10967/221 - QDB Compounds

QsarDB Repository

Bajot, F.; Cronin, M. Polar narcosis QSAR for fathead minnow acute toxicity. Q17-33-0032. Liverpool John Moores University, 2009.

Compound

ID:26
Name:4-Butylaniline
Description:
Labels:
CAS:104-13-2
InChi Code:InChI=1S/C10H15N/c1-2-3-4-9-5-7-10(11)8-6-9/h5-8H,2-4,11H2,1H3

Properties

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

ValueSource or prediction
-1.83

experimental value

-1.58

QSAR: Polar narcosis (Training set)