Gramatica, P.; Cassani, S.; Chirico, N. QSARINS-chem: Insubria datasets and new QSAR/QSPR models for environmental pollutants in QSARINS. J. Comput. Chem. 2014, 35, 1036–1044.
Compound
| ID: | 74 | |
|---|---|---|
| Name: | N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: Diflufenican | |
| Labels: | ||
| CAS: | 83164-33-4 | |
| InChi Code: | InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27) |
Properties
M22.pEC50: Daphnia toxicity as log(1/EC50) [-log(mol/L)]
| Value | Source or prediction |
|---|---|
| 6.22 |
experimental value |
| 5.8792 |
Tab2.Model_22: (B)TAZ D.magna EC50 (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID4041494 | US EPA CompTox Dashboard |