SUMMARY OUTPUT

Regression Statistics Hy
Multiple R 0.992748
R Square 0.985549
Adjusted R 0.981936

TPSA
Standard E 5.305424
Observatio 16
-2.5 -2.4 -2.3 -2.2 -2
ANOVA
df SS MS F Significance F
Regression 3 23035.3 7678.434 272.7925 2.655E-11
Residual 12 337.7703 28.14753
Total 15 23373.07

Coefficients
Standard Error t Stat P-value Lower 95%Upper 95%Lower 95.0%
Upper 95.0%
Intercept -76.54812 21.37164 -3.581763 0.00377 -123.1129 -29.98333 -123.1129 -29.98333
Hy -54.49067 8.579339 -6.351384 3.657E-05 -73.18345 -35.7979 -73.18345 -35.7979
LogP2 2.570726 0.296515 8.669795 1.636E-06 1.924675 3.216777 1.924675 3.216777
LDI 209.8257 71.66494 2.927871 0.012654 53.68118 365.9702 53.68118 365.9702

RESIDUAL OUTPUT

Observation
Predicted TPSA
Residuals
1 96.56809 -6.418095 activity= -76.548- 54.491Hy+ 2.571LogP2+ 209.826+ C
2 96.56809 -6.418095
3 111.0401 -0.660109
4 111.0401 -0.660109 R Square 0.985549
5 114.6843 -4.304267 Fvalue 2.655E-11
6 189.8828 -0.352808 Intercept 0.00377
7 191.5151 -1.98514 Hy 3.657E-05
8 189.8828 -0.352808 LogP2 1.636E-06
9 189.8828 -0.352808 LDI 0.012654
10 110.0248 6.145249
11 111.2184 10.16157
12 143.9482 1.601835
13 98.06975 -0.079749
14 114.6843 -4.304267
15 119.1176 8.332404
16 189.8828 -0.352808
 Hy Line Fit Plot
250
LogP2 200
Line Fit Plot
150 TPSA
250
TPSA

200 LDI Line Fit Plot

100
50
Predicted TPSA
150 0 TPSA
250
TPSA

100
-2.5 -2.4 -2.3 -2.2 -2.1 -2 200
-1.9 -1.8 -1.7 -1.6 Predicted TPSA
50
0 Hy 150 TPSA
TPSA

5 100
10 15 20 25 30 35 Predicted TPSA
50
0 LogP2
0.26 0.28 0.3 0.32 0.34 0.36 0.38
LDI
SUMMARY OUTPUT

Regression Statistics LogP

Multiple R 0.998381
200
R Square 0.996764 150
Adjusted R 0.995955 100

TPSA
Standard E 2.510593 50
Observatio 16 0
5 10 15
ANOVA L
df SS MS F Significance F
Regression 3 23297.44 7765.812 1232.067 3.363E-15
Residual 12 75.63692 6.303076
Total 15 23373.07

Coefficients
Standard Error t Stat P-value Lower 95%Upper 95%Lower 95.0%
Upper 95.0%
Intercept -50.06051 6.466503 -7.741512 5.254E-06 -64.14981 -35.97121 -64.14981 -35.97121
LogP2 3.01735 0.156374 19.29575 2.119E-10 2.67664 3.358059 2.67664 3.358059
Hy -40.36933 4.605363 -8.765723 1.457E-06 -50.40356 -30.33511 -50.40356 -30.33511
QHmax 267.6256 29.94581 8.936996 1.189E-06 202.3793 332.8719 202.3793 332.8719

RESIDUAL OUTPUT
activity= -50.061+ 3.017LogP2- 40.269Hy+ 267.6256QHmax+ C
Observation
Predicted TPSA
Residuals
1 94.11689 -3.966891
2 94.11689 -3.966891 R Square 0.996764
3 110.4759 -0.095929 Fvalue 3.363E-15
4 110.4759 -0.095929 Intercept 5.254E-06
5 110.8341 -0.454076 LogP2 2.119E-10
6 190.1108 -0.580761 Hy 1.457E-06
7 189.5212 0.008802 QHmax 1.189E-06
8 190.1108 -0.580761
9 189.5755 -0.04551
10 111.2544 4.915594
11 117.5384 3.841635
12 145.2011 0.348934
13 96.08302 1.906977
14 110.8341 -0.454076
15 127.6504 -0.200356
16 190.1108 -0.580761
 LogP2 Line Fit Plot
200
150 Hy Line Fit Plot
100 TPSA
200
TPSA

50 QHmax Line Fit Plot

Predicted TPSA
150
0 100 TPSA
200
TPSA

5 10 15 20 25 30 35 Predicted TPSA
150 50
LogP2 100 0 TPSA
TPSA

-2.5 -2.4 -2.3 -2.2 Predicted TPSA

50 -2.1 -2 -1.9 -1.8 -1.7 -1.6
0 Hy
0.2 0.22 0.24 0.26 0.28 0.3 0.32
QHmax

+ 267.6256QHmax+ C
SUMMARY OUTPUT

Regression Statistics LogP

Multiple R 0.993955
250
R Square 0.987947 200
Adjusted R 0.984934 150

TPSA
Standard E 4.845221 100
50
Observatio 16 0
5 10 15
ANOVA L
df SS MS F Significance F
Regression 3 23091.36 7697.12 327.8695 8.944E-12
Residual 12 281.714 23.47617
Total 15 23373.07

Coefficients
Standard Error t Stat P-value Lower 95%Upper 95%Lower 95.0%
Upper 95.0%
Intercept -20.12094 11.40109 -1.764826 0.103005 -44.96178 4.719897 -44.96178 4.719897
LogP2 2.700139 0.283141 9.536358 5.967E-07 2.083226 3.317051 2.083226 3.317051
Hy -47.60201 8.644024 -5.506927 0.000135 -66.43572 -28.7683 -66.43572 -28.7683
QCmax 99.406 27.93142 3.558931 0.003932 38.54867 160.2633 38.54867 160.2633

RESIDUAL OUTPUT

Observation
Predicted TPSA
Residuals
1 95.14182 -4.99182
2 95.14182 -4.99182
3 111.3839 -1.003898 activity= -20.121+ 2.700LogP2- 47.602Hy+ 99.406ACmax+ C
4 111.3839 -1.003898
5 114.8447 -4.464706
6 189.4638 0.066239 R Square 0.987947
7 192.4967 -2.966745 Fvalue 8.944E-12
8 189.4638 0.066239 Intercept 0.103005
9 189.6626 -0.132573 LogP2 5.967E-07
10 110.9871 5.182932 Hy 0.000135
11 110.9262 10.45379 QCmax 0.003932
12 144.0067 1.543349
13 97.87726 0.112735
14 114.8447 -4.464706
15 120.9214 6.528641
16 189.4638 0.066239
 LogP2 Line Fit Plot
250
200 Hy Line Fit Plot
150 TPSA
250
TPSA

100
50
QCmax Line Fit Plot
Predicted TPSA
200
0 150 TPSA
250
TPSA

5 10 15 2020025 30 35 100 Predicted TPSA

50
LogP2 150 0 TPSA
TPSA

100
-2.5 -2.4 -2.3 -2.2 -2.1 -2 -1.9 -1.8 -1.7 -1.6 Predicted TPSA
50
0 Hy
0.05 0.1 0.15 0.2 0.25 0.3 0.35
QCmax
SUMMARY OUTPUT

Regression Statistics LogP

Multiple R 0.987543
200
R Square 0.975242 150
Adjusted R 0.969052 100

TPSA
Standard E 6.944293 50
Observatio 16 0
5 10 15
ANOVA L
df SS MS F Significance F
Regression 3 22794.39 7598.132 157.5617 6.682E-10
Residual 12 578.6784 48.2232
Total 15 23373.07

Coefficients
Standard Error t Stat P-value Lower 95%Upper 95%Lower 95.0%
Upper 95.0%
Intercept -25.54306 16.19561 -1.577159 0.140743 -60.83027 9.744146 -60.83027 9.744146
LogP2 2.113618 0.33037 6.397724 3.414E-05 1.393803 2.833433 1.393803 2.833433
Hy -65.09945 10.29345 -6.324355 3.807E-05 -87.52696 -42.67194 -87.52696 -42.67194
QOmin -0.80927 9.062284 -0.089301 0.930316 -20.55429 18.93575 -20.55429 18.93575

RESIDUAL OUTPUT

Observation
Predicted TPSA
Residuals
1 96.95427 -6.804266
2 96.99473 -6.844729
3 113.2825 -2.902478
4 113.2825 -2.902478
5 113.3435 -2.963459
6 189.9802 -0.450194
7 189.9421 -0.412149
8 189.9802 -0.450194
9 189.9802 -0.450194
10 113.1901 2.979913
11 118.6046 2.775431
12 143.6563 1.89367
13 98.76634 -0.776341
14 113.3435 -2.963459
15 106.7289 20.72112
16 189.9802 -0.450194
 LogP2 Line Fit Plot
200
150 Hy Line Fit Plot
100 TPSA
200
TPSA

50 QOmin Line Fit Plot

Predicted TPSA
150
0 TPSA
200 100
TPSA

5 10 15 20 25 30 35 Predicted TPSA
150 50
LogP2 100 0 TPSA
TPSA

-2.5 -2.4 -2.3 -2.2 -2.1 -2 -1.950

-1.8 -1.7 -1.6 Predicted TPSA
Hy 0
-0.6 -0.4 -0.2 0 0.2 0.4 0.6
QOmin
SUMMARY OUTPUT

