| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID60198114 |
| InChI Key | DFOHHQRGDOQMKG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C5H5Cl1N2S1 |
| Molecular Weight | 159.99 |
| AlogP | 1.85 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 25.78 |
| Heavy Atoms | 9.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 49844-90-8 |
| NORMAN SUSDAT | |
| PubChem | 97113 |
| ChemSpider | 87661.0 |