| Molecule Category | Free-form |
| UNII | RK19732OQB |
| EPA CompTox | DTXSID00162273 |
| 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 | OQLZINXFSUDMHM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C2H6N2 |
| Molecular Weight | 58.08 |
| AlogP | -0.78 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 2.0 |
| Polar Surface Area | 49.87 |
| Molecular species | BASE |
| Aromatic Rings | 0.0 |
| Heavy Atoms | 4.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 143-37-3 |
| ChEMBL | CHEMBL2227684 |
| FDA SRS | RK19732OQB |
| PubChem | 67171 |
| SureChEMBL | SCHEMBL48895 |
CONTENTS
