10967/33 - QDB Compounds

QsarDB Repository

Seward, J.R.; Sinks, G.D.; Schultz, T.W. Reproducibility of toxicity across mode of toxic action in the Tetrahymena population growth impairment assay. Aquat. Toxicol. 2001, 53, 1, 33–47.

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

IDNamepIGC50RefDetails
13,7-dimethyl-3-octanol0.3369View
2Methyl nonanoate0.9623View
3Ethyl acetate-1.2968[1]View
4Ethyl alcohol-1.9912[2]View
55-octyn-3-ol-0.3759View
6Octylamine0.3252[3]View
7Pentachloro-phenol2.0327[4]View
82-dodecanone1.6701[5]View
93-butyn-1-ol-1.8390[6]View
104-bromopyridine(HCl)-0.5593[7]View
11Benzoic acid-0.2956[8]View
121,4-butanediol-2.2365View
132-methyl-5-octyn-4-ol0.4011View
142,3,5,6-tetrachloro-4-pyridinethiol1.3724View
15Phenol-0.3533View
16Dimethylsulfoxide-2.4911[9]View
174-n-amylphenol1.5841View
182-butyn-1-ol-1.4348[10]View
191,10-decanediol0.2240View
20Dimethyl succinate-1.0573[11]View
212-methyl-1-naphthol1.2493View
22Isopropylamine-0.8795[12]View
23Dimethyl suberate0.2962[11]View
24Acetaldoxime-0.8905View
256-chloro-2-pyridinol-0.2851[13]View
263-hydroxypyridine-0.8005View
274(tert)butyl-2,6-dinitrophenol1.8020[14]View
28Ethyl-2-hexynoate0.6998View
293-phenyl-2-propyn-1-ol0.0746[10]View
30Malonamide-2.1464View
313,5-dinitrophenol1.3860View
32Tetrachloro-1,4-benzoquinone1.1982[15]View
333-hexyn-2-ol0.6159View
34Tetrachlorohydroquinone2.1087[16]View
35(+/−)-β-butyrolactone-0.7588[17]View
362-butyn-1,4-diol-1.1932[10]View
372-bromopropionamide0.0032View
384-vinylpyridine1.1880View
392,5-dihydroxybenzoquinone-0.0546[15]View
401,5-dichloro-2,3-dinitrobenzene2.5966[18]View
412,6-dichloro-3-nitropyridine2.0279View
422-hydroxyethyl acrylate0.6891[19]View
43Butyric acid sodium salt-1.3722[20]View
443-hexyn-2-one1.3192[5]View
45Metylhydroxyhydroquinone2.2021[15]View
46Acrolein1.4122[19]View
47Methyl vinyl sulfone0.9865View
482-chloro-3,5-dinitropyridine2.6366View
492-bromoacetamide1.5249View
50Chloro-1,4-benzoquinone1.5454[15]View

Bibliography

  1. Jaworska, J. S.; Hunter, R. S.; Schultz, T. W. Quantitative Structure-Toxicity Relationships and Volume Fraction Analyses for Selected Esters. Arch. Environ. Contam. Toxicol. 1995, 29, 86–93. http://dx.doi.org/10.1007/BF00213091

  2. Schultz, T. W.; Arnold, L. M.; Wilke, T. S.; Moulton, M. P. Relationships of quantitative structure-activity for normal aliphatic alcohols. Ecotox. Environ. Saf. 1989, 19, 243–253. http://dx.doi.org/10.1016/0147-6513(90)90026-2

  3. Schultz, T. W.; Wilke, T. S.; Bryant, S. E.; Hosein, L. M. QSARs for selected aliphatic and aromatic amines. Sci. Total Environ. 1991, 109, 581–587. http://dx.doi.org/10.1016/0048-9697(91)90211-V

  4. Cajina-Quezada, M.; Schultz, T. W. Structure-toxicity relationships for selected weak acid respiratory uncouplers. Aquat. Toxicol. 1990, 17, 239–252. http://dx.doi.org/10.1016/0166-445X(90)90066-X

  5. Schultz, T. W.; Sinks, G. D.; Hunter, R. S. Structure-Toxicity Relationships For Alkanones and Alkenones. SAR QSAR Environ. Res. 1995, 3, 27–36. http://dx.doi.org/10.1080/10629369508233991

  6. Schultz, T. W.; Kissel, T. S.; Tichy, M. Structure-toxicity relationships for unsaturated alcohols to Tetrahymena pyriformis: 3-alkyn-1-ols and 2-alken-1-ols. Bull. Environ. Contam. Toxicol. 1994, 53, 179–185. http://dx.doi.org/10.1007/BF00192030

