| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID3071147 |
| InChI Key | NGNAFXRFKWRTKB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C22H18N2O5 |
| Molecular Weight | 390.12 |
| AlogP | 3.02 |
| Hydrogen Bond Acceptor | 7.0 |
| Hydrogen Bond Donor | 5.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 118.89 |
| Heavy Atoms | 29.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 68133-70-0 |
| NORMAN SUSDAT | |
| PubChem | 109547 |
| ChemSpider | 98483.0 |