| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | LK5QE26HRU |
| EPA CompTox | DTXSID6059520 |
| InChI Key | WLJSUJOESWTGEX-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H9Cl2N1O1 |
| Molecular Weight | 253.01 |
| AlogP | 4.37 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 35.25 |
| Heavy Atoms | 16.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 121-27-7 |
| NORMAN SUSDAT | |
| FDA SRS | LK5QE26HRU |
| PubChem | 67135 |
| ChemSpider | 60482.0 |