| Trade Names | |
| Synonyms | |
| Status | |
| Molecule Category | Free-form |
| UNII | T795873AJP |
| EPA CompTox | DTXSID6023606 |
| InChI Key | SIBQAECNSSQUOD-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H14N4O3S |
| Molecular Weight | 294.34 |
| AlogP | 0.65 |
| Hydrogen Bond Acceptor | 6.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 107.08 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 20.0 |
| Resources | Reference |
|---|---|
| ChEBI | 135230 |
| ChEMBL | CHEMBL1201056 |
| DrugBank | DB01298 |
| DrugCentral | 2499 |
| FDA SRS | T795873AJP |
| Human Metabolome Database | HMDB0015412 |
| PharmGKB | PA164754808 |
| PubChem | 5322 |
| SureChEMBL | SCHEMBL49377 |
| ZINC | ZINC000000002092 |