10967/81 - QDB Compounds

QsarDB Repository

Netzeva, T.I.; Aptula, A.O.; Chaudary, S.H.; Duffy, J.C.; Schultz, T.W.; Schüürmann, G.; Cronin, M.T.D. Structure-Activity Relationships for the Toxicity of Substituted Poly-hydroxylated Benzenes to Tetrahymena pyriformis: Influence of Free Radical Formation. QSAR Comb. Sci. 2003, 22, 6, 575–582.

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

IDNamepIGC50Details
1Hydroquinone0.473View
2Methylhydroquinone1.858View
32,3-dimethylhydroquinone1.413View
4Trimethylhydroquinone1.342View
5Tetramethylhydroquinone1.281View
6Methoxyhydroquinone2.202View
7Phenylhydroquinone2.005View
8Chlorohydroquinone1.262View
9Bromohydroquinone1.678View
10Tetrafluorohydroquinone1.844View
11Tetrachlorohydroquinone2.109View
12Catechol0.752View
13Resorscinol-0.652View
141,3,5-trihydroxybenzene-1.264View
151,2,4-trihydroxybenzene0.439View
161,2,3-trihydroxybenzene0.850View
175-methylresorcinol-0.389View
185-pentylresorcinol1.306View
194-hexylresorcinol1.798View
202-nitroresorcinol0.658View
214-chlororesorcinol0.125View
224,6-dichlororesorcinol0.967View
232,4,6-tribromoresorcinol1.060View
243-methylcatechol0.280View
254-methylcatechol0.368View
263,5-di(tert)butylcatechol2.109View
274-nitrocatechol1.170View
284-chlorocatechol1.061View
29Tetrachlorocatechol1.697View
30Tetrabromocatechol0.984View

Bibliography

  1. Netzeva, T. I.; Aptula, A. O.; Chaudary, S. H.; Duffy, J. C.; Schultz, T. W.; Schüürmann, G.; Cronin, M. T. D. Structure-Activity Relationships for the Toxicity of Substituted Poly-hydroxylated Benzenes to Tetrahymena pyriformis: Influence of Free Radical Formation. QSAR Comb. Sci. 2003, 22, 575–582. http://dx.doi.org/10.1002/qsar.200330816

  2. Schultz, T. W. TETRATOX: Tetrahymena pyriformis population growth impairment endpoint - a surrogate for fish lethality. Toxicol. Mech. Meth. 1997, 7, 289–309. http://dx.doi.org/10.1080/105172397243079