| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID80173246 |
Structure
| InChI Key | VFZRGLKTZAKXCP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H7N3O2S1 |
| Molecular Weight | 233.03 |
| AlogP | 2.54 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 68.92 |
| Heavy Atoms | 16.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 19581-24-9 |
| NORMAN SUSDAT | |
| PubChem | 88157 |
| ChemSpider | 79530.0 |
CONTENTS
