| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | NS3RKG8A3U |
| EPA CompTox | DTXSID9063532 |
Structure
| InChI Key | PGFIHORVILKHIA-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H3Br1N2 |
| Molecular Weight | 157.95 |
| AlogP | 1.24 |
| Hydrogen Bond Acceptor | 2.0 |
| Polar Surface Area | 25.78 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 4595-60-2 |
| NORMAN SUSDAT | |
| FDA SRS | NS3RKG8A3U |
| PubChem | 78345 |
| ChemSpider | 70310.0 |
CONTENTS
