| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 6D1R3P86GX |
| EPA CompTox | DTXSID3046532 |
Structure
| InChI Key | OMWQUXGVXQELIX-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H4N2S2 |
| Molecular Weight | 191.98 |
| AlogP | 3.16 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 24.72 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 4044-65-9 |
| NORMAN SUSDAT | |
| FDA SRS | 6D1R3P86GX |
| PubChem | 19958 |
| ChemSpider | 18799.0 |
CONTENTS
