| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | N6S3YL5YW6 |
| EPA CompTox | DTXSID2063212 |
| InChI Key | OKZNPGWYVNZKKZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C16H14N2O4 |
| Molecular Weight | 298.1 |
| AlogP | 1.96 |
| Hydrogen Bond Acceptor | 6.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 98.66 |
| Heavy Atoms | 22.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 3860-63-7 |
| NORMAN SUSDAT | |
| FDA SRS | N6S3YL5YW6 |
| PubChem | 19729 |
| ChemSpider | 18585.0 |