 | #77 pK: 7.824 name: M77 |
| #77 pK: 7.824 name: M77 |
| Loading Structure Activity Report... |
| Structure-Activity Report |  |
| Summary | Scaffolds | Activity | Suggestions | Explore | Graph | Fragments | Data | Methods |
 | Scaffold 1 |
 (39)
|
|   | ||
|                                    | |||
|  |
| Scaffold 2 |
 (21)
|
| | ||
| |
| Scaffold 3 |
 (15)
|
|           | ||
|   | |||
| |
| Scaffold 4 |
 (10)
|
|   | ||
|  |
| Scaffold 5 |
 (3)
|
|    | ||
| |
205,132,113,75
205,132,113,75
205,133,113,75
204,133,113,76
204,133,113,76
205,133,113,76
5
28,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,75,76,77,78,79,80,81,82,83,84,85,86,87,88,90,93
1,2,3
19,13;15,14,17,18,38,49,47,46,42,41,45,44,50,40,39,48,43,37,34,33,36,35,32,31,30,29,26,21,28,27,25,20,24,23,22;3
161.167997717857,0,3,2,90.71,0.1892
33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69,71,73
2,3
;15,14,17,18,38,49,47,46,42,41,45,44,40,39,48,43,37,34,33,36,35;3
162.155997991562,0,4,2,103.6,-0.4158
31,89,91,92,94,95,96,97,98,99,100,101,102,103,104
1,2,3
19,13,12,11,10,9,7,6,8,5,1,4;2,15,14,17,18,16;3
160.179997444153,0,2,2,77.82,0.7942
5,6,7,8,9,10,11,12,13,14
2,3
;15,14,38,52,51;3,53
166.207999944687,0,2,2,77.82,0.8557
1,2,3
2,3
;56,55,54;3
150.184997797012,0,2,2,77.82,0.12964
216,166,114,86
58,14,35,10
58,14,35,10
216,165,114,86
216,166,114,86
207,146,110,76
181,159,97,83
179,161,96,84
181,159,97,83
166,72,89,39
137,85,75,46
179,66,96,36
58,14,35,10
181,159,97,83
216,166,114,86
194,102,103,54
195,72,104,42
184,121,98,64
58,15,35,11
184,121,98,64
184,121,98,64
184,179,98,93
194,214,103,110
188,218,100,112
204,129,108,68
201,131,107,69
208,123,110,65
203,138,108,72
200,141,106,74
166,151,89,79
203,116,108,61
166,130,89,68
181,159,97,83
184,121,98,64
202,157,107,82
182,180,97,93
182,151,97,79
179,161,96,84
166,136,89,71
186,134,99,70
195,72,104,39
181,85,97,46
201,131,107,69
216,72,114,39
207,87,110,47
195,72,104,39
181,85,97,46
184,121,98,64
166,72,89,39
151,160,82,83
244,117,128,62
216,165,114,86
58,15,35,11
238,158,125,82
216,166,114,86
187,163,100,85
56,3
104
195.237995505333,0,3,0,27.69,2.15177
95,96,97,98,99,100,101,102,103,104
1.00800001621246,0,0,0,0,0.123
1,2,3,10,11,12,13,14,28,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63,64,65,66,67,68,69,70,71,72,73,74,75,76,77,78,79,80,81,82,83,84,85,86,87,88,89,90,91,92,93,94,95,96,97,98,99,100,101,102,103,104
1.00800001621246,0,0,0,0,0.123
103
210.252995491028,0,3,0,30.93,1.6554
102
196.225995779037,0,3,1,39.72,1.6311
101
161.179996132851,0,2,0,18.46,1.562108
100
165.211996197701,0,2,0,18.46,2.14317
99
180.226996183395,0,2,0,21.7,1.6468
98
166.199996471405,0,2,1,30.49,1.6225
