Tulp, I.; Tamm, T.; Karelson, G.; Dobchev, D.; Martin, D.; Tämm, K.; Savchenko, D.; Jänes, J.; Härk, E.; Kreegipuu, A.; Karelson, M. QSAR for algae toxicity of benzene derivatives. Q13-32-0028. Molcode Ltd., 2009.

Compound

	ID:	21
	Name:	anisole
	Description:
	Labels:
	CAS:	100-66-3
	InChi Code:	InChI=1S/C7H8O/c1-8-7-5-3-2-4-6-7/h2-6H,1H3

Properties

pEC50: Algal toxicity as log(1/EC50) [mM]

Value	Source or prediction
-1.09	experimental value
-0.821	QSAR: Model for algal toxicity (Training set)