Regression Statistics LogP

Multiple R 0.992748
250
R Square 0.985549 200
Adjusted R 0.981936 150

TPSA
Standard E 5.305424 100
50
Observatio 16 0
5 10 15
ANOVA L
df SS MS F Significance F
Regression 3 23035.3 7678.434 272.7925 2.655E-11
Residual 12 337.7703 28.14753
Total 15 23373.07

Coefficients
Standard Error t Stat P-value Lower 95%Upper 95%Lower 95.0%
Upper 95.0%
Intercept -76.54812 21.37164 -3.581763 0.00377 -123.1129 -29.98333 -123.1129 -29.98333
LogP2 2.570726 0.296515 8.669795 1.636E-06 1.924675 3.216777 1.924675 3.216777
Hy -54.49067 8.579339 -6.351384 3.657E-05 -73.18345 -35.7979 -73.18345 -35.7979
LDI 209.8257 71.66494 2.927871 0.012654 53.68118 365.9702 53.68118 365.9702

RESIDUAL OUTPUT

Observation
Predicted TPSA
Residuals
1 96.56809 -6.418095
2 96.56809 -6.418095
3 111.0401 -0.660109
4 111.0401 -0.660109 activity= -76.548+ 2.571LogP2- 54.491Hy+ 209.826LDI+ C
5 114.6843 -4.304267
6 189.8828 -0.352808 R Square 0.985549
7 191.5151 -1.98514 Fvalue 2.655E-11
8 189.8828 -0.352808 Intercept 0.00377
9 189.8828 -0.352808 LogP2 1.636E-06
10 110.0248 6.145249 Hy 3.657E-05
11 111.2184 10.16157 LDI 0.012654
12 143.9482 1.601835
13 98.06975 -0.079749
14 114.6843 -4.304267
15 119.1176 8.332404
16 189.8828 -0.352808
 LogP2 Line Fit Plot
250
200 Hy Line Fit Plot
150 TPSA
250
TPSA

100
50
LDI Line Fit Plot
Predicted TPSA
200
0 150 TPSA
250
TPSA

5 10 15 2020025 30 35 100 Predicted TPSA

50
LogP2 150 0 TPSA
TPSA

100
-2.5 -2.4 -2.3 -2.2 -2.1 -2 -1.9 -1.8 -1.7 -1.6 Predicted TPSA
50
0 Hy
0.26 0.28 0.3 0.32 0.34 0.36 0.38
LDI

209.826LDI+ C
SUMMARY OUTPUT

Regression Statistics LogP

Multiple R 0.98803
200
R Square 0.976203 150
Adjusted R 0.970253 100

TPSA
Standard E 6.808168 50
Observatio 16 0
5 10 15
ANOVA L
df SS MS F Significance F
Regression 3 22816.86 7605.62 164.087 5.272E-10
Residual 12 556.2138 46.35115
Total 15 23373.07

Coefficients
Standard Error t Stat P-value Lower 95%Upper 95%Lower 95.0%
Upper 95.0%
Intercept -29.0675 22.15323 -1.312111 0.214028 -77.33524 19.20024 -77.33524 19.20024
LogP2 4.250749 0.194286 21.87886 4.877E-11 3.827437 4.674062 3.827437 4.674062
QHmax 465.2221 151.4361 3.072069 0.00968 135.2713 795.1729 135.2713 795.1729
QCmax -21.37161 75.25477 -0.28399 0.781259 -185.3377 142.5944 -185.3377 142.5944

RESIDUAL OUTPUT

Observation
Predicted TPSA
Residuals
1 94.45779 -4.307792
2 94.45779 -4.307792
3 110.0324 0.34758
4 110.0324 0.34758
5 109.8985 0.48147
6 189.8526 -0.32264
7 188.1832 1.346837
8 189.8526 -0.32264
9 188.8795 0.650547
10 111.3642 4.805799
11 121.3655 0.014509
12 129.8401 15.7099
13 96.94436 1.045639
14 109.8985 0.48147
15 143.0978 -15.64783
16 189.8526 -0.32264
 LogP2 Line Fit Plot
200
150 QHmax Line Fit Plot
100 TPSA
200
TPSA

50 150
QCmax Line Fit Plot
Predicted TPSA
0 100 TPSA
200
TPSA

5 10 5015 20 25 30 35 Predicted TPSA

150
0 LogP2 100 TPSA
TPSA

0.2 0.22500.24 0.26 0.28 0.3 0.32 Predicted TPSA

0 QHmax
0.05 0.1 0.15 0.2 0.25 0.3 0.35
QCmax
SUMMARY OUTPUT

Regression Statistics LogP

Multiple R 0.988479
200
R Square 0.977091 150
Adjusted R 0.971364 100

TPSA
Standard E 6.679919 50
Observatio 16 0
5 10 15
ANOVA L
df SS MS F Significance F
Regression 3 22837.62 7612.539 170.6032 4.198E-10
Residual 12 535.4557 44.62131
Total 15 23373.07

Coefficients
Standard Error t Stat P-value Lower 95%Upper 95%Lower 95.0%
Upper 95.0%
Intercept -25.84046 15.46313 -1.671102 0.120555 -59.53173 7.850807 -59.53173 7.850807
LogP2 4.268026 0.191102 22.33373 3.831E-11 3.85165 4.684403 3.85165 4.684403
QHmax 440.4208 66.24948 6.647914 2.367E-05 296.0756 584.7661 296.0756 584.7661
QOmin 6.646086 8.969883 0.740933 0.472984 -12.89761 26.18978 -12.89761 26.18978

RESIDUAL OUTPUT

Observation
Predicted TPSA
Residuals
1 94.182 -4.032
2 93.8497 -3.699696
3 109.4692 0.910792
4 109.4692 0.910792
5 110.0576 0.322392
6 189.6782 -0.148229
7 188.7206 0.809437
8 189.6782 -0.148229
9 188.7974 0.732613
10 115.8075 0.362526
11 119.3353 2.044743
12 129.7529 15.79712
13 96.34754 1.642458
14 110.0576 0.322392
15 143.1289 -15.67888
16 189.6782 -0.148229
 LogP2 Line Fit Plot
200
150 QHmax Line Fit Plot
100 TPSA
200
TPSA

50 150
QOmin Line Fit Plot
Predicted TPSA
0 100 TPSA
200
TPSA

5 10 5015 20 25 30 35 Predicted TPSA

150
0 LogP2 100 TPSA
TPSA

0.2 0.22 0.24 0.26 0.28 Predicted TPSA

50 0.3 0.32
QHmax 0
-0.6 -0.4 -0.2 0 0.2 0.4 0.6
QOmin
SUMMARY OUTPUT

Regression Statistics LogP

Multiple R 0.990185
200
R Square 0.980466 150
Adjusted R 0.975582 100

TPSA
Standard E 6.168288 50
Observatio 16 0
5 10 15
ANOVA L
df SS MS F Significance F
Regression 3 22916.5 7638.833 200.7695 1.616E-10
Residual 12 456.5734 38.04778
Total 15 23373.07

Coefficients
Standard Error t Stat P-value Lower 95%Upper 95%Lower 95.0%
Upper 95.0%
Intercept 15.11113 27.97437 0.540178 0.598957 -45.83979 76.06206 -45.83979 76.06206
LogP2 4.188223 0.176119 23.78064 1.832E-11 3.804492 4.571953 3.804492 4.571953
QHmax 586.4683 113.4538 5.169224 0.000233 339.2737 833.663 339.2737 833.663
LDI -240.2429 145.7471 -1.648355 0.125194 -557.7985 77.31267 -557.7985 77.31267

RESIDUAL OUTPUT

Observation
Predicted TPSA
Residuals
1 93.00017 -2.850167
2 93.00017 -2.850167
3 110.7692 -0.389186
4 110.7692 -0.389186
5 107.3972 2.982828
6 189.9589 -0.428944
7 186.7887 2.741324
8 189.9589 -0.428944
9 188.786 0.743993
10 113.7717 2.398309
11 127.3495 -5.969482
12 132.0213 13.52875
13 96.02 1.970004
14 107.3972 2.982828
15 141.063 -13.61301
16 189.9589 -0.428944
 LogP2 Line Fit Plot
200
150 QHmax Line Fit Plot
100 TPSA
200
TPSA

50 150
LDI Line Fit Plot
Predicted TPSA
0 100 TPSA
200
TPSA

5 10 5015 20 25 30 35 Predicted TPSA

150
0 LogP2 100 TPSA
TPSA

0.2 0.22500.24 0.26 0.28 0.3 0.32 Predicted TPSA

0 QHmax
0.26 0.28 0.3 0.32 0.34 0.36 0.38
LDI
SUMMARY OUTPUT

Regression Statistics LogP

Multiple R 0.978959
250
R Square 0.958361 200
Adjusted R 0.947951 150

TPSA
Standard E 9.005751 100
50
Observatio 16 0
5 10 15
ANOVA L
df SS MS F Significance F
Regression 3 22399.83 7466.61 92.06268 1.501E-08
Residual 12 973.2426 81.10355
Total 15 23373.07

Coefficients
Standard Error t Stat P-value Lower 95%Upper 95%Lower 95.0%
Upper 95.0%
Intercept 34.91481 10.45867 3.338361 0.005906 12.12733 57.70229 12.12733 57.70229
LogP2 4.100024 0.249785 16.41421 1.381E-09 3.555789 4.644259 3.555789 4.644259
QCmax 194.6878 44.76224 4.349376 0.000946 97.15927 292.2164 97.15927 292.2164
QOmin 6.118852 12.19583 0.501717 0.624945 -20.45358 32.69129 -20.45358 32.69129

