| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 25N42PSV2E |
| EPA CompTox | DTXSID10212697 |
| InChI Key | BBDTZMZYBJMBRW-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H7Cl2N3O2S1 |
| Molecular Weight | 302.96 |
| AlogP | 2.36 |
| Hydrogen Bond Acceptor | 6.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 68.01 |
| Heavy Atoms | 18.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 63308-79-2 |
| NORMAN SUSDAT | |
| FDA SRS | 25N42PSV2E |
| PubChem | 6454579 |
| ChemSpider | 4956890.0 |