| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | ZPE5W4ED20 |
| EPA CompTox | DTXSID1059600 |
| InChI Key | VOZLLWQPJJSWPR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C14H6Cl1N1O4 |
| Molecular Weight | 287.0 |
| AlogP | 3.02 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 77.28 |
| Heavy Atoms | 20.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 129-40-8 |
| NORMAN SUSDAT | |
| FDA SRS | ZPE5W4ED20 |
| PubChem | 8510 |
| ChemSpider | 8196.0 |