10967/31 - QDB Compounds

QsarDB Repository

Netzeva, T.I.; Schultz, T.W. QSARs for the aquatic toxicity of aromatic aldehydes from Tetrahymena data. Chemosphere 2005, 61, 11, 1632–1643.

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

IDNamepIGC50Details
14-Nitrobenzaldehyde0.203View
21-Naphthaldehyde0.423View
34-Biphenylcarboxaldehyde1.119View
44-Bromobenzaldehyde0.587View
54-Cyanobenzaldehyde0.043View
6Benzaldehyde-0.196View
7p-Tolualdehyde-0.057View
84-Fluorobenzaldehyde-0.127View
94-Chlorobenzaldehyde0.400View
104-Ethylbenzaldehyde0.291View
11Terephthaldicarboxaldehyde-0.086View
124-Anisaldehyde-0.047View
134-Ethoxybenzaldehyde0.073View
144-Acetamidobenzaldehyde-0.224View
152-Tolualdehyde0.011View
163-Tolualdehyde0.081View
172-Chlorobenzaldehyde0.487View
183-Chlorobenzaldehyde0.406View
192-Nitrobenzaldehyde0.167View
203-Nitrobenzaldehyde0.178View
21Phenyl-1,3-dialdehyde0.183View
222-Anisaldehyde0.148View
233-Anisaldehyde0.232View
243-Bromobenzaldehyde0.506View
253-Fluorobenzaldehyde0.154View
262,4-Dichlorobenzaldehyde1.036View
272,4-Dimethoxybenzaldehyde-0.056View
282,4,5-Trimethoxybenzaldehyde-0.101View
294-(Dimethylamino)Benzaldehyde0.231View
304-Phenoxybenzaldehyde1.257View
312-Bromobenzaldehyde0.477View
322-Fluorobenzaldehyde0.079View
334-Butoxybenzaldehyde0.716View
344-(Pentyloxy)Benzaldehyde1.179View
354-Isopropylbenzaldehyde0.670View
36Pentafluorobenzaldehyde0.815View
372-Chloro-5-nitrobenzaldehyde0.527View
382-Chloro-6-fluorobenzaldehyde0.155View
393-Cyanobenzaldehyde-0.020View
402-Chloro-3-hydroxy-4-methoxybenzaldehyde0.204View
416-Chloro-2-fluoro-3-methylbenzaldehyde1.238View
423-Chloro-2-fluoro-5-(trifluoromethyl)benzaldehyde1.723View
432,3,5-Trichlorobenzaldehyde1.499View
442-Fluorenecarboxaldehyde1.499View
452-Methyl-1-naphthaldehyde1.231View
464-Methyl-1-naphthaldehyde1.123View
47Phenanthrene-9-carboxaldehyde1.708View
485-Hydroxy-2-nitrobenzaldehyde0.329View
493-Hydroxy-4-nitrobenzaldehyde0.273View
503-Hydroxybenzaldehyde0.085View
513-Hydroxy-4-methoxybenzaldehyde-0.142View
523,4-Dimethoxy-5hydroxycarboxaldehyde-0.390View
532,3-Dihydroxybenzaldehyde0.111View
542,5-Dihydroxybenzaldehyde0.277View
553,4-Dihydroxybenzaldehyde0.107View
563,4,5-Trihydroxybenzaldehyde-0.196View
572,3,4-Trihydroxybenzaldehyde0.001View
582,4,6-Trihydroxybenzaldehyde0.128View
592,4-Dihydroxybenzaldehyde0.515View
603-Ethoxy-2-hydroxycarboxaldehyde0.850View
613-Methoxysalicylaldehyde0.377View
623,5-Dibromosalicylaldehyde1.648View
634,6-Dimethoxy-2-hydroxybenzaldehyde0.617View
642-Hydroxy-3-nitrocarboxaldehyde0.870View
652-Chloro-4-hydroxycarboxaldehyde0.890View
664-Hydroxy-3-nitrobenzaldehyde0.614View
674-Hydroxybenzaldehyde0.266View
682-Hydroxy-1-naphtaldehyde1.320View
695-Bromovanillin0.617View
704-Hydroxy-1-naphtaldehyde1.050View
715-Bromosalicylaldehyde1.107View
725-Chlorosalicylaldehyde1.009View
732-Hydroxybenzaldehyde0.424View
743-Bromo-4-hydroxycarboxaldehyde0.610View
753-Methoxy-4-hydroxybenzaldehyde-0.030View
763,5-Dibromo-4-hydroxycarboxaldehyde0.890View
773-Ethoxy-4-hydroxybenzaldehyde0.015View

Bibliography

  1. Netzeva, T. I.; Schultz, T. W. QSARs for the aquatic toxicity of aromatic aldehydes from Tetrahymena data. Chemosphere 2005, 61, 1632–1643. http://dx.doi.org/10.1016/j.chemosphere.2005.04.040

  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