| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | XMN8H2XE9H |
| EPA CompTox | DTXSID9060819 |
| InChI Key | NYPYPOZNGOXYSU-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C5H4Br1N1 |
| Molecular Weight | 156.95 |
| AlogP | 1.84 |
| Hydrogen Bond Acceptor | 1.0 |
| Polar Surface Area | 12.89 |
| Heavy Atoms | 7.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 626-55-1 |
| NORMAN SUSDAT | |
| FDA SRS | XMN8H2XE9H |
| PubChem | 12286 |
| ChemSpider | 7685.0 |