RESIDUAL OUTPUT

Observation
Predicted TPSA
Residuals
1 95.81346 -5.663463
2 95.50752 -5.357521
3 110.7085 -0.328482
4 110.7085 -0.328482
5 117.4692 -7.089225
6 188.3443 1.18571
7 194.3058 -4.775812
8 188.3443 1.18571
9 188.7337 0.796334
10 114.4464 1.723622
11 106.8201 14.55987
12 123.9141 21.63591
13 99.73303 -1.743027
14 117.4692 -7.089225
15 137.3476 -9.897627
16 188.3443 1.18571
 LogP2 Line Fit Plot
250
200 QCmax Line Fit Plot
150 TPSA
250
TPSA

100
50 200 QOmin Line Fit Plot
Predicted TPSA
0 150 TPSA
250
TPSA

5 100
10 15 20 25 30 35 Predicted TPSA
50 200
0 LogP2 150 TPSA
TPSA

100
0.05 0.1 0.15 0.2 0.25 0.3 0.35 Predicted TPSA
50
QCmax 0
-0.6 -0.4 -0.2 0 0.2 0.4 0.6
QOmin
SUMMARY OUTPUT

Regression Statistics LogP

Multiple R 0.992837
250
R Square 0.985725 200
Adjusted R 0.982157 150

TPSA
Standard E 5.272903 100
50
Observatio 16 0
5 10 15
ANOVA L
df SS MS F Significance F
Regression 3 23039.43 7679.81 276.2174 2.47E-11
Residual 12 333.642 27.8035
Total 15 23373.07

Coefficients
Standard Error t Stat P-value Lower 95%Upper 95%Lower 95.0%
Upper 95.0%
Intercept 377.5499 70.66722 5.342646 0.000176 223.5793 531.5205 223.5793 531.5205
LogP2 3.54032 0.181534 19.50224 1.872E-10 3.144792 3.935849 3.144792 3.935849
QCmax 729.1582 113.8925 6.402164 3.392E-05 481.0078 977.3085 481.0078 977.3085
LDI -1434.493 294.4224 -4.872226 0.000384 -2075.984 -793.0013 -2075.984 -793.0013

RESIDUAL OUTPUT

Observation
Predicted TPSA
Residuals
1 87.03099 3.119005
2 87.03099 3.119005
3 115.0945 -4.714516 Activity= 377.550+ 3.540LogP2+ 729.158QCmax- 1434.490LDI+ C
4 115.0945 -4.714516
5 115.6057 -5.225728
6 186.6842 2.845781
7 197.7485 -8.218455
8 186.6842 2.845781
9 188.1425 1.387465
10 119.4631 -3.29312
11 113.8153 7.564724
12 138.2569 7.293087
13 97.91519 0.07481
14 115.6057 -5.225728
15 127.1534 0.296623
16 186.6842 2.845781
 LogP2 Line Fit Plot
250
200 QCmax Line Fit Plot
150 TPSA
250
TPSA

100
50 200 LDI Line Fit Plot
Predicted TPSA
0 150 TPSA
250
TPSA

5 100
10 15 2020025 30 35 Predicted TPSA
50
0 LogP2 150 TPSA
TPSA

100
0.05 0.1 0.15 0.2 0.25 0.3 0.35 Predicted TPSA
50
0 QCmax
0.26 0.28 0.3 0.32 0.34 0.36 0.38
LDI

R Square 0.985725
Fvalue 2.47E-11
Intercept 0.000176
LogP2 1.872E-10
QCmax 3.392E-05
LDI 0.000384

Cmax- 1434.490LDI+ C
SUMMARY OUTPUT

Regression Statistics QCma

Multiple R 0.94699
200
R Square 0.896791 150
Adjusted R 0.870988 100

TPSA
Standard E 14.1784 50
Observatio 16 0
0.05 0.1 0.15
ANOVA Q
df SS MS F Significance F
Regression 3 20960.75 6986.917 34.75612 3.384E-06
Residual 12 2412.323 201.0269
Total 15 23373.07

Coefficients
Standard Error t Stat P-value Lower 95%Upper 95%Lower 95.0%
Upper 95.0%
Intercept -84.19814 49.36382 -1.705665 0.113796 -191.7527 23.35637 -191.7527 23.35637
QCmax -35.26076 157.2134 -0.224286 0.826308 -377.7994 307.2779 -377.7994 307.2779
QHmax -44.96182 305.1914 -0.147323 0.885323 -709.9168 619.9931 -709.9168 619.9931
Hy -120.2136 11.95354 -10.05674 3.369E-07 -146.2581 -94.16907 -146.2581 -94.16907

RESIDUAL OUTPUT

Observation
Predicted TPSA
Residuals
1 99.44704 -9.297035
2 99.44704 -9.297035
3 115.1598 -4.779755
4 115.1598 -4.779755
5 113.9159 -3.535927
6 183.3353 6.194711
7 182.3321 7.197871
8 183.3353 6.194711
9 183.3547 6.175309
10 115.5476 0.622377
11 117.8237 3.556286
12 176.5343 -30.98428
13 99.36066 -1.370655
14 113.9159 -3.535927
15 96.00561 31.44439
16 183.3353 6.194711
 QCmax Line Fit Plot
200
150 QHmax Line Fit Plot
100 TPSA
200
TPSA

50 150
Hy Line Fit Plot
Predicted TPSA
0 100 TPSA
200
TPSA

0.05 0.1 500.15 0.2 0.25 0.3 0.35 Predicted TPSA

150
0 QCmax 100 TPSA
TPSA

0.2 0.22 0.24 0.26 0.28 0.3 0.32 Predicted TPSA

50
QHmax 0
-2.5 -2.4 -2.3 -2.2 -2.1 -2 -1.9 -1.8 -1.7 -1.6
Hy
SUMMARY OUTPUT

Regression Statistics QOm

Multiple R 0.946763
200
R Square 0.896361 150
Adjusted R 0.870451 100

TPSA
Standard E 14.20789 50
Observatio 16 0
-0.6 -0.4 -0.2
ANOVA Q
df SS MS F Significance F
Regression 3 20950.7 6983.567 34.59537 3.469E-06
Residual 12 2422.371 201.8642
Total 15 23373.07

Coefficients
Standard Error t Stat P-value Lower 95%Upper 95%Lower 95.0%
Upper 95.0%
Intercept -76.62227 35.99588 -2.12864 0.054687 -155.0505 1.806005 -155.0505 1.806005
QOmin 0.340986 18.99542 0.017951 0.985973 -41.04648 41.72845 -41.04648 41.72845
QHmax -106.4721 132.6125 -0.802882 0.437657 -395.4099 182.4656 -395.4099 182.4656
Hy -119.7274 11.91867 -10.04536 3.41E-07 -145.696 -93.75885 -145.696 -93.75885

RESIDUAL OUTPUT

Observation
Predicted TPSA
Residuals
1 99.45114 -9.30114
2 99.43409 -9.28409
3 115.1163 -4.736335
4 115.1163 -4.736335
5 115.0109 -4.630886
6 183.1215 6.408497
7 183.3344 6.195553
8 183.1215 6.408497
9 183.3344 6.195553
10 115.385 0.784968
11 115.3293 6.050721
12 176.2907 -30.7407
13 99.63885 -1.648851
14 115.0109 -4.630886
15 96.19306 31.25694
16 183.1215 6.408497
 QOmin Line Fit Plot
200
150 QHmax Line Fit Plot
TPSA
200100
TPSA

150 50
Hy Line Fit Plot
Predicted TPSA

100 0 TPSA
200
TPSA

-0.6 -0.4 -0.2 0 0.2 0.4 0.6 Predicted TPSA

50 150
0 QOmin 100 TPSA
TPSA

0.2 0.22 0.24 0.26 0.28 0.3 0.32 Predicted TPSA

50
QHmax 0
-2.5 -2.4 -2.3 -2.2 -2.1 -2 -1.9 -1.8 -1.7 -1.6
Hy
SUMMARY OUTPUT

Regression Statistics LDI

Multiple R 0.946762
200
R Square 0.896358 150
Adjusted R 0.870447 100

TPSA
Standard E 14.20808 50
Observatio 16 0
0.26 0.28 0.3
ANOVA
df SS MS F Significance F
Regression 3 20950.64 6983.547 34.59437 3.469E-06
Residual 12 2422.433 201.8694
Total 15 23373.07

Coefficients
Standard Error t Stat P-value Lower 95%Upper 95%Lower 95.0%
Upper 95.0%
Intercept -76.34338 69.21968 -1.102914 0.291692 -227.1601 74.47335 -227.1601 74.47335
LDI -1.183156 341.7193 -0.003462 0.997294 -745.7256 743.3593 -745.7256 743.3593
QHmax -106.1983 270.7583 -0.392225 0.701769 -696.13 483.7335 -696.13 483.7335
Hy -119.6806 12.16118 -9.841195 4.256E-07 -146.1775 -93.18363 -146.1775 -93.18363

RESIDUAL OUTPUT

Observation
Predicted TPSA
Residuals
1 99.45668 -9.30668
2 99.45668 -9.30668
3 115.1467 -4.766667
4 115.1467 -4.766667
5 115.0204 -4.640355
6 183.1276 6.402402
7 183.3305 6.199471
8 183.1276 6.402402
9 183.34 6.190005
10 115.1561 1.013868
11 115.3946 5.985442
12 176.2862 -30.73619
13 99.67263 -1.682626
14 115.0204 -4.640355
15 96.19977 31.25023
16 183.1276 6.402402
 LDI Line Fit Plot
200
150 QHmax Line Fit Plot
100 TPSA
200
TPSA

