10967/200 - QDB Compounds

QsarDB Repository

Katritzky, A. R.; Kasemets, K.; Slavov, S.; Radzvilovits, M.; Tämm, K.; Karelson, M. Estimating the toxicities of organic chemicals in activated sludge process. Water Res. 2010, 44, 2451–2460.

104 compounds | Property logEC50: Bioluminescent Shk1 aquatic toxicity as logEC50 [log(mmol/L)] i

IDNamelogEC50Details
14-Nitrophenol i-0.51View
2Ethylbenzene i-0.27View
3Benzyl alcohol i0.77View
4Benzaldehyde0.35View
5Triethanolamine1.8View
62-Ethyl-1-hexanol i0.08View
74-Chlorobenzaldehyde0.48View
84-Bromophenol-0.8View
9p-Xylene-0.27View
101,4-Dichlorobenzene-0.15View
114-Chlorophenol-0.8View
121,2-Dibromoethane0.69View
131,2-Dichloroethane1.15View
14Methyl isobutyl ketone0.57View
15m-Cresol0.24View
16Toluene i0View
17Chlorobenzene-0.03View
18Cyclohexylamine0.61View
19Cyclohexanone0.08View
20Phenol0.71View
211-Chlorobutane-0.48View
22n-Butylamine i0.64View
23Diethylamine0.65View
24Isobutyl acetate0.4View
25Hexane-0.15View
261,4-Dichlorobutane0.33View
27Cyclohexane0.05View
281-Hexanol0.3View
29Glutaraldehyde0.22View
30Octane0.16View
311-Octanol i-0.27View
32Pyrocatechol0.86View
332,4-Dichlorophenol-0.74View
342,4-Dinitrotoluene0.12View
35Triethylamine0.49View
36Isopentyl alcohol1.14View
37Azelaic acid0.05View
38Tetrachloroethylene0.11View
392-Naphthol-1.08View
40Ethanolamine0.96View
41Ethyl acetate1.29View
421,3-Dichloropropane0.59View
438-Quinolinol-0.19View
44tert-Butyl methyl ether0.2View
451,1,3-Trichloroprop-1-ene i-0.08View
462,3-Dihydroxybenzoic acid i0View
472,3,4,5-Tetrachlorophenol-1.51View
482,5-Dihydroxybenzoic acid0.21View
49Formaldehyde i0.08View
503,5-dihydroxytoluene0.97View
51Orcinol0.97View
522,5-Dichlorobenzoic acid0.03View
532,4-Dinitrophenol-0.24View
543-Chlorobenzoic acid0.14View
551,3-Dichlorobenzene-0.36View
56Carbon tetrachloride-0.22View
573-Phenylphenol-0.85View
582,5-Dichlorophenol-0.01View
594-Bromobenzoic acid-0.77View
603,5-Dichlorophenol-0.6View
614-Chloro-3-methylphenol-0.89View
62Diethyl ether i1.68View
63Aniline1.13View
64n-Amyl acetate0.15View
651,5-Dichloropentane-0.38View
661,1,1,2-Tetrachloroethane-0.85View
67Ethanol2.83View
68Acetic acid0.35View
69Methanol3.1View
702-Propanol2.55View
71Acetone2.59View
72Chloroform i0.77View
731-Propanol2.14View
741-Butanol1.57View
751-Pentanol0.92View
76Benzene0.41View
771,1,1-Trichloroethane i-0.43View
78Iodomethane i0.64View
79Dibromomethane0.79View
80Bromoethane1.3View
81Bromochloromethane1.4View
82Methylene chloride1.54View
83Formamide2.14View
84Bromoform-0.19View
851,2-Dichloropropane0.39View
86Methyl ethyl ketone0.94View
87Trichloroethylene0.16View
881,1,2,2-Tetrachloroethane-0.62View
892,6-Dichlorophenol-0.13View
90Phthalic acid i0.89View
912-Chlorobenzaldehyde-0.32View
92Salicylaldehyde0.23View
932-Methoxyphenol0.67View
941-Naphthol i-0.43View
952,6-Dimethoxyphenol-1View
962,3,6-Trichlorophenol i-0.51View
971,2-Dichlorobenzene-0.26View
982-Chlorophenol0.07View
992,4,5-Trichlorophenol-1.18View
1001,2,3-Trichloropropane0.16View
101Nitrobenzene0.22View
1023'-Chloroacetophenone-0.37View
103Protocatechuic acid0.25View
1044'-Chloroacetophenone-0.37View

Bibliography

  1. Ren, S.; Frymier, P. D. Estimating the toxicities of organic chemicals to bioluminescent bacteria and activated sludge. Water Research 2002, 36, 4406–4414. http://dx.doi.org/10.1016/s0043-1354(02)00153-7

  2. Ren, S.; Frymier, P. D. Comparative Study of Two Bioassays for Applications in Influent Wastewater Toxicity Monitoring. Journal of Environmental Engineering 2003, 129, 216–221. http://dx.doi.org/10.1061/(asce)0733-9372(2003)129:3(216)

  3. Ren, S.; Frymier, P. D. Toxicity Estimation of Phenolic Compounds by Bioluminescent Bacterium. Journal of Environmental Engineering 2003, 129, 328–335. http://dx.doi.org/10.1061/(asce)0733-9372(2003)129:4(328)