10967/186 - QDB Compounds

QsarDB Repository

Papa, E.; Pilutti, P.; Gramatica, P. Prediction of PAH mutagenicity in human cells by QSAR classification. SAR and QSAR in Environmental Research 2008, 19, 115–127.

70 compounds | Property Mutagenicity: Mutagenicity on human h1A1v2 cells i

IDNameMutagenicityDetails
1Benzo(a)pyreneyesView
2Dibenz[a,h]anthracene iyesView
3Benz[a]anthraceneyesView
41,8-Naphthalic AnhydridenoView
57H-benz[de]anthracen-7-oneyesView
6Phenanthrene-9,10-quinonenoView
7AnthraquinonenoView
8PhenanthrenenoView
9PyrenenoView
10Dibenzo[a,i]pyreneyesView
11Dibenzo[a,h]pyreneyesView
12CoronenenoView
13Benzo[ghi]peryleneyesView
14Dibenzo(a,l)pyreneyesView
15Benzo[a]peryleneyesView
16Dibenzo[a,e]pyreneyesView
17Benzo(e)pyreneyesView
18Indeno[1,2,3-cd]pyreneyesView
19Benzo[c]phenanthreneyesView
20Benzo[b]peryleneyesView
21PerylenenoView
22Naphtho[2,1-a]pyreneyesView
23Benzo[ghi]fluoranthenenoView
24Benzo(J)fluorantheneyesView
25Naphtho[2,3-j]fluoranthenenoView
26Dibenzo[b,k]fluorantheneyesView
27Benzo(b)fluorantheneyesView
28Naphtho[2,3-b]fluorantheneyesView
29Benzo(k)fluorantheneyesView
30Naphtho[2,3-k]fluoranthenenoView
31AcenaphthyleneyesView
32PicenenoView
33Benzo[b]chrysenenoView
34TriphenyleneyesView
35ChryseneyesView
36Dibenz[a,j]anthracene iyesView
37Naphtho[1,2-k]fluorantheneyesView
38Benzo[b]fluorenenoView
39Benzo[b]naphtho[2,1-d]thiophenenoView
40PhenalenoneyesView
419-NitroanthraceneyesView
422-Nitrofluorene inoView
43AnthanthrenequinoneyesView
442-NitropyrenenoView
451-MethylphenanthreneyesView
463-NitrofluorantheneyesView
475,12-NaphthacenequinonenoView
487,12-Benz[a]anthracenequinonenoView
491,6-Benzo[a]pyrenequinonenoView
503,6-Benzo[a]pyrenequinonenoView
516H-Benzo[cd]pyren-6-oneyesView
525-MethylchryseneyesView
53Dibenzo[a,e]fluorantheneyesView
541-NitropyreneyesView
554H-cyclopenta[def]-phenanthrene-4-onenoView
562-Nitro-6H-dibenzo[b,d]pyran-6-onenoView
573-Nitro-6H-dibenzo[b,d]pyran-6-oneyesView
582-NitrofluorantheneyesView
598-MethylfluorantheneyesView
60Cyclopenta[cd]pyrene iyesView
61Benzo[a]fluorenenoView
621-Methylbenzo(a)pyrene iyesView
634,5-Benzo[a]pyrenequinonenoView
641,6-DinitropyreneyesView
651,8-DinitropyreneyesView
66Cyclopenta[cd]pyren-3(4H)-oneyesView
671,3-DinitropyreneyesView
687H-dibenz[de, j]anthracen-7-onenoView
69Dibenzo[a,k]fluorantheneyesView
701,4-ChrysenequinonenoView

Bibliography

  1. Durant, J. L.; Busby, W. F.; Lafleur, A. L.; Penman, B. W.; Crespi, C. L. Human cell mutagenicity of oxygenated, nitrated and unsubstituted polycyclic aromatic hydrocarbons associated with urban aerosols. Mutation Research/Genetic Toxicology 1996, 371, 123–157. http://dx.doi.org/10.1016/s0165-1218(96)90103-2

  2. Durant, J. L.; Lafleur, A. L.; Busby, W. F.; Donhoffner, L. L.; Penman, B. W.; Crespi, C. L. Mutagenicity of C24H14 PAH in human cells expressing CYP1A1. Mutation Research/Genetic Toxicology and Environmental Mutagenesis 1999, 446, 1–14. http://dx.doi.org/10.1016/s1383-5718(99)00135-7