| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID30316363 |
| InChI Key | SSNKVURLRWLXES-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H7N3S2 |
| Molecular Weight | 233.01 |
| AlogP | 2.72 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 54.74 |
| Heavy Atoms | 15.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 13251-19-9 |
| NORMAN SUSDAT | |
| PubChem | 327473 |
| ChemSpider | 290012.0 |