50 150
Hy Line Fit Plot
Predicted TPSA
0 100 TPSA
200
TPSA

0.26 0.28500.3 0.32 0.34 0.36 0.38 Predicted TPSA

150
0 LDI 100 TPSA
TPSA

0.2 0.22 0.24 0.26 0.28 0.3 0.32 Predicted TPSA

50
QHmax 0
-2.5 -2.4 -2.3 -2.2 -2.1 -2 -1.9 -1.8 -1.7 -1.6
Hy
SUMMARY OUTPUT

Regression Statistics QOm

Multiple R 0.211239
200
R Square 0.044622 150
Adjusted R-0.194223 100

TPSA
Standard E 43.1375 50
Observatio 16 0
-0.6 -0.4 -0.2
ANOVA Q
df SS MS F Significance F
Regression 3 1042.948 347.6494 0.186824 0.90332
Residual 12 22330.12 1860.844
Total 15 23373.07

Coefficients
Standard Error t Stat
Intercept 183.7417 125.8988 1.459439
QOmin -27.15353 57.59184 -0.471482
QHmax -473.9664 919.3998 -0.515517
QCmax 236.8685 475.2621 0.498396
P-value Lower 95%Upper 95%Lower 95.0%
Upper 95.0%
0.170122 -90.56829 458.0516 -90.56829 458.0516
0.645753 -152.6354 98.32832 -152.6354 98.32832
0.615556 -2477.167 1529.234 -2477.167 1529.234
0.627214 -798.6387 1272.376 -798.6387 1272.376

RESIDUAL OUTPUT

Observation
Predicted TPSA
Residuals
1 135.3117 -45.16166
2 136.6693 -46.51933
3 137.0691 -26.68912
4 137.0691 -26.68912
5 144.5672 -34.18723
6 137.7797 51.75027
7 146.0706 43.45941
8 137.7797 51.75027
9 139.2014 50.3286
10 113.0666 3.103409
11 120.7257 0.654347
12 135.0945 10.4555
13 139.4533 -41.46329
14 144.5672 -34.18723
15 135.8051 -8.355106
16 137.7797 51.75027
 QOmin Line Fit Plot
200
150 QHmax Line Fit Plot
TPSA
200100
TPSA

150 50
QCmax Line Fit Plot
Predicted TPSA

100 0 TPSA
200
TPSA

-0.6 -0.4 -0.2 0 0.2 0.4 0.6 Predicted TPSA

50 150
0 QOmin100 TPSA
TPSA

0.2 0.22500.24 0.26 0.28 0.3 0.32 Predicted TPSA

0 QHmax
0.05 0.1 0.15 0.2 0.25 0.3 0.35
QCmax
SUMMARY OUTPUT

Regression Statistics LDI

Multiple R 0.751536
200
R Square 0.564807 150
Adjusted R 0.456009 100

TPSA
Standard E 29.11443 50
Observatio 16 0
0.26 0.28 0.3
ANOVA
df SS MS F Significance F
Regression 3 13201.27 4400.424 5.191321 0.015761
Residual 12 10171.8 847.6501
Total 15 23373.07

Coefficients
Standard Error t Stat
Intercept 1347.701 312.3119 4.315242
LDI -4971.884 1291.004 -3.851177
QHmax -578.3574 620.4446 -0.932166
QCmax 2254.693 604.2644 3.731302
P-value Lower 95%Upper 95%Lower 95.0%Upper 95.0%
0.001005 667.2323 2028.171 667.2323 2028.171
0.002305 -7784.739 -2159.029 -7784.739 -2159.029
0.369627 -1930.19 773.4752 -1930.19 773.4752
0.002867 938.1139 3571.272 938.1139 3571.272

RESIDUAL OUTPUT

Observation
Predicted TPSA
Residuals
1 85.89237 4.25763
2 85.89237 4.25763
3 137.8659 -27.4859
4 137.8659 -27.4859
5 129.4251 -19.04508
6 154.5737 34.95625
7 185.8509 3.679129
8 154.5737 34.95625
9 160.2398 29.29015
10 152.8394 -36.66935
11 123.5866 -2.206551
12 174.9626 -29.41259
13 113.2382 -15.2482
14 129.4251 -19.04508
15 97.20465 30.24535
16 154.5737 34.95625
 LDI Line Fit Plot
200
150 QHmax Line Fit Plot
100 TPSA
200
TPSA

50 150
QCmax Line Fit Plot
Predicted TPSA
0 100 TPSA
200
TPSA

0.26 0.28500.3 0.32 0.34 0.36 0.38 Predicted TPSA

150
0 LDI 100 TPSA
TPSA

0.2 0.22500.24 0.26 0.28 0.3 0.32 Predicted TPSA

0 QHmax
0.05 0.1 0.15 0.2 0.25 0.3 0.35
QCmax
SUMMARY OUTPUT

Regression Statistics LDI

Multiple R 0.774638
200
R Square 0.600064 150
Adjusted R 0.50008 100

TPSA
Standard E 27.91018 50
Observatio 16 0
0.26 0.28 0.3
ANOVA
df SS MS F Significance F
Regression 3 14025.33 4675.112 6.001595 0.009722
Residual 12 9347.738 778.9782
Total 15 23373.07

Coefficients
Standard Error t Stat P-value Lower 95%Upper 95%Lower 95.0%
Upper 95.0%
Intercept 1321.064 289.4396 4.564215 0.00065 690.4298 1951.699 690.4298 1951.699
LDI -5211.155 1252.856 -4.159419 0.001324 -7940.894 -2481.415 -7940.894 -2481.415
QOmin -53.38493 37.71667 -1.41542 0.182371 -135.5625 28.79264 -135.5625 28.79264
QCmax 2026.103 501.5228 4.039903 0.00164 933.3791 3118.828 933.3791 3118.828

RESIDUAL OUTPUT

Observation
Predicted TPSA
Residuals
1 84.00517 6.144829
2 86.67442 3.475583
3 141.1324 -30.75238
4 141.1324 -30.75238
5 121.2701 -10.89011
6 157.633 31.897
7 178.753 10.77703
8 157.633 31.897
9 161.6852 27.8448
10 118.4672 -2.297155
11 149.5615 -28.18147
12 184.9757 -39.42567
13 113.7196 -15.72964
14 121.2701 -10.89011
15 102.4643 24.98565
16 157.633 31.897
 LDI Line Fit Plot
200
150 QOmin Line Fit Plot
100 TPSA
200
TPSA

50 150
QCmax Line Fit Plot
Predicted TPSA
0 TPSA
200100
TPSA

0.26 0.28 0.3 0.32 0.34 0.36 0.38 Predicted TPSA

150 50
LDI 100 0 TPSA
TPSA

-0.6 -0.4 -0.2 0 0.2 0.4 0.6 Predicted TPSA

50
0 QOmin
0.05 0.1 0.15 0.2 0.25 0.3 0.35
QCmax
SUMMARY OUTPUT

Regression Statistics LogP

Multiple R 0.978959
250
R Square 0.958361 200
Adjusted R 0.947951 150

TPSA
Standard E 9.005751 100
50
Observatio 16 0
5 10 15
ANOVA L
df SS MS F Significance F
Regression 3 22399.83 7466.61 92.06268 1.501E-08
Residual 12 973.2426 81.10355
Total 15 23373.07

Coefficients
Standard Error t Stat P-value Lower 95%Upper 95%Lower 95.0%
Upper 95.0%
Intercept 34.91481 10.45867 3.338361 0.005906 12.12733 57.70229 12.12733 57.70229
LogP2 4.100024 0.249785 16.41421 1.381E-09 3.555789 4.644259 3.555789 4.644259
QOmin 6.118852 12.19583 0.501717 0.624945 -20.45358 32.69129 -20.45358 32.69129
QCmax 194.6878 44.76224 4.349376 0.000946 97.15927 292.2164 97.15927 292.2164

RESIDUAL OUTPUT

Observation
Predicted TPSA
Residuals
1 95.81346 -5.663463
2 95.50752 -5.357521
3 110.7085 -0.328482
4 110.7085 -0.328482
5 117.4692 -7.089225
6 188.3443 1.18571
7 194.3058 -4.775812
8 188.3443 1.18571
9 188.7337 0.796334
10 114.4464 1.723622
11 106.8201 14.55987
12 123.9141 21.63591
13 99.73303 -1.743027
14 117.4692 -7.089225
15 137.3476 -9.897627
16 188.3443 1.18571
 LogP2 Line Fit Plot
250
200 QOmin Line Fit Plot
150 TPSA
250
TPSA

100
50 200 QCmax Line Fit Plot
Predicted TPSA
0 150 TPSA
250100
TPSA

5 10 15 2020025 30 35 Predicted TPSA

50
LogP2 150 0 TPSA
TPSA

100
-0.6 -0.4 -0.2 0 0.2 0.4 0.6 Predicted TPSA
50
0 QOmin
0.05 0.1 0.15 0.2 0.25 0.3 0.35
QCmax
SUMMARY OUTPUT

Regression Statistics LDI

Multiple R 0.946065
200
R Square 0.895039 150
Adjusted R 0.868799 100

TPSA
Standard E 14.29817 50
Observatio 16 0
0.26 0.28 0.3
ANOVA
df SS MS F Significance F
Regression 3 20919.82 6973.274 34.10954 3.741E-06
Residual 12 2453.252 204.4377
Total 15 23373.07

Coefficients
Standard Error t Stat P-value Lower 95%Upper 95%Lower 95.0%
Upper 95.0%
Intercept -60.41504 59.56007 -1.014355 0.33043 -190.1853 69.3552 -190.1853 69.3552
LDI -120.9719 173.6252 -0.696742 0.499239 -499.2687 257.3248 -499.2687 257.3248
Hy -118.346 12.08417 -9.793473 4.485E-07 -144.6751 -92.01684 -144.6751 -92.01684
QOmin -0.670906 19.70559 -0.034046 0.9734 -43.6057 42.26389 -43.6057 42.26389

