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:	906
	Name:	4-chloro-N-ethyl-6-(ethylimino)-N-(propan-2-yl)-1,6-dihydro-1,3,5-triazin-2-amine
	Description:	IUPAC names and InChI codes were generated with InstantJChem Original name was: Ipazine
	Labels:
	CAS:	1912-25-0
	InChi Code:	InChI=1S/C10H18ClN5/c1-5-12-9-13-8(11)14-10(15-9)16(6-2)7(3)4/h7H,5-6H2,1-4H3,(H,12,13,14,15)

Properties

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

Value	Source or prediction
3.07	experimental value
2.725	Tab2.Model_2: logKoc (Training set)