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: | 159 | |
|---|---|---|
| Name: | N-(4,6-dimethoxy-2,5-dihydro-1,3,5-triazin-2-ylidene)-N'-[2-(2-methoxyethoxy)benzenesulfonyl]carbamimidic acid | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: Cinosulfuron | |
| Labels: | ||
| CAS: | 94593-91-6 | |
| InChi Code: | InChI=1S/C15H19N5O7S/c1-24-8-9-27-10-6-4-5-7-11(10)28(22,23)20-13(21)16-12-17-14(25-2)19-15(18-12)26-3/h4-7H,8-9H2,1-3H3,(H2,16,17,18,19,20,21) |
Properties
M23.pLC50: 96-h Rainbow trout toxicity as log(1/LC50) [-log(mol/L)]
| Value | Source or prediction |
|---|---|
| 3.62 |
experimental value |
| 3.8418 |
Tab2.Model_23: (B)TAZ O. mykiss LC50 (Training set) |