| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 79XTL2H0HR |
| EPA CompTox | DTXSID9064211 |
| InChI Key | XVNBMCIQCILWHP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H12Cl3N3O3 |
| Molecular Weight | 314.99 |
| AlogP | -0.11 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 66.0 |
| Heavy Atoms | 18.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 6299-37-2 |
| NORMAN SUSDAT | |
| FDA SRS | 79XTL2H0HR |
| PubChem | 80532 |
| ChemSpider | 72731.0 |