| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | K6GTB9PD9U |
| EPA CompTox | DTXSID3062609 |
Structure
| InChI Key | DZFKAXLNKZXNHD-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H4N2S1 |
| Molecular Weight | 160.01 |
| AlogP | 2.29 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 36.15 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2719-32-6 |
| NORMAN SUSDAT | |
| FDA SRS | K6GTB9PD9U |
| PubChem | 17626 |
| ChemSpider | 16660.0 |
CONTENTS
