10967/170 - QDB Compounds

QsarDB Repository

Bhhatarai, B.; Gramatica, P. Oral LD50 toxicity modeling and prediction of per- and polyfluorinated chemicals on rat and mouse. Mol. Diversity 2010, 15, 467–476.

Compound

ID:089427-09-8
Name:2,4-Bis(trifluoromethyl)-6-chlorobenzimidazole
Description:
Labels:
CAS:89427-09-8
InChi Code:InChI=1/C9H3ClF6N2/c10-3-1-4(8(11,12)13)6-5(2-3)17-7(18-6)9(14,15)16/h1-2H,(H,17,18)/f/h17H

Properties

pLD50rat: Rat oral toxicity as log(1/LD50) [-log(mmol/kg)]

ValueSource or prediction
5.24

experimental value

5.260163

Eq2: model for 50 polyflourinated compounds for rat oral toxicity (train)

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