RESIDUAL OUTPUT

Observation
Predicted TPSA
Residuals
1 98.64116 -8.491158
2 98.6747 -8.524703
3 115.3918 -5.011771
4 115.3918 -5.011771
5 113.3332 -2.953236
6 182.8542 6.675768
7 181.8865 7.643543
8 182.8542 6.675768
9 182.8542 6.675768
10 115.8309 0.339127
11 119.0209 2.359071
12 178.6326 -33.0826
13 99.05372 -1.06372
14 113.3332 -2.953236
15 97.40262 30.04738
16 182.8542 6.675768
 LDI Line Fit Plot
200
150 Hy Line Fit Plot
100 TPSA
200
TPSA

50 QOmin Line Fit Plot

Predicted TPSA
150
0 TPSA
200 100
TPSA

0.26 0.28 0.3 0.32 0.34 0.36 0.38 Predicted TPSA

150 50
LDI 100 0 TPSA
TPSA

-2.5 -2.4 -2.3 -2.2 -2.1 -2 -1.950

-1.8 -1.7 -1.6 Predicted TPSA
Hy 0
-0.6 -0.4 -0.2 0 0.2 0.4 0.6
QOmin
SUMMARY OUTPUT

Regression Statistics LDI

Multiple R 0.96845
250
R Square 0.937895 200
Adjusted R 0.922369 150

TPSA
Standard E 10.99841 100
50
Observatio 16 0
0.26 0.28 0.3
ANOVA
df SS MS F Significance F
Regression 3 21921.49 7307.165 60.40731 1.637E-07
Residual 12 1451.579 120.9649
Total 15 23373.07

Coefficients
Standard Error t Stat P-value Lower 95%Upper 95%Lower 95.0%
Upper 95.0%
Intercept -59.89513 45.52679 -1.315602 0.212889 -159.0895 39.29922 -159.0895 39.29922
LDI 427.8683 144.8196 2.954491 0.012043 112.3335 743.4031 112.3335 743.4031
LogP2 4.222578 0.323498 13.05288 1.884E-08 3.517737 4.92742 3.517737 4.92742
QOmin 6.459481 15.26339 0.423201 0.679634 -26.79659 39.71555 -26.79659 39.71555

RESIDUAL OUTPUT

Observation
Predicted TPSA
Residuals
1 99.57261 -9.422614
2 99.24964 -9.09964
3 110.4248 -0.044841
4 110.4248 -0.044841
5 117.8447 -7.464657
6 188.924 0.605978
7 192.271 -2.740961
8 188.924 0.605978
9 188.924 0.605978
10 113.1814 2.988609
11 108.2212 13.15875
12 115.7301 29.81989
13 101.3115 -3.321525
14 117.8447 -7.464657
15 136.2374 -8.787431
16 188.924 0.605978
 LDI Line Fit Plot
250
200 LogP2 Line Fit Plot
150 TPSA
250
TPSA

100
50 200 QOmin Line Fit Plot
Predicted TPSA
0 150 TPSA
250
TPSA

100
0.26 0.28 0.3 0.32 0.34 0.36 0.38 Predicted TPSA
50 200
0 LDI 150 TPSA
TPSA

5 100
10 15 20 25 30 35 Predicted TPSA
50
LogP2 0
-0.6 -0.4 -0.2 0 0.2 0.4 0.6
QOmin
SUMMARY OUTPUT

Regression Statistics L
Multiple R 0.949111
200
R Square 0.900811 150
Adjusted R 0.876014 100

TPSA
Standard E 13.8995 50
Observatio 16 0
0.26 0.28
ANOVA
df SS MS F Significance F
Regression 3 21054.72 7018.239 36.327 2.671E-06
Residual 12 2318.355 193.1962
Total 15 23373.07

Coefficients
Standard Error t Stat P-value Lower 95%Upper 95%Lower 95.0%
Upper 95.0%
Intercept -283.9639 272.4201 -1.042375 0.317784 -877.5164 309.5885 -877.5164 309.5885
LDI 749.7379 1050.902 0.713423 0.489227 -1539.98 3039.456 -1539.98 3039.456
Hy -131.9043 19.78162 -6.668025 2.3E-05 -175.0048 -88.80388 -175.0048 -88.80388
QCmax -358.7362 428.9353 -0.836341 0.419306 -1293.306 575.8334 -1293.306 575.8334

RESIDUAL OUTPUT

Observation
Predicted TPSA
Residuals
1 103.3986 -13.24861
2 103.3986 -13.24861
3 112.822 -2.441963
4 112.822 -2.441963
5 113.3705 -2.990474
6 185.1679 4.362067
7 180.045 9.484988
8 185.1679 4.362067
9 184.4505 5.07954
10 110.7702 5.399841
11 116.5176 4.862426
12 174.3799 -28.82992
13 99.35572 -1.365717
14 113.3705 -2.990474
15 97.80526 29.64474
16 185.1679 4.362067
 LDI Line Fit Plot
200
150 Hy Line Fit Plot
100 TPSA
200
TPSA

50 QCmax Line Fit Plot

Predicted TPSA
150
0 100 TPSA
200
TPSA

0.26 0.28 0.3 0.32 0.34 0.36 0.38 Predicted TPSA

150 50
LDI 100 0 TPSA
TPSA

-2.5 -2.4 -2.3 -2.2 Predicted TPSA

50 -2.1 -2 -1.9 -1.8 -1.7 -1.6
0 Hy
0.05 0.1 0.15 0.2 0.25 0.3 0.35
QCmax
SACCHARIDE TPSA LogP2 0.943339 TPSA Hy -0.943618
RIBOSE 90.15 6.668 90.15 -1.661
ARABINOSE 90.15 6.668 90.15 -1.661
Galactose 110.38 10.337 110.38 -1.792
Glucose 110.38 10.337 110.38 -1.792
fructose 110.38 10.367 110.38 -1.792
Maltose 189.53 29.13 189.53 -2.36
SUCROSE 189.53 29.112 189.53 -2.36
LACTOSE 189.53 29.13 189.53 -2.36
TREHALOSE 189.53 29.13 189.53 -2.36
BETA D GLUSAMINE 116.17 10.595 116.17 -1.792
MANNITOL 121.38 12.855 121.38 -1.792
N-acetylmuramic acid 145.55 6.657 145.55 -2.377
RIBULOSE 97.99 7.497 97.99 -1.661
TAGATOSE 110.38 10.367 110.38 -1.792
Galacturonic Acid 127.45 9.791 127.45 -1.708
Cellobiose 189.53 29.13 189.53 -2.36

TPSA Hy LogP2 LDI Predicted TPSA

90.15 -1.661 6.668 0.312 96.56809 -6.418095
90.15 -1.661 6.668 0.312 96.56809 -6.418095
110.38 -1.792 10.337 0.302 111.0401 -0.660109 R Square 0.985549
110.38 -1.792 10.337 0.302 111.0401 -0.660109 Fvalue 2.655E-11
110.38 -1.792 10.367 0.319 114.6843 -4.304267 Intercept 0.00377
189.53 -2.36 29.13 0.3 189.8828 -0.352808 Hy 3.657E-05
189.53 -2.36 29.112 0.308 191.5151 -1.98514 LogP2 1.636E-06
189.53 -2.36 29.13 0.3 189.8828 -0.352808 LDI 0.012654
189.53 -2.36 29.13 0.3 189.8828 -0.352808
116.17 -1.792 10.595 0.294 110.0248 6.145249 activity= -76.548- 54.491Hy+ 2.571Lo
121.38 -1.792 12.855 0.272 111.2184 10.16157
145.55 -2.377 6.657 0.352 143.9482 1.601835
97.99 -1.661 7.497 0.309 98.06975 -0.079749
110.38 -1.792 10.367 0.319 114.6843 -4.304267
127.45 -1.708 9.791 0.369 119.1176 8.332404
189.53 -2.36 29.13 0.3 189.8828 -0.352808
4.745316

TPSA LogP2 Hy QHmax Predicted TPSA

90.15 6.668 -1.661 0.213 94.11689 -3.966891
90.15 6.668 -1.661 0.213 94.11689 -3.966891
110.38 10.337 -1.792 0.213 110.4759 -0.095929 R Square 0.996764
110.38 10.337 -1.792 0.213 110.4759 -0.095929 Fvalue 3.363E-15
110.38 10.367 -1.792 0.214 110.8341 -0.454076 Intercept 5.254E-06
189.53 29.13 -2.36 0.213 190.1108 -0.580761 LogP2 2.119E-10
189.53 29.112 -2.36 0.211 189.5212 0.008802 Hy 1.457E-06
 189.53 29.13 -2.36 0.213 190.1108 -0.580761 QHmax 1.189E-06
189.53 29.13 -2.36 0.211 189.5755 -0.04551
116.17 10.595 -1.792 0.213 111.2544 4.915594 activity= -50.061+ 3.017LogP2- 40.26
121.38 12.855 -1.792 0.211 117.5384 3.841635
145.55 6.657 -2.377 0.296 145.2011 0.348934
97.99 7.497 -1.661 0.211 96.08302 1.906977
110.38 10.367 -1.792 0.214 110.8341 -0.454076
127.45 9.791 -1.708 0.296 127.6504 -0.200356
189.53 29.13 -2.36 0.213 190.1108 -0.580761
2.245542

