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: | 1011 | |
|---|---|---|
| Name: | N'-(3-chloro-4-methoxyphenyl)-N,N-dimethylcarbamimidic acid | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: Metoxuron | |
| Labels: | ||
| CAS: | 19937-59-8 | |
| InChi Code: | InChI=1S/C10H13ClN2O2/c1-13(2)10(14)12-7-4-5-9(15-3)8(11)6-7/h4-6H,1-3H3,(H,12,14) |
Properties
M2.logKoc: Soil sorption coefficient as log(Koc) i
| Value | Source or prediction |
|---|---|
| 1.72 |
experimental value |
| 2.3148 |
Tab2.Model_2: logKoc (Training set) |