10967/143 - QDB Compounds

QsarDB Repository

Schultz, T.W.; Carlson, R.E.; Cronin, M.T.D.; Hermens, J.L.M.; Johnson, R.; O’Brien, P.J.; Roberts, D.W.; Siraki, A.; Wallace, K.B.; Veith, G.D. A conceptual framework for predicting the toxicity of reactive chemicals: modeling soft electrophilicity. SAR QSAR Environ. Res. 2006, 17, 413–428.

Compound

ID:5
Name:4-Vinylpyridine
Description:
Labels:Training
CAS:100-43-6
InChi Code:InChI=1S/C7H7N/c1-2-7-3-5-8-6-4-7/h2-6H,1H2

Properties

logRD50: Respiratory sensitisation as logarithm of toxicity

ValueSource or prediction
1.22

experimental value

0.92834

Tbl.4: Michael acceptors as respiratory irritants (Training set)

Links to External Resources