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:	1068
	Name:	3-cyclohexyl-6-(dimethylamino)-1-methyl-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-dione
	Description:	IUPAC names and InChI codes were generated with InstantJChem Original name was: Hexazinone
	Labels:
	CAS:	51235-04-2
	InChi Code:	InChI=1S/C12H20N4O2/c1-14(2)10-13-11(17)16(12(18)15(10)3)9-7-5-4-6-8-9/h9H,4-8H2,1-3H3

Properties

M2.logKoc: Soil sorption coefficient as log(Koc) i

Value	Source or prediction
1.73	experimental value
1.4078	Tab2.Model_2: logKoc (Training set)