67 0.20 8 16, 27, 20, 22, 13 0.69 0.21 9 22, 19, 14, 27, 9 0.87 0.09 10 14, 5, 32, 2, 13 0.71 0.19 Average values 0.74 0.17 Table 4 R Y 2 and Q Y 2 values after ten Y-scrambling tests Number

of runs Order of compounds NVP-BGJ398 in observed y vector in the Y-scrambling test R Y 2 Q Y 2 1 9, 4, 32, 24, 19, 27, 12, 33, 29, 11, 22, 26, 15, 6, 20, 14, 28, 5, 31, 16, 13, 10, 2, 18, 7 0.07 0.01 2 12, 19, 14, 9, 26, 20, 33, 16, 32, 28, 24, 22, 27, 29, 5, 10, 4, 6, 18, 7, 2, 31, 11, 15, 13 0.12 0.05 3 16, 19, 22, 33, 11, 6, 2, 7, 26, 4, 5, 24, 31, 15, 10, 20, 29, 14, 27, 13, 28, 12, 32, 18, 9 0.06 0.02 4 28, 12, 4, 20, 15, 11, 24, 2, 9, 7, 31, 6, 29, 18, 16, 26, 19, 22, 14, 33, 5, 27, 10, 32, 13 0.06 0.01 5 32, 2, 16, 20, 6, 22, 19, 15, 14, 5, 26, 29, 7, 4, 18, 12, 28, 11, 10, 33, 31, 27, 9, 24, 13 0.09 0.01 6 32, 19, 13, 12,

6, 20, 28, 10, 27, 31, 33, 16, 7, 14, 11, 29, 24, 15, 26, 4, 5, 9, 2, 22, 18 0.08 0.05 7 15, 31, 2, 20, 27, 9, 28, 13, 19, 12, 33, 24, 7, 14, 11, 29, 5, 16, selleck chemicals 22, 32, 18, 26, 10, 6, 4 0.04 0.00 8 7, 28, 10, 31, 11, 22, 19, 29, 33, 12, 27, 18, 32, 20, 6, 13, 2, 9, 5, 15, 26, 4, 24, 14, 16 0.03 0.00 9 27, 29, 24, 33, 28, 4, 19, 31, 32, 12, 9, 14, 13, 7, 18, 22, 26, 5, 20, 11, 16, 10, 15, 6, 2 0.05 0.00 10 27, 6, 10, 2, 14, 31, 19, 29, 32, 4, 26, 11, 18, 12, 9, 13, 15, 24, 28, 33, 16, 5, 22, 7, 20 0.13 0.07 Average values 0.07 0.02 Table 5 Multiple regression results   BETA Standard error B Standard error t(14) P level Intercept     −20.1101 6.07174 −3.31209 0.005137 JGI4 −0.870898 0.188244 −60.1674 13.00513 −4.62644 0.000392 PCR 1.026828 0.319750 12.3345 3.84092 3.21134 Sinomenine 0.006277 Hy 0.604621 0.130843 0.9856 0.21329 4.62095 0.000396 The molecular charge distribution plays an important role in many biological and pharmacological activities. Finally, $$ \textJGIk = \frac\textGGIk\left( N – 1 \right)\text and \,\textGGIk = \sum\limits_i = 1,\kern 1pt j = i + 1^i = N – 1,\kern 1pt j = N \left , $$ (2)where, δ is where d is Kronecker’s delta and CT ij  = m ij −m ji [m stands for the elements of the M matrix M = A × D*; A is the adjacency (N × N) matrix of the molecular graph G, where N is the number of vertices (atoms different to Lazertinib in vivo hydrogen)].