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:	6
	Name:	1,1-diphenyl-2-propyn-1-ol
	Description:
	Labels:
	CAS:
	InChi Code:	InChI=1S/C15H12O/c1-2-15(16,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h1,3-12,16H

Properties

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

Value	Source or prediction
1.273	experimental value
2.117	Model.2: Model with 18x18 neurons (Validation set)
1.164	Model.8: Model with 25x25 neurons (Validation set)