| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 5X92116L06 |
| EPA CompTox | DTXSID8028006 |
| InChI Key | PDQMMZXYWKOZHY-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C13H17Cl2N1O1 |
| Molecular Weight | 273.07 |
| AlogP | 3.58 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 20.31 |
| Heavy Atoms | 17.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 40164-69-0 |
| NORMAN SUSDAT | |
| FDA SRS | 5X92116L06 |
| PubChem | 162007 |
| ChemSpider | 142286.0 |