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. 2021 Oct 8;9(10):255. doi: 10.3390/toxics9100255

Table 5.

Docking scores (kcal/mol) of environmental toxicants in binding pockets of receptors.

Environmental Toxicants Androgen Receptor Estrogen Receptor-α Estrogen Receptor-β
4-nonylphenol −7.1 −5.8 −6.9
4-octylphenol −6.6 −5.9 −7.0
4-tert-butylphenol −6.3 −5.9 −6.3
Bisphenol A −8.3 −7.7 −7.9
Dichlorodiphenyltrichloroethane −7.9 ND ND
Diethylhexyl phthalate −6.4 ND ND
Diethylstilbestrol −8.6 −8.5 −8.6
Heptachlor −5.9 ND ND
Methoxychlor −6.0 −7.0 −5.4
O-phenylphenol −7.8 −7.0 −7.4
Perfluorooctanoic acid −8.9 ND ND
Permethrin ND ND −7.9
α-estradiol ND −9.1 ND
β-estradiol ND ND −8.5
Dihydrotestosterone −9.2 ND ND

ND: Not determined. Binding energy in bold signifies compounds that are past the threshold of −7.5 kcal/mol.