| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 8D4U6AC82L |
| EPA CompTox | DTXSID50199690 |
| InChI Key | PEKGWSOIIJWWKO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C14H7N1O1S1 |
| Molecular Weight | 237.02 |
| AlogP | 3.29 |
| Hydrogen Bond Acceptor | 3.0 |
| Polar Surface Area | 40.86 |
| Heavy Atoms | 17.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 51762-90-4 |
| NORMAN SUSDAT | |
| FDA SRS | 8D4U6AC82L |
| PubChem | 103956 |
| ChemSpider | 93856.0 |