| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 4DX8I3D6G6 |
| EPA CompTox | DTXSID5061744 |
Structure
| InChI Key | GMEGXJPUFRVCPX-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H12N2S1 |
| Molecular Weight | 132.07 |
| AlogP | 1.24 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 35.88 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1516-32-1 |
| NORMAN SUSDAT | |
| FDA SRS | 4DX8I3D6G6 |
| PubChem | 1551919 |
| ChemSpider | 1268128.0 |
CONTENTS
