10967/76 - QDB Compounds

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Ellison, C.M.; Cronin, M.T.D.; Madden, J.C.; Schultz, T.W. Definition of the structural domain of the baseline non-polar narcosis model for Tetrahymena pyriformis. SAR QSAR Environ. Res. 2008, 19, 7-8, 751–783.

Compound

ID:458
Name:2-Chlorothiophene
Description:InChI code was generated with Jchem for Excel
Labels:Thiophene
CAS:96-43-5
InChi Code:InChI=1S/C4H3ClS/c5-4-2-1-3-6-4/h1-3H

Properties

pIGC50: 40-h Tetrahymena toxicity as log(1/IGC50) [log(L/mmol)]

ValueSource or prediction
-0.59

experimental value

-0.03

Eq2: Saturated alcohols and ketones (Test set)

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