| Synonyms | |
| Molecule Category | Free-form |
| UNII | 61G466064D |
| 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 | LCCNCVORNKJIRZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H14NO5PS |
| Molecular Weight | 291.26 |
| AlogP | 2.9 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 115.41 |
| Heavy Atoms | 18.0 |
Cross References
| Resources | Reference |
|---|---|
| ChEMBL | CHEMBL261919 |
| FDA SRS | 61G466064D |
| PDB | WYS |
| PubChem | 991 |
| SureChEMBL | SCHEMBL26857 |
| ZINC | ZINC00896311 |
CONTENTS
