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Table 2 Human pharmacokinetic prediction results for 14 compounds

From: Utility of a single adjusting compartment: a novel methodology for whole body physiologically-based pharmacokinetic modelling

Parameter Group T1/2 CLtot
   6 organs 8 organs 10 organs 6 organs 8 organs 10 organs
   + - + - + - + - + - + -
AFE acidic 5.45 38.7 2.26 16.6 1.36 13.5 1.39 305 1.07 26.5 2.56 14.7
  neutral 3.58 36.6 2.97 2.12 1.64 2.25 4.01 68.5 1.47 14.8 1.38 10.8
  basic 4.13 36.8 1.85 7.48 1.76 6.28 1.34 24.4 1.62 5.64 1.10 4.37
  zwitterionic 2.80 14.4 1.41 5.10 1.36 3.85 1.40 33.3 1.48 7.40 1.63 5.67
AFE Overall 3.35 23.2 1.75 5.78 1.48 4.74 1.63 47.4 1.47 9.24 1.56 6.74
within-2-fold (%)   0 0 62 14 93 14 92 0 92 0 79 0
  1. +: WBPBPK model with SAC, -: WBPBPK model without SAC.