| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID10233842 |
| InChI Key | DLXYWZMHUVVOFZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C14H11Cl1N2O3 |
| Molecular Weight | 290.05 |
| AlogP | 3.93 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 63.45 |
| Heavy Atoms | 20.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 84803-52-1 |
| NORMAN SUSDAT | |
| PubChem | 5743865 |
| ChemSpider | 4675546.0 |