| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID101005474 |
Structure
| InChI Key | IVNMWEWWGCVXEY-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H11NOS |
| Molecular Weight | 145.06 |
| AlogP | 1.51 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 21.59 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 85099-02-1 |
| NORMAN SUSDAT | |
| PubChem | 3020343 |
CONTENTS
