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: | 907 | |
|---|---|---|
| Name: | 4-chloro-N,N-diethyl-6-(ethylimino)-1,6-dihydro-1,3,5-triazin-2-amine | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: Trietazine | |
| Labels: | ||
| CAS: | 1912-26-1 | |
| InChi Code: | InChI=1S/C9H16ClN5/c1-4-11-8-12-7(10)13-9(14-8)15(5-2)6-3/h4-6H2,1-3H3,(H,11,12,13,14) |
Properties
M2.logKoc: Soil sorption coefficient as log(Koc) i
| Value | Source or prediction |
|---|---|
| 2.77 |
experimental value |
| 2.5084 |
Tab2.Model_2: logKoc (Training set) |