10967/85 - QDB Compounds

QsarDB Repository

Dearden, J.C.; Cronin, M.T.D.; Schultz, T.W.; Lin, D.T. QSAR Study of the Toxicity of Nitrobenzenes to Tetrahymena pyriformis. QSAR Comb. Sci. 1995, 14, 5, 427–432.

47 compounds | Property pIGC50: 48-h Tetrahymena toxicity as log(1/IGC50) [log(L/mmol)]

IDNamepIGC50Details
1H0.350View
22-NH20.077View
32-OH0.770View
42-CH30.479View
52-Cl0.676View
62-Br0.863View
72-CN1.076View
82-CH2OH-0.155View
92-COOH-1.637View
102-C6H51.301View
112-CONH2-0.721View
122-CHO0.174View
132-NO21.252View
143-NH20.026View
153-OH0.506View
163-CH30.572View
173-Cl0.836View
183-Br1.215View
193-CN0.451View
203-CH2OH-0.220View
213-COOH-1.089View
223-C6H51.569View
233-CONH2-0.193View
243-CHO0.140View
253-NO20.762View
263-OCH30.670View
273-COCH30.317View
284-CH30.796View
294-C2H50.804View
304-OCH30.544View
314-OC2H50.829View
324-OC4H91.420View
334-F0.253View
344-Cl0.559View
354-Br0.461View
364-CN0.569View
374-CH2CN0.132View
384-CH2Cl1.180View
394-CH=NOH0.678View
404-NHC6H51.886View
414-CH2OH0.101View
424-COOH-0.862View
434-COOCH30.398View
444-COOC2H50.710View
454-CONH20.179View
464-CHO0.203View
474-NO21.301View

Bibliography

  1. Dearden, J. C.; Cronin, M. T. D.; Schultz, T. W.; Lin, D. T. QSAR Study of the Toxicity of Nitrobenzenes to Tetrahymena pyriformis. QSAR Comb. Sci. 1995, 14, 427–432. http://dx.doi.org/10.1002/qsar.19950140503

  2. Schultz, T. W.; Lin, D. T.; Wilke, T. S.; Arnold, L. M. Quantitative structure-activity relationships for the Tetrahymena pyriformis population growth endpoint: a mechanism of action approach. In Practical Applications of Quantitative Structure-Activity Relationships (QSAR) in Environmental Chemistry and Toxicology; Karcher, W.; Devillers, J., Eds.; Joint Research Centre; 1990.