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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

ID Name Mutagenicity Details
1 Benzo(a)pyrene yes View
2 Dibenz[a,h]anthracene i yes View
3 Benz[a]anthracene yes View
4 1,8-Naphthalic Anhydride no View
5 7H-benz[de]anthracen-7-one yes View
6 Phenanthrene-9,10-quinone no View
7 Anthraquinone no View
8 Phenanthrene no View
9 Pyrene no View
10 Dibenzo[a,i]pyrene yes View
11 Dibenzo[a,h]pyrene yes View
12 Coronene no View
13 Benzo[ghi]perylene yes View
14 Dibenzo(a,l)pyrene yes View
15 Benzo[a]perylene yes View
16 Dibenzo[a,e]pyrene yes View
17 Benzo(e)pyrene yes View
18 Indeno[1,2,3-cd]pyrene yes View
19 Benzo[c]phenanthrene yes View
20 Benzo[b]perylene yes View
21 Perylene no View
22 Naphtho[2,1-a]pyrene yes View
23 Benzo[ghi]fluoranthene no View
24 Benzo(J)fluoranthene yes View
25 Naphtho[2,3-j]fluoranthene no View
26 Dibenzo[b,k]fluoranthene yes View
27 Benzo(b)fluoranthene yes View
28 Naphtho[2,3-b]fluoranthene yes View
29 Benzo(k)fluoranthene yes View
30 Naphtho[2,3-k]fluoranthene no View
31 Acenaphthylene yes View
32 Picene no View
33 Benzo[b]chrysene no View
34 Triphenylene yes View
35 Chrysene yes View
36 Dibenz[a,j]anthracene i yes View
37 Naphtho[1,2-k]fluoranthene yes View
38 Benzo[b]fluorene no View
39 Benzo[b]naphtho[2,1-d]thiophene no View
40 Phenalenone yes View
41 9-Nitroanthracene yes View
42 2-Nitrofluorene i no View
43 Anthanthrenequinone yes View
44 2-Nitropyrene no View
45 1-Methylphenanthrene yes View
46 3-Nitrofluoranthene yes View
47 5,12-Naphthacenequinone no View
48 7,12-Benz[a]anthracenequinone no View
49 1,6-Benzo[a]pyrenequinone no View
50 3,6-Benzo[a]pyrenequinone no View
51 6H-Benzo[cd]pyren-6-one yes View
52 5-Methylchrysene yes View
53 Dibenzo[a,e]fluoranthene yes View
54 1-Nitropyrene yes View
55 4H-cyclopenta[def]-phenanthrene-4-one no View
56 2-Nitro-6H-dibenzo[b,d]pyran-6-one no View
57 3-Nitro-6H-dibenzo[b,d]pyran-6-one yes View
58 2-Nitrofluoranthene yes View
59 8-Methylfluoranthene yes View
60 Cyclopenta[cd]pyrene i yes View
61 Benzo[a]fluorene no View
62 1-Methylbenzo(a)pyrene i yes View
63 4,5-Benzo[a]pyrenequinone no View
64 1,6-Dinitropyrene yes View
65 1,8-Dinitropyrene yes View
66 Cyclopenta[cd]pyren-3(4H)-one yes View
67 1,3-Dinitropyrene yes View
68 7H-dibenz[de, j]anthracen-7-one no View
69 Dibenzo[a,k]fluoranthene yes View
70 1,4-Chrysenequinone no View

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