| Synonyms | |
| Molecule Category | Free-form |
| UNII | 7O50LKL2G8 |
| 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 | KIWUVOGUEXMXSV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C3H3NOS2 |
| Molecular Weight | 133.19 |
| AlogP | 0.94 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 86.49 |
| Molecular species | ACID |
| Aromatic Rings | 0.0 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| ChEMBL | CHEMBL224633 |
| FDA SRS | 7O50LKL2G8 |
| PubChem | 1201546 |
| SureChEMBL | SCHEMBL55625 |
| ZINC | ZINC03875936 |
CONTENTS
