| Synonyms: | |
| Status: | Phase 1 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | OWA98U788S |
Structure
| InChI Key | OTKJDMGTUTTYMP-ROUUACIJSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C18H39NO2 |
| Molecular Weight | 301.52 |
| AlogP | 4.15 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 16.0 |
| Polar Surface Area | 66.48 |
| Molecular species | BASE |
| Aromatic Rings | 0.0 |
| Heavy Atoms | 21.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Enzyme
|
- | - | - | 3000-5000 | - |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Neoplasms | 1 | D009369 | ClinicalTrials |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 15639-50-6 |
| ChEMBL | CHEMBL1442934 |
| DrugBank | DB11924 |
| EPA CompTox | DTXSID9045768 |
| FDA SRS | OWA98U788S |
| PubChem | 3058739 |
| SureChEMBL | SCHEMBL6772 |
| ZINC | ZINC000008214671 |
CONTENTS