| Synonyms | |
| Molecule Category | Free-form |
| UNII | WQ92Y2793G |
| 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 | HNYOPLTXPVRDBG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H4N2O3 |
| Molecular Weight | 128.09 |
| AlogP | -1.05 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 2.0 |
| Polar Surface Area | 75.27 |
| Molecular species | ACID |
| Aromatic Rings | 0.0 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| ChEMBL | CHEMBL574699 |
| FDA SRS | WQ92Y2793G |
| PDB | BR8 |
| PubChem | 6211 |
| SureChEMBL | SCHEMBL38707 |
CONTENTS
