| Synonyms | |
| Molecule Category | Free-form |
| UNII | 9H154DI0UP |
| Source | Gaulton A, Kale N, van Westen GJ, Bellis LJ, Bento AP, Davies M, Hersey A, Papadatos G, Forster M, Wege P, Overington JP. A large-scale crop protection bioassay data set. Sci Data. 2015 Jul 7;2:150032. Read more ... |
Structure
| InChI Key | PLUBXMRUUVWRLT-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C3H8O3S |
| Molecular Weight | 124.16 |
| AlogP | -0.03 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 51.75 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 62-50-0 |
| ChEMBL | CHEMBL338686 |
| FDA SRS | 9H154DI0UP |
| PubChem | 6113 |
| SureChEMBL | SCHEMBL2296 |
| ZINC | ZINC01634140 |
CONTENTS
