10967/170 - QDB Compounds

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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:089427-31-6
Name:5-Methyl-4,6,7-trifluoro-2-(trifluoromethyl)benzimidazole
Description:
Labels:
CAS:89427-31-6
InChi Code:InChI=1/C9H4F6N2/c1-2-3(10)5(12)7-6(4(2)11)16-8(17-7)9(13,14)15/h1H3,(H,16,17)/f/h16H

Properties

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

ValueSource or prediction
4.81

experimental value

5.020372

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

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