TPSA LogP2 Hy QCmax Predicted TPSA

90.15 6.668 -1.661 0.183 95.14182 -4.99182
90.15 6.668 -1.661 0.183 95.14182 -4.99182
110.38 10.337 -1.792 0.184 111.3839 -1.003898 R Square 0.987947
110.38 10.337 -1.792 0.184 111.3839 -1.003898 Fvalue 8.944E-12
110.38 10.367 -1.792 0.218 114.8447 -4.464706 Intercept 0.103005
189.53 29.13 -2.36 0.187 189.4638 0.066239 LogP2 5.967E-07
189.53 29.112 -2.36 0.218 192.4967 -2.966745 Hy 0.000135
189.53 29.13 -2.36 0.187 189.4638 0.066239 QCmax 0.003932
189.53 29.13 -2.36 0.189 189.6626 -0.132573
116.17 10.595 -1.792 0.173 110.9871 5.182932 activity= -20.121+ 2.700LogP2- 47.60
121.38 12.855 -1.792 0.111 110.9262 10.45379
145.55 6.657 -2.377 0.332 144.0067 1.543349
97.99 7.497 -1.661 0.188 97.87726 0.112735
110.38 10.367 -1.792 0.218 114.8447 -4.464706
127.45 9.791 -1.708 0.335 120.9214 6.528641
189.53 29.13 -2.36 0.187 189.4638 0.066239
4.333697

TPSA LogP2 Hy QOmin

90.15 6.668 -1.661 -0.338
90.15 6.668 -1.661 -0.388
110.38 10.337 -1.792 -0.394
110.38 10.337 -1.792 -0.394
110.38 10.367 -1.792 -0.391
189.53 29.13 -2.36 -0.394
189.53 29.112 -2.36 -0.394
189.53 29.13 -2.36 -0.394
189.53 29.13 -2.36 -0.394
116.17 10.595 -1.792 0.394
121.38 12.855 -1.792 -0.394
145.55 6.657 -2.377 -0.479
97.99 7.497 -1.661 -0.412
110.38 10.367 -1.792 -0.391
127.45 9.791 -1.708 -0.479
 189.53 29.13 -2.36 -0.394

TPSA LogP2 Hy LDI Predicted TPSA

0.312
90.15 6.668 -1.661 96.56809 -6.418095
90.15 6.668 -1.661 0.312 96.56809 -6.418095
110.38 10.337 -1.792 0.302 111.0401 -0.660109 R Square 0.985549
110.38 10.337 -1.792 0.302 111.0401 -0.660109 Fvalue 2.655E-11
110.38 10.367 -1.792 0.319 114.6843 -4.304267 Intercept 0.00377
189.53 29.13 -2.36 0.3 189.8828 -0.352808 LogP2 1.636E-06
189.53 29.112 -2.36 0.308 191.5151 -1.98514 Hy 3.657E-05
189.53 29.13 -2.36 0.3 189.8828 -0.352808 LDI 0.012654
189.53 29.13 -2.36 0.3 189.8828 -0.352808
116.17 10.595 -1.792 0.294 110.0248 6.145249 activity= -76.548+ 2.571LogP2- 54.49
121.38 12.855 -1.792 0.272 111.2184 10.16157
145.55 6.657 -2.377 0.352 143.9482 1.601835
97.99 7.497 -1.661 0.309 98.06975 -0.079749
110.38 10.367 -1.792 0.319 114.6843 -4.304267
127.45 9.791 -1.708 0.369 119.1176 8.332404
189.53 29.13 -2.36 0.3 189.8828 -0.352808
4.745316

TPSA LogP2 QHmax QCmax

90.15 6.668 0.213 0.183
90.15 6.668 0.213 0.183
110.38 10.337 0.213 0.184
110.38 10.337 0.213 0.184
110.38 10.367 0.214 0.218
189.53 29.13 0.213 0.187
189.53 29.112 0.211 0.218
189.53 29.13 0.213 0.187
189.53 29.13 0.211 0.189
116.17 10.595 0.213 0.173
121.38 12.855 0.211 0.111
145.55 6.657 0.296 0.332
97.99 7.497 0.211 0.188
110.38 10.367 0.214 0.218
127.45 9.791 0.296 0.335
189.53 29.13 0.213 0.187

TPSA LogP2 QHmax QOmin

-0.338
90.15 6.668 0.213
90.15 6.668 0.213 -0.388
110.38 10.337 0.213 -0.394
110.38 10.337 0.213 -0.394
110.38 10.367 0.214 -0.391
 189.53 29.13 0.213 -0.394
189.53 29.112 0.211 -0.394
189.53 29.13 0.213 -0.394
189.53 29.13 0.211 -0.394
116.17 10.595 0.213 0.394
121.38 12.855 0.211 -0.394
145.55 6.657 0.296 -0.479
97.99 7.497 0.211 -0.412
110.38 10.367 0.214 -0.391
127.45 9.791 0.296 -0.479
189.53 29.13 0.213 -0.394

TPSA LogP2 QHmax LDI

0.312
90.15 6.668 0.213
90.15 6.668 0.213 0.312
110.38 10.337 0.213 0.302
110.38 10.337 0.213 0.302
110.38 10.367 0.214 0.319
189.53 29.13 0.213 0.3
189.53 29.112 0.211 0.308
189.53 29.13 0.213 0.3
189.53 29.13 0.211 0.3
116.17 10.595 0.213 0.294
121.38 12.855 0.211 0.272
145.55 6.657 0.296 0.352
97.99 7.497 0.211 0.309
110.38 10.367 0.214 0.319
127.45 9.791 0.296 0.369
189.53 29.13 0.213 0.3

TPSA LogP2 QCmax QOmin

-0.338
90.15 6.668 0.183
90.15 6.668 0.183 -0.388
110.38 10.337 0.184 -0.394
110.38 10.337 0.184 -0.394
110.38 10.367 0.218 -0.391
189.53 29.13 0.187 -0.394
189.53 29.112 0.218 -0.394
189.53 29.13 0.187 -0.394
189.53 29.13 0.189 -0.394
116.17 10.595 0.173 0.394
121.38 12.855 0.111 -0.394
145.55 6.657 0.332 -0.479
97.99 7.497 0.188 -0.412
110.38 10.367 0.218 -0.391
 127.45 9.791 0.335 -0.479
189.53 29.13 0.187 -0.394

TPSA LogP2 QCmax LDI Predicted TPSA

0.312
90.15 6.668 0.183 87.03099 3.119005
90.15 6.668 0.183 0.312 87.03099 3.119005
110.38 10.337 0.184 0.302 115.0945 -4.714516
110.38 10.337 0.184 0.302 115.0945 -4.714516
110.38 10.367 0.218 0.319 115.6057 -5.225728
189.53 29.13 0.187 0.3 186.6842 2.845781
189.53 29.112 0.218 0.308 197.7485 -8.218455
189.53 29.13 0.187 0.3 186.6842 2.845781
189.53 29.13 0.189 0.3 188.1425 1.387465
116.17 10.595 0.173 0.294 119.4631 -3.29312
121.38 12.855 0.111 0.272 113.8153 7.564724
145.55 6.657 0.332 0.352 138.2569 7.293087
97.99 7.497 0.188 0.309 97.91519 0.07481
110.38 10.367 0.218 0.319 115.6057 -5.225728
127.45 9.791 0.335 0.369 127.1534 0.296623
189.53 29.13 0.187 0.3 186.6842 2.845781
4.716228

TPSA QCmax QHmax Hy

90.15 0.183 0.213 -1.661
90.15 0.183 0.213 -1.661
110.38 0.184 0.213 -1.792
110.38 0.184 0.213 -1.792
110.38 0.218 0.214 -1.792
189.53 0.187 0.213 -2.36
189.53 0.218 0.211 -2.36
189.53 0.187 0.213 -2.36
189.53 0.189 0.211 -2.36
116.17 0.173 0.213 -1.792
121.38 0.111 0.211 -1.792
145.55 0.332 0.296 -2.377
97.99 0.188 0.211 -1.661
110.38 0.218 0.214 -1.792
127.45 0.335 0.296 -1.708
189.53 0.187 0.213 -2.36

TPSA QOmin QHmax Hy

-0.338
0.213 -1.661
 -0.388
0.213 -1.661
-0.394 0.213 -1.792
-0.394 0.213 -1.792
-0.391 0.214 -1.792
-0.394 0.213 -2.36
-0.394 0.211 -2.36
-0.394 0.213 -2.36
-0.394 0.211 -2.36
0.394 0.213 -1.792
-0.394 0.211 -1.792
-0.479 0.296 -2.377
-0.412 0.211 -1.661
-0.391 0.214 -1.792
-0.479 0.296 -1.708
-0.394 0.213 -2.36

TPSA LDI QHmax Hy

0.312
0.213 -1.661
0.312 0.213 -1.661
0.302 0.213 -1.792
0.302 0.213 -1.792
0.319 0.214 -1.792
0.3 0.213 -2.36
0.308 0.211 -2.36
0.3 0.213 -2.36
0.3 0.211 -2.36
0.294 0.213 -1.792
0.272 0.211 -1.792
0.352 0.296 -2.377
0.309 0.211 -1.661
0.319 0.214 -1.792
0.369 0.296 -1.708
0.3 0.213 -2.36

TPSA QOmin QHmax QCmax

-0.338
0.213 0.183
-0.388
0.213 0.183
-0.394 0.213 0.184
-0.394 0.213 0.184
-0.391 0.214 0.218
-0.394 0.213 0.187
-0.394 0.211 0.218
-0.394 0.213 0.187
-0.394 0.211 0.189
0.394 0.213 0.173
 -0.394 0.211 0.111
-0.479 0.296 0.332
-0.412 0.211 0.188
-0.391 0.214 0.218
-0.479 0.296 0.335
-0.394 0.213 0.187

