| Synonyms: | |
| Status: | Phase 3 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | S846B891OR |
Structure
| InChI Key | RGOVYLWUIBMPGK-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C17H27NO3 |
| Molecular Weight | 293.41 |
| AlogP | 3.77 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 10.0 |
| Polar Surface Area | 58.56 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 21.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Ion channel
Voltage-gated ion channel
Transient receptor potential channel
|
550-550 | - | - | 1223 | - |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Low Back Pain | 3 | D017116 | ClinicalTrials |
Related Entries
MCS
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2444-46-4 |
| ChEBI | 46936 |
| ChEMBL | CHEMBL75124 |
| DrugBank | DB11324 |
| EPA CompTox | DTXSID1034769 |
| FDA SRS | S846B891OR |
| Human Metabolome Database | HMDB0029846 |
| PubChem | 2998 |
| SureChEMBL | SCHEMBL81939 |
| ZINC | ZINC000001697652 |
CONTENTS