| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 3C7AG4U84M |
| EPA CompTox | DTXSID20216641 |
| InChI Key | LKOZHLXUWUBRDK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H5N1O5 |
| Molecular Weight | 243.02 |
| AlogP | 2.06 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 86.51 |
| Heavy Atoms | 18.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 6642-29-1 |
| NORMAN SUSDAT | |
| FDA SRS | 3C7AG4U84M |
| PubChem | 81150 |
| ChemSpider | 73216.0 |