TPSA LDI QHmax QCmax

0.312
0.213 0.183
0.312 0.213 0.183
0.302 0.213 0.184
0.302 0.213 0.184
0.319 0.214 0.218
0.3 0.213 0.187
0.308 0.211 0.218
0.3 0.213 0.187
0.3 0.211 0.189
0.294 0.213 0.173
0.272 0.211 0.111
0.352 0.296 0.332
0.309 0.211 0.188
0.319 0.214 0.218
0.369 0.296 0.335
0.3 0.213 0.187

TPSA LDI QOmin QCmax

0.312 -0.338
0.183
0.312 -0.388 0.183
0.302 -0.394 0.184
0.302 -0.394 0.184
0.319 -0.391 0.218
0.3 -0.394 0.187
0.308 -0.394 0.218
0.3 -0.394 0.187
0.3 -0.394 0.189
0.294 0.394 0.173
0.272 -0.394 0.111
0.352 -0.479 0.332
0.309 -0.412 0.188
0.319 -0.391 0.218
0.369 -0.479 0.335
0.3 -0.394 0.187

TPSA LogP2 QOmin QCmax

 6.668 -0.338 0.183
6.668 -0.388 0.183
10.337 -0.394 0.184
10.337 -0.394 0.184
10.367 -0.391 0.218
29.13 -0.394 0.187
29.112 -0.394 0.218
29.13 -0.394 0.187
29.13 -0.394 0.189
10.595 0.394 0.173
12.855 -0.394 0.111
6.657 -0.479 0.332
7.497 -0.412 0.188
10.367 -0.391 0.218
9.791 -0.479 0.335
29.13 -0.394 0.187

TPSA LDI Hy QOmin

0.312
-1.661 -0.338
0.312 -1.661 -0.388
0.302 -1.792 -0.394
0.302 -1.792 -0.394
0.319 -1.792 -0.391
0.3 -2.36 -0.394
0.308 -2.36 -0.394
0.3 -2.36 -0.394
0.3 -2.36 -0.394
0.294 -1.792 0.394
0.272 -1.792 -0.394
0.352 -2.377 -0.479
0.309 -1.661 -0.412
0.319 -1.792 -0.391
0.369 -1.708 -0.479
0.3 -2.36 -0.394

TPSA LDI LogP2 QOmin

0.312
6.668 -0.338
0.312 6.668 -0.388
0.302 10.337 -0.394
0.302 10.337 -0.394
0.319 10.367 -0.391
0.3 29.13 -0.394
0.308 29.112 -0.394
0.3 29.13 -0.394
0.3 29.13 -0.394
 0.294 10.595 0.394
0.272 12.855 -0.394
0.352 6.657 -0.479
0.309 7.497 -0.412
0.319 10.367 -0.391
0.369 9.791 -0.479
0.3 29.13 -0.394

TPSA LDI Hy QCmax

0.312
-1.661 0.183
0.312 -1.661 0.183
0.302 -1.792 0.184
0.302 -1.792 0.184
0.319 -1.792 0.218
0.3 -2.36 0.187
0.308 -2.36 0.218
0.3 -2.36 0.187
0.3 -2.36 0.189
0.294 -1.792 0.173
0.272 -1.792 0.111
0.352 -2.377 0.332
0.309 -1.661 0.188
0.319 -1.792 0.218
0.369 -1.708 0.335
0.3 -2.36 0.187
 TPSA QHmax -0.005757 TPSA QCmax 0.064514 TPSA QOmin
90.15 0.213 90.15 0.183 90.15 -0.338
90.15 0.213 90.15 0.183 90.15 -0.388
110.38 0.213 110.38 0.184 110.38 -0.394
110.38 0.213 110.38 0.184 110.38 -0.394
110.38 0.214 110.38 0.218 110.38 -0.391
189.53 0.213 189.53 0.187 189.53 -0.394
189.53 0.211 189.53 0.218 189.53 -0.394
189.53 0.213 189.53 0.187 189.53 -0.394
189.53 0.211 189.53 0.189 189.53 -0.394
116.17 0.213 116.17 0.173 116.17 0.394
121.38 0.211 121.38 0.111 121.38 -0.394
145.55 0.296 145.55 0.332 145.55 -0.479
97.99 0.211 97.99 0.188 97.99 -0.412
110.38 0.214 110.38 0.218 110.38 -0.391
127.45 0.296 127.45 0.335 127.45 -0.479
189.53 0.213 189.53 0.187 189.53 -0.394

76.548- 54.491Hy+ 2.571LogP2+ 209.826+ C

50.061+ 3.017LogP2- 40.269Hy+ 267.6256QHmax+ C

20.121+ 2.700LogP2- 47.602Hy+ 99.406ACmax+ C

76.548+ 2.571LogP2- 54.491Hy+ 209.826LDI+ C
-0.151519 TPSA LDI -0.125456 MODELS:
90.15 0.312
90.15 0.312
110.38 0.302
110.38 0.302
110.38 0.319
189.53 0.3
189.53 0.308
189.53 0.3
189.53 0.3
116.17 0.294
121.38 0.272
145.55 0.352
97.99 0.309
110.38 0.319
127.45 0.369
189.53 0.3
Hy, LogP2, LDI
4.745
activity= -76.548- 54.491Hy+ 2.571LogP2+ 209.826+ C
LogP2,Hy, Qhmax
2.246
activity= -50.061+ 3.017LogP2- 40.269Hy+ 267.6256QHmax+ C
logp2, hy, Qcmax
4.334
activity= -20.121+ 2.700LogP2- 47.602Hy+ 99.406ACmax+ C
Logp2, Hy, LDI
4.745
activity= -76.548+ 2.571LogP2- 54.491Hy+ 209.826LDI+ C
logP2, Qcmax, LDI
4.716
Activity= 377.550+ 3.540LogP2+ 729.158QCmax- 1434.490LDI+ C

R Square 0.985725
Fvalue 2.47E-11
Intercept 0.000176
LogP2 1.872E-10
QCmax 3.392E-05
LDI 0.000384
TPSA Hy LogP2 LDI
90.15 -1.661 6.668 0.312
90.15 -1.661 6.668 0.312
110.38 -1.792 10.337 0.302
110.38 -1.792 10.337 0.302
110.38 -1.792 10.367 0.319
189.53 -2.36 29.13 0.3
189.53 -2.36 29.112 0.308
189.53 -2.36 29.13 0.3
189.53 -2.36 29.13 0.3
116.17 -1.792 10.595 0.294
121.38 -1.792 12.855 0.272
145.55 -2.377 6.657 0.352
97.99 -1.661 7.497 0.309
110.38 -1.792 10.367 0.319
127.45 -1.708 9.791 0.369
189.53

TPSA LogP2 Hy QHmax

90.15 6.668 -1.661 0.213
90.15 6.668 -1.661 0.213
110.38 10.337 -1.792 0.213
110.38 10.337 -1.792 0.213
110.38 10.367 -1.792 0.214
189.53 29.13 -2.36 0.213
189.53 29.112 -2.36 0.211
189.53 29.13 -2.36 0.213
189.53 29.13 -2.36 0.211
116.17 10.595 -1.792 0.213
121.38 12.855 -1.792 0.211
145.55 6.657 -2.377 0.296
97.99 7.497 -1.661 0.211
110.38 10.367 -1.792 0.214
127.45 9.791 -1.708 0.296

TPSA LogP2 Hy QCmax

90.15 6.668 -1.661 0.183
90.15 6.668 -1.661 0.183
110.38 10.337 -1.792 0.184
110.38 10.337 -1.792 0.184
110.38 10.367 -1.792 0.218
189.53 29.13 -2.36 0.187
189.53 29.112 -2.36 231
189.53 29.13 -2.36 0.187
189.53 29.13 -2.36 0.189
116.17 10.595 -1.792 0.173
 121.38 12.855 -1.792 0.111
145.55 6.657 -2.377 0.332
97.99 7.497 -1.661 0.188
110.38 10.367 -1.792 0.218
127.45 9.791 -1.708 0.335

TPSA LogP2 Hy QOmin

90.15 6.668 -1.661 -0.338
90.15 6.668 -1.661 -0.388
110.38 10.337 -1.792 -0.394
110.38 10.337 -1.792 -0.394
110.38 10.367 -1.792 -0.391
189.53 29.13 -2.36 -0.394
189.53 29.112 -2.36 -0.394
189.53 29.13 -2.36 -0.394
189.53 29.13 -2.36 -0.394
116.17 10.595 -1.792 0.394
121.38 12.855 -1.792 -0.394
145.55 6.657 -2.377 -0.479
97.99 7.497 -1.661 -0.412
110.38 10.367 -1.792 -0.391
127.45 9.791 -1.708 -0.479

TPSA LogP2 Hy LDI

90.15 6.668 -1.661 0.312
90.15 6.668 -1.661 0.312
110.38 10.337 -1.792 0.302
110.38 10.337 -1.792 0.302
110.38 10.367 -1.792 0.319
189.53 29.13 -2.36 0.3
189.53 29.112 -2.36 0.308
189.53 29.13 -2.36 0.3
189.53 29.13 -2.36 0.3
116.17 10.595 -1.792 0.294
121.38 12.855 -1.792 0.272
145.55 6.657 -2.377 0.352
97.99 7.497 -1.661 0.309
110.38 10.367 -1.792 0.319
127.45 9.791 -1.708 0.369

