| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID80576394 |
| InChI Key | KSXLHOFDCDKQLH-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C25H21N3O3 |
| Molecular Weight | 411.16 |
| AlogP | 4.81 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 77.14 |
| Heavy Atoms | 31.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 139481-44-0 |
| NORMAN SUSDAT | |
| PubChem | 15654674 |
| ChemSpider | 10798472.0 |