| Synonyms: | |
| Status: | Approved |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| ATC: | G03XA02 |
| UNII: | 1421533RCM |
Structure
| InChI Key | BJJXHLWLUDYTGC-ANULTFPQSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C21H24O2 |
| Molecular Weight | 308.42 |
| AlogP | 3.72 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 37.3 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 0.0 |
| Heavy Atoms | 23.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Secreted protein
|
- | - | 8 | - | - |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 89642 |
| ChEMBL | CHEMBL1868702 |
| DrugBank | DB11619 |
| DrugCentral | 1292 |
| EPA CompTox | DTXSID4023094 |
| FDA SRS | 1421533RCM |
| Human Metabolome Database | HMDB0002720 |
| PubChem | 27812 |
| SureChEMBL | SCHEMBL217651 |
| ZINC | ZINC000003938633 |
CONTENTS