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: | 718 | |
|---|---|---|
| Name: | 4,6-dichloro-N-(2-chlorophenyl)-1,2-dihydro-1,3,5-triazin-2-imine | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: Anilazine | |
| Labels: | ||
| CAS: | 101-05-3 | |
| InChi Code: | InChI=1S/C9H5Cl3N4/c10-5-3-1-2-4-6(5)13-9-15-7(11)14-8(12)16-9/h1-4H,(H,13,14,15,16) |
Properties
M2.logKoc: Soil sorption coefficient as log(Koc) i
| Value | Source or prediction |
|---|---|
| 3.24 |
experimental value |
| 3.2044 |
Tab2.Model_2: logKoc (Training set) |