| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | FRM8GDW64Z |
| EPA CompTox | DTXSID8067315 |
Structure
| InChI Key | JXQGICFGPUAVLJ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H6N2S1 |
| Molecular Weight | 114.03 |
| AlogP | 1.15 |
| Hydrogen Bond Acceptor | 3.0 |
| Polar Surface Area | 25.78 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 27464-82-0 |
| NORMAN SUSDAT | |
| FDA SRS | FRM8GDW64Z |
| PubChem | 96922 |
| ChemSpider | 87514.0 |
CONTENTS
