| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | KI350CS0LZ |
| EPA CompTox | DTXSID70863048 |
Structure
| InChI Key | PPPFFGVGWFKTHX-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H8N2S1 |
| Molecular Weight | 140.04 |
| AlogP | 1.51 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 25.78 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2882-20-4 |
| NORMAN SUSDAT | |
| FDA SRS | KI350CS0LZ |
| PubChem | 76152 |
| ChemSpider | 68636.0 |
CONTENTS
