| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID10947972 |
Structure
| InChI Key | TWLGLYVADVLALB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H5Br2N |
| Molecular Weight | 224.88 |
| AlogP | 2.06 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 23.79 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 25109-76-6 |
| NORMAN SUSDAT | |
| PubChem | 91266 |
CONTENTS
