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:	105
	Name:	1,2,4-triazolidine-3,5-diimine
	Description:	IUPAC names and InChI codes were generated with InstantJChem Original name was: Guanazole
	Labels:
	CAS:	1455-77-2
	InChi Code:	InChI=1S/C2H5N5/c3-1-5-2(4)7-6-1/h(H5,3,4,5,6,7)

Properties

M17.logKow: The octanol-water partition coefficient as log(Kow)

Value	Source or prediction
-1.61	experimental value
-1.1406	Tab2.Model_17: (B)TAZ logKow (Training set)

M18.MP: Melting point [°C]

Value	Source or prediction
205	experimental value
183.3436	Tab2.Model_18: (B)TAZ melting point (Training set)