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. 2019 Nov 8;14(11):e0224657. doi: 10.1371/journal.pone.0224657

Table 1. Comparison of in vitro 3D BMPS model data with in vivo data for OP toxicity.

Chemical AChE activity (IC50, M)
(95% CI)
Toxicity
(LC50, M)
(95% CI)
In vivo
(LD50,mg/kg)
(toxicity source)
Chlorpyrifos (CPF) 2.735E-1
(7.634E-4 ~ noncomplete CI)
3.949E-4
(1.118E-4 ~ 8.145E-4)
96
(Oral-human)
Malathion (MT) 1.805E-3
(7.670E-4 ~ 5.600E-3)
1.171E-3
(9.216E-4 ~ 1.494E-3)
369
(Oral-rat)
Parathion (PT) 4.338E-6
(1.113E-6 ~ 1.036E-5)
8.924E-3
(5.727E-3 ~ 1.409E-2)
25
(Oral-human)
Diisopropyl fluorphosphate
(DFP)
1.863E-3
(9.180E-4 ~ 4.635E-3)
1.781E-5
(5.007E-8 ~ 2.251)
6
(Oral-rat)
Dimethyl methylphosphonate
(DMMP)
4.159E-1
(1.253E-1 ~ noncomplete CI)
1.217E-1
(1.651E-2 ~ 1.763)
8210
(Oral-rat)
Diethyl methylphosphonate (DEMP) 1.971E-1
(9.826E-2 ~ 4.933E-1)
2.307E-1
(2.415E-1 ~ noncomplete CI)
800
(Intraperitoneal-mouse)
Diethyl cyanophosphonate (DECP) 1.075E-05
(2.475E-6 ~ 5.813E-5)
8.948E-6
(5.919E-9 ~ 3.906E-3)
1.4
(Intraperitoneal-mouse)
Diethyl chlorophosphate (DCP) 8.688E-06
(1.603E-6 ~4.302E-5)
4.094E-3
(6.202E-4 ~ 7.146E-2)
11
(Oral-rat)