| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | I103PUS4QR |
| EPA CompTox | DTXSID50205381 |
Structure
| InChI Key | OCVLSHAVSIYKLI-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C3H3N1S2 |
| Molecular Weight | 116.97 |
| AlogP | 1.43 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 12.89 |
| Heavy Atoms | 6.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 82358-09-6 |
| NORMAN SUSDAT | |
| FDA SRS | I103PUS4QR |
| PubChem | 1201387 |
| ChemSpider | 1013197.0 |
CONTENTS
