Drgan, V.; Župerl, Š.; Vračko, M.; Como, F.; Novič, M. Robust modelling of acute toxicity towards fathead minnow (Pimephales promelas) using counter-propagation artificial neural networks and genetic algorithm. SAR QSAR Environ. Res. 2016, 27, 501–519.

Compound

	ID:	90
	Name:	2-sec-butyl-4,6-dinitrophenol
	Description:
	Labels:
	CAS:
	InChi Code:	InChI=1S/C10H12N2O5/c1-3-6(2)8-4-7(11(14)15)5-9(10(8)13)12(16)17/h4-6,13H,3H2,1-2H3

Properties

pLC50: 96-h Fathead minnow toxicity as log(1/LC50) [mmol/L]

Value	Source or prediction
2.536	experimental value
1.918	Model.2: Model with 18x18 neurons (Validation set)
1.718	Model.8: Model with 25x25 neurons (Validation set)