| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | N6DJ47VN3L |
| EPA CompTox | DTXSID70193998 |
Structure
| InChI Key | PVGHNTXQMCYYGF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C2H3N3S1 |
| Molecular Weight | 101.0 |
| AlogP | 0.12 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 51.8 |
| Heavy Atoms | 6.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 4100-41-8 |
| NORMAN SUSDAT | |
| FDA SRS | N6DJ47VN3L |
| PubChem | 77736 |
| ChemSpider | 70136.0 |
CONTENTS
