10967/219 - QDB Compounds

QsarDB Repository

Pavan, M.; Worth, A.; Netzeva, T. Preliminary analysis of an aquatic toxicity dataset and assessment of QSAR models for narcosis. EUR 21749 EN. European Commission, Joint Research Centre, 2005.

Compound

ID:S116
Name:2-Naphthalenol
Description:
Labels:Polar
CAS:135-19-3
InChi Code:InChI=1S/C10H8O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7,11H

Properties

logLC50: 96-h Fathead minnow toxicity as logLC50 [log(mol/L)]

ValueSource or prediction
-4.62

experimental value

-4.1

QSAR2: Polar narcosis model (Test set)

-3.92

QSAR3: Narcosis model (Test set)