10967/162 - QDB Compounds

QsarDB Repository

Cronin, M.T.D.; Netzeva, T.I.; Dearden, J.C.; Edwards, R.; Worgan, A.D.P. Assessment and Modeling of the Toxicity of Organic Chemicals to Chlorella vulgaris :  Development of a Novel Database. Chem. Res. Toxicol. 2004, 17, 545–554.

91 compounds | Property pEC50: 15-minute algal toxicity as log(1/EC50) [log(1/mM)] i

IDNamepEC50Details
1methanol-4.06View
2ethanol-3.32View
4butan-2-ol-2.98View
52-hydroxyethyl methacrylate-2.82View
62-hydroxyethyl acrylate-2.79View
7methyl acrylate-2.75View
9butanone-2.51View
10methyl methacrylate-2.24View
11pentan-3-one-2.23View
12crotonaldehyde-1.98View
14trans-2-pentenal-1.88View
15phenol-1.46View
16allyl methacrylate-1.42View
17aniline-1.34View
19anisole-1.09View
202-fluorophenol-1.08View
212-fluoroaniline-1.05View
223-cresol-1.01View
242-hydroxyaniline-0.91View
252-methoxyphenol-0.88View
262,6-dimethylaniline-0.87View
27benzaldehyde-0.81View
292-hydroxybenzaldehyde-0.8View
30nitrobenzene-0.78View
31methidathion-0.73View
324-cresol-0.66View
344-tolualdehyde-0.65View
352-ethoxyphenol-0.62View
363-cyanobenzaldehyde-0.57View
373-nitrotoluene-0.5View
392,4-dinitroaniline-0.36View
404-bromophenol-0.35View
414-bromoaniline-0.33View
423-chloroaniline-0.31View
443,5-dinitroaniline0.03View
452-chlorobenzaldehyde0.06View
464-iodophenol0.16View
474-ethylbenzaldehyde0.16View
492-isopropylphenol0.17View
503,5-dichloroaniline0.24View
511,3,5-trimethyl-2-nitrobenzene0.25View
522,6-dichloroaniline0.26View
541,2-dichlorobenzene0.37View
551,3-dinitrobenzene0.38View
562,4-dinitrophenol0.4View
571,4-dinitrobenzene0.41View
59phosmet0.47View
60methylparathion0.6View
61malathion0.64View
622,6-dichloro-4-nitroaniline0.64View
642,4-dinitrotoluene0.7View
65cyanophos0.79View
666-chloro-2,4-dinitroaniline0.8View
672,6-dibromo-4-nitrophenol0.81View
692,5-dichloronitrobenzene0.97View
70piperine0.97View
714-tert-butylbenzaldehyde1View
722,4,6-trichloroaniline1.11View
744-chloro-2,6-dinitroaniline1.19View
751,2-dinitrobenzene1.23View
761-chloro-4-nitrobenzene1.25View
77dicapthon1.36View
792,3,5,6-tetrachloroaniline1.48View
802,4-dichloro-6-nitrophenol1.5View
812,6-dichlorobenzaldehyde1.5View
82fenthion1.56View
84pentachlorophenol1.69View
85fenitrothion1.71View
861,2,4-trichloro-5-nitrobenzene1.88View
871,3,5-trichloro-2,4-dinitrobenzene1.89View
894-(dibutylamino)benzaldehyde2.18View
902,3,5,6-tetrachloronitrobenzene2.34View
91pentabromophenol3.1View
32-methyl-propan-2-ol-3.16View
8butan-1-ol-2.73View
13trans-2-hexenal-1.94View
182-heptanone-1.18View
234-methoxyphenol-0.97View
282-cresol-0.81View
333,4-dimethylphenol-0.65View
384-chlorophenol-0.42View
43benzyl methacrylate-0.21View
482-methyl-1,4-naphthoquinone0.16View
532-tert-butyl phenol0.29View
583-nitrobenzaldehyde0.45View
63methyl azinphos0.69View
68thiometon0.94View
732-chloro-6-nitrotoluene1.17View
782,6-ditertbutyl-4-methyl phenol1.45View
832,4-di-tert-butylphenol1.6View
88phenylazophenol2.16View

Bibliography

  1. Cronin, M. T. D.; Netzeva, T. I.; Dearden, J. C.; Edwards, R.; Worgan, A. D. P. Assessment and Modeling of the Toxicity of Organic Chemicals to Chlorella vulgaris :  Development of a Novel Database . Chemical Research in Toxicology 2004, 17, 545–554. http://dx.doi.org/10.1021/tx0342518