| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 43CN9R9NTV |
| EPA CompTox | DTXSID10605020 |
Structure
| InChI Key | ZZXDUGZYDILQMO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H10O1S2 |
| Molecular Weight | 174.02 |
| AlogP | 3.27 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 13.14 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 61197-06-6 |
| NORMAN SUSDAT | |
| FDA SRS | 43CN9R9NTV |
CONTENTS
