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: | 1470 | |
|---|---|---|
| Name: | (2,6-dichloro-4-methylphenoxy)-dimethoxy-sulfanylidenephosphorane | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: Tolclofos-methyl | |
| Labels: | ||
| CAS: | 57018-04-9 | |
| InChi Code: | InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3 |
Properties
M5.logHLn: Biotransformation half-lives in fish
| Value | Source or prediction |
|---|---|
| -0.109174539 |
experimental value |
| 0.842 |
Tab2.Model_5: Metab. biotransf. fish (Training set) |