  7. Schultz, T. W.; Applehans, F. M.; Riggin, G. W. Structure-activity relationships of selected pyridines: III. Log Kow analysis. Ecotox. Environ. Saf. 1987, 13, 76–83. http://dx.doi.org/10.1016/0147-6513(87)90044-3

  8. Muccini, M.; Layton, A. C.; Sayler, G. S.; Schultz, T. W. Aquatic Toxicities of Halogenated Benzoic Acids to Tetrahymena pyriformis. Bull. Environ. Contam. Toxicol. 1999, 62, 616–622. http://dx.doi.org/10.1007/s001289900919

  9. 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

  10. Schultz, T. W.; Tichy, M. Structure-toxicity relationships for unsaturated alcohols to Tetrahymena pyriformis: C5 and C6 analogs and primary propargylic alcohols. Bull. Environ. Contam. Toxicol. 1993, 51, 681–688. http://dx.doi.org/10.1007/BF00201645

  11. Jaworska, J. S.; Hunter, R. S.; Gobble, J. R.; Schultz, T. W. Structure-Activity Relationships for Diesters: Aquatic Toxicity to Tetrahymena. In Quantitative Structure-Activity Relationships in Environmental Sciences; Chen, F.; Schüürmann, G., Eds.; SETAC Press; 1997.

  12. Sinks, G. D.; Carver, T. A.; Schultz, T. W. Structure-Toxicity Relationships for Aminoalkanols: A Comparison with Alkanols and Alkanamines. SAR QSAR Environ. Res. 1998, 9, 217–228. http://dx.doi.org/10.1080/10629369808039157

  13. Schultz, T. W.; Dawson, D. A.; Lin, D. T. Comparative toxicity of selected nitrogen-containing aromatic compounds in the Tetrahymena pyriformis and Pimephales promelas test systems. Chemosphere 1989, 18, 2283–2291.

  14. Schultz, T. W.; Sinks, G. D.; Cronin, M. T. D. Identification of Mechanisms of Toxic Action of Phenols to Tetrahymena pyriformis from Molecular Descriptors. In Quantitative Structure-Activity Relationships in Environmental Sciences; Chen, F.; Schüürmann, G., Eds.; SETAC Press; 1997.

  15. Schultz, T. W.; Sinks, G. D.; Cronin, M. T. D. Quinone-induced toxicity to Tetrahymena: structure-activity relationships. Aquat. Toxicol. 1997, 39, 267–278. http://dx.doi.org/10.1016/S0166-445X(97)00031-3

  16. Bryant, S. E.; Schultz, T. W. Toxicological Assessment of Biotransformation Products of Pentachlorophenol: Tetrahymena Population Growth Impairment. Arch. Environ. Con. Tox. 1994, 26, 299–303. http://dx.doi.org/10.1007/BF00203555

  17. Schultz, T. W.; Deweese, A. D. Structure-Toxicity Relationships for Selected Lactones to Tetrahymena pyriformis. Bull. Environ. Contam. Toxicol. 1999, 62, 463–468. http://dx.doi.org/10.1007/s001289900898

  18. Cronin, M. T. D.; Gregory, B. W.; Schultz, T. W. Quantitative Structure-Activity Analyses of Nitrobenzene Toxicity to Tetrahymena pyriformis. Chem. Res. Toxicol. 1998, 11, 902–908. http://dx.doi.org/10.1021/tx970166m

  19. Schultz, T. W.; Sinks, G. D.; Bearden, A. P. QSAR in Aquatic Toxicology: A Mechanism of Action Approach Comparing Toxic Potency to Pimephales promelas, Tetrahymena pyriformis, and Vibrio fisheri. In Comparative QSAR; Devillers, J., Ed.; Taylor & Francis; 1998.

  20. Seward, J. R.; Schultz, T. W. QSAR Analyses of the Toxicity of Aliphatic Carboxylic Acids and Salts to Tetrahymena Pyriformis. SAR QSAR Environ. Res. 1999, 10, 557–568. http://dx.doi.org/10.1080/10629369908033224

  21. Seward, J. R.; Sinks, G. D.; Schultz, T. W. Reproducibility of toxicity across mode of toxic action in the Tetrahymena population growth impairment assay. Aquat. Toxicol. 2001, 53, 33–47. http://dx.doi.org/10.1016/S0166-445X(00)00158-2