| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | HPM5AZ39WE |
| EPA CompTox | DTXSID10167931 |
| InChI Key | LZWWZQXBKVZKIP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H6N2O6 |
| Molecular Weight | 226.02 |
| AlogP | 1.51 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 123.58 |
| Heavy Atoms | 16.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 16533-71-4 |
| NORMAN SUSDAT | |
| FDA SRS | HPM5AZ39WE |
| PubChem | 85477 |
| ChemSpider | 77091.0 |