBL26151 |
| ZINC | ZINC000000538198 |
CONTENTS