10967/76 - QDB Compounds

QsarDB Repository

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:442
Name:Ethyl sulfone
Description:InChI code was generated with Jchem for Excel
Labels:Sulfone
CAS:597-35-3
InChi Code:InChI=1S/C4H10O2S/c1-3-7(5,6)4-2/h3-4H2,1-2H3

Properties

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

ValueSource or prediction
-1.84

experimental value

-2.47

Eq2: Saturated alcohols and ketones (Test set)