| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID0066533 |
| InChI Key | CLJIGLPOBRSBNU-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C4H3Br1N2O1 |
| Molecular Weight | 173.94 |
| AlogP | 0.94 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 46.01 |
| Heavy Atoms | 8.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 19808-30-1 |
| NORMAN SUSDAT | |
| PubChem | 88256 |
| ChemSpider | 79617.0 |