| Synonyms: | |
| Status: | Approved (2012) |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | 6W15Z5R0RU |
Structure
| InChI Key | YNDIAUKFXKEXSV-CRYLGTRXSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C20H25FN2O3 |
| Molecular Weight | 359.43 |
| AlogP | 3.68 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 12.0 |
| Polar Surface Area | 52.61 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 26.0 |
Pharmacology
| Action | Mechanism of Action | Reference |
|---|---|---|
| None | Diagnostic agent | DailyMed |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Membrane receptor
|
- | - | - | 3-3 | - |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Alzheimer Disease | 4 | D000544 | ClinicalTrials |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 66880 |
| ChEMBL | CHEMBL1774461 |
| DrugBank | DB09149 |
| DrugCentral | 4285 |
| EPA CompTox | DTXSID80241898 |
| FDA SRS | 6W15Z5R0RU |
| Guide to Pharmacology | 7344 |
| SureChEMBL | SCHEMBL14826096 |
| ZINC | ZINC000100090643 |
CONTENTS