TPSA LogP2 QHmax QCmax

90.15 6.668 0.213 0.183
90.15 6.668 0.213 0.183
110.38 10.337 0.213 0.184
110.38 10.337 0.213 0.184
 110.38 10.367 0.214 0.218
189.53 29.13 0.213 0.187
189.53 29.112 0.211 231
189.53 29.13 0.213 0.187
189.53 29.13 0.211 0.189
116.17 10.595 0.213 0.173
121.38 12.855 0.211 0.111
145.55 6.657 0.296 0.332
97.99 7.497 0.211 0.188
110.38 10.367 0.214 0.218
127.45 9.791 0.296 0.335

TPSA LogP2 QHmax QOmin

-0.338
90.15 6.668 0.213
90.15 6.668 0.213 -0.388
110.38 10.337 0.213 -0.394
110.38 10.337 0.213 -0.394
110.38 10.367 0.214 -0.391
189.53 29.13 0.213 -0.394
189.53 29.112 0.211 -0.394
189.53 29.13 0.213 -0.394
189.53 29.13 0.211 -0.394
116.17 10.595 0.213 0.394
121.38 12.855 0.211 -0.394
145.55 6.657 0.296 -0.479
97.99 7.497 0.211 -0.412
110.38 10.367 0.214 -0.391
127.45 9.791 0.296 -0.479

TPSA LogP2 QHmax LDI

0.312
90.15 6.668 0.213
90.15 6.668 0.213 0.312
110.38 10.337 0.213 0.302
110.38 10.337 0.213 0.302
110.38 10.367 0.214 0.319
189.53 29.13 0.213 0.3
189.53 29.112 0.211 0.308
189.53 29.13 0.213 0.3
189.53 29.13 0.211 0.3
116.17 10.595 0.213 0.294
121.38 12.855 0.211 0.272
145.55 6.657 0.296 0.352
97.99 7.497 0.211 0.309
110.38 10.367 0.214 0.319
127.45 9.791 0.296 0.369
TPSA LogP2 QCmax QOmin
-0.338
90.15 6.668 0.183
90.15 6.668 0.183 -0.388
110.38 10.337 0.184 -0.394
110.38 10.337 0.184 -0.394
110.38 10.367 0.218 -0.391
189.53 29.13 0.187 -0.394
189.53 29.112 231 -0.394
189.53 29.13 0.187 -0.394
189.53 29.13 0.189 -0.394
116.17 10.595 0.173 0.394
121.38 12.855 0.111 -0.394
145.55 6.657 0.332 -0.479
97.99 7.497 0.188 -0.412
110.38 10.367 0.218 -0.391
127.45 9.791 0.335 -0.479

TPSA LogP2 QCmax LDI

0.312
90.15 6.668 0.183
90.15 6.668 0.183 0.312
110.38 10.337 0.184 0.302
110.38 10.337 0.184 0.302
110.38 10.367 0.218 0.319
189.53 29.13 0.187 0.3
189.53 29.112 231 0.308
189.53 29.13 0.187 0.3
189.53 29.13 0.189 0.3
116.17 10.595 0.173 0.294
121.38 12.855 0.111 0.272
145.55 6.657 0.332 0.352
97.99 7.497 0.188 0.309
110.38 10.367 0.218 0.319
127.45 9.791 0.335 0.369

TPSA QCmax QHmax Hy

90.15 0.183 0.213 -1.661
90.15 0.183 0.213 -1.661
110.38 0.184 0.213 -1.792
110.38 0.184 0.213 -1.792
110.38 0.218 0.214 -1.792
189.53 0.187 0.213 -2.36
 189.53 231 0.211 -2.36
189.53 0.187 0.213 -2.36
189.53 0.189 0.211 -2.36
116.17 0.173 0.213 -1.792
121.38 0.111 0.211 -1.792
145.55 0.332 0.296 -2.377
97.99 0.188 0.211 -1.661
110.38 0.218 0.214 -1.792
127.45 0.335 0.296 -1.708

TPSA QOmin QHmax Hy

90.15 -0.338 0.213 -1.661
-0.388
90.15 0.213 -1.661
110.38 -0.394 0.213 -1.792
110.38 -0.394 0.213 -1.792
110.38 -0.391 0.214 -1.792
189.53 -0.394 0.213 -2.36
189.53 -0.394 0.211 -2.36
189.53 -0.394 0.213 -2.36
189.53 -0.394 0.211 -2.36
116.17 0.394 0.213 -1.792
121.38 -0.394 0.211 -1.792
145.55 -0.479 0.296 -2.377
97.99 -0.412 0.211 -1.661
110.38 -0.391 0.214 -1.792
127.45 -0.479 0.296 -1.708

TPSA LDI QHmax Hy

90.15 0.312 0.213 -1.661
90.15 0.312 0.213 -1.661
110.38 0.302 0.213 -1.792
110.38 0.302 0.213 -1.792
110.38 0.319 0.214 -1.792
189.53 0.3 0.213 -2.36
189.53 0.308 0.211 -2.36
189.53 0.3 0.213 -2.36
189.53 0.3 0.211 -2.36
116.17 0.294 0.213 -1.792
121.38 0.272 0.211 -1.792
145.55 0.352 0.296 -2.377
97.99 0.309 0.211 -1.661
110.38 0.319 0.214 -1.792
127.45 0.369 0.296 -1.708
TPSA QOmin QHmax QCmax
90.15 -0.338 0.213 0.183
-0.388
90.15 0.213 0.183
110.38 -0.394 0.213 0.184
110.38 -0.394 0.213 0.184
110.38 -0.391 0.214 0.218
189.53 -0.394 0.213 0.187
189.53 -0.394 0.211 231
189.53 -0.394 0.213 0.187
189.53 -0.394 0.211 0.189
116.17 0.394 0.213 0.173
121.38 -0.394 0.211 0.111
145.55 -0.479 0.296 0.332
97.99 -0.412 0.211 0.188
110.38 -0.391 0.214 0.218
127.45 -0.479 0.296 0.335

TPSA LDI QHmax QCmax

90.15 0.312 0.213 0.183
90.15 0.312 0.213 0.183
110.38 0.302 0.213 0.184
110.38 0.302 0.213 0.184
110.38 0.319 0.214 0.218
189.53 0.3 0.213 0.187
189.53 0.308 0.211 231
189.53 0.3 0.213 0.187
189.53 0.3 0.211 0.189
116.17 0.294 0.213 0.173
121.38 0.272 0.211 0.111
145.55 0.352 0.296 0.332
97.99 0.309 0.211 0.188
110.38 0.319 0.214 0.218
127.45 0.369 0.296 0.335

TPSA LDI QOmin QCmax

90.15 0.312 -0.338
0.183
-0.388
90.15 0.312 0.183
110.38 0.302 -0.394 0.184
110.38 0.302 -0.394 0.184
110.38 0.319 -0.391 0.218
189.53 0.3 -0.394 0.187
189.53 0.308 -0.394 231
189.53 0.3 -0.394 0.187
 189.53 0.3 -0.394 0.189
116.17 0.294 0.394 0.173
121.38 0.272 -0.394 0.111
145.55 0.352 -0.479 0.332
97.99 0.309 -0.412 0.188
110.38 0.319 -0.391 0.218
127.45 0.369 -0.479 0.335

TPSA LogP2 QOmin QCmax

90.15 6.668 -0.338 0.183
90.15 6.668 -0.388 0.183
110.38 10.337 -0.394 0.184
110.38 10.337 -0.394 0.184
110.38 10.367 -0.391 0.218
189.53 29.13 -0.394 0.187
189.53 29.112 -0.394 231
189.53 29.13 -0.394 0.187
189.53 29.13 -0.394 0.189
116.17 10.595 0.394 0.173
121.38 12.855 -0.394 0.111
145.55 6.657 -0.479 0.332
97.99 7.497 -0.412 0.188
110.38 10.367 -0.391 0.218
127.45 9.791 -0.479 0.335

TPSA LDI Hy QOmin

90.15 0.312 -1.661 -0.338
90.15 0.312 -1.661 -0.388
110.38 0.302 -1.792 -0.394
110.38 0.302 -1.792 -0.394
110.38 0.319 -1.792 -0.391
189.53 0.3 -2.36 -0.394
189.53 0.308 -2.36 -0.394
189.53 0.3 -2.36 -0.394
189.53 0.3 -2.36 -0.394
116.17 0.294 -1.792 0.394
121.38 0.272 -1.792 -0.394
145.55 0.352 -2.377 -0.479
97.99 0.309 -1.661 -0.412
110.38 0.319 -1.792 -0.391
127.45 0.369 -1.708 -0.479

TPSA LDI LogP2 QOmin

0.312
90.15 6.668 -0.338
90.15 0.312 6.668 -0.388
 110.38 0.302 10.337 -0.394
110.38 0.302 10.337 -0.394
110.38 0.319 10.367 -0.391
189.53 0.3 29.13 -0.394
189.53 0.308 29.112 -0.394
189.53 0.3 29.13 -0.394
189.53 0.3 29.13 -0.394
116.17 0.294 10.595 0.394
121.38 0.272 12.855 -0.394
145.55 0.352 6.657 -0.479
97.99 0.309 7.497 -0.412
110.38 0.319 10.367 -0.391
127.45 0.369 9.791 -0.479

TPSA LDI Hy QCmax

90.15 0.312 -1.661 0.183
90.15 0.312 -1.661 0.183
110.38 0.302 -1.792 0.184
110.38 0.302 -1.792 0.184
110.38 0.319 -1.792 0.218
189.53 0.3 -2.36 0.187
189.53 0.308 -2.36 231
189.53 0.3 -2.36 0.187
189.53 0.3 -2.36 0.189
116.17 0.294 -1.792 0.173
121.38 0.272 -1.792 0.111
145.55 0.352 -2.377 0.332
97.99 0.309 -1.661 0.188
110.38 0.319 -1.792 0.218
127.45 0.369 -1.708 0.335