97
105.159997582436,0,0,0,0,2.12597
96
103.143997550011,0,0,0,0,2.2066
95
101.127997517586,0,0,0,0,1.544908
88,89,90,91,92,93,94
1.00800001621246,0,0,0,0,0.123
6,11,59,60,94
166.199996471405,0,2,1,30.49,1.6225
5,10,31,65,66,93
196.225995779037,0,3,1,39.72,1.6311
92
154.619996666908,0,0,1,12.03,2.56712
53,54,90,91
140.592996954918,0,0,1,12.03,2.2587
33,34,88,89
156.207996606827,0,0,1,12.03,2.7585
28,31,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,75,76,77,78,79,80,81,82,83,84,85,86,87
15.0349997282028,0,0,0,0,0.5131
87
174.266996383667,0,0,0,3.24,2.50834
86
160.239996671677,0,0,1,12.03,2.48404
85
218.197994112968,0,1,0,12.47,2.9685
84
208.280995607376,0,2,0,21.7,2.427
83
194.253995895386,0,2,1,30.49,2.4027
82
180.226996183395,0,2,0,21.7,1.6468
81
166.199996471405,0,2,1,30.49,1.6225
80
180.226996183395,0,2,0,21.7,1.6468
79
180.226996183395,0,2,0,21.7,1.6468
78
166.199996471405,0,2,1,30.49,1.6225
77
150.200996875763,0,1,1,21.26,1.92232
76
150.200996875763,0,1,1,21.26,1.92232
75
134.201997280121,0,0,1,12.03,2.22214
73,74
165.211996197701,0,2,0,18.46,2.14317
71,72
155.219996333122,0,0,0,0,3.27917
69,70
204.170994400978,0,1,1,21.26,2.9442
67,68
204.170994400978,0,1,1,21.26,2.9442
63,64
166.199996471405,0,2,1,30.49,1.6225
8,13,61,62
180.226996183395,0,2,0,21.7,1.6468
57,58
150.200996875763,0,1,1,21.26,1.92232
55,56
150.200996875763,0,1,1,21.26,1.92232
51,52
157.643998861313,0,0,0,0,2.9389
49,50
157.643998861313,0,0,0,0,2.9389
47,48
183.2509983778,0,2,0,18.46,2.3027
45,46
153.224999070168,0,1,0,9.23,2.2941
43,44
153.224999070168,0,1,0,9.23,2.2941
41,42
137.225999474525,0,0,0,0,2.59392
39,40
137.225999474525,0,0,0,0,2.59392
37,38
173.258998513222,0,0,0,0,3.4387
35,36
123.198999762535,0,0,0,0,2.2855
28,32
151.18499648571,0,2,0,18.46,1.75307
9,14
240.112994790077,0,0,1,16.96,3.7028
7,12
210.252995491028,0,3,0,30.93,1.6554
5,6,7,8,9
79.9039993286133,0,0,0,0,0.8456
3
209.264995217323,0,3,0,27.69,2.54187
2
195.237995505333,0,3,0,27.69,2.15177
1
181.210995793343,0,3,0,27.69,1.76167
116,32,17,19,10,20
summary,scaffolds,activity,suggest,explore,graph,frags,data,methods
Tue Nov 08 13:38:31 2011
104
5
0,56,3
330.387993574142,0,5,2,105.51,1.93924
146,102
5
0,55,3
344.414993286133,0,5,2,105.51,2.32934
146,119
5
0,54,3
358.441992998123,0,5,2,105.51,2.71944
165,119
0
0,0,0
248.716995358467,0,2,2,77.82,2.52377
116,75
4
0,15,53
440.321995019913,0,5,3,117.54,3.5225
146,119
4
0,14,53
410.29599571228,0,4,3,108.31,3.5139
141,124
4
0,52,53
454.348994731903,0,5,2,108.75,3.5468
146,119
4
0,38,53
424.322995424271,0,4,2,99.52,3.5382
141,124
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0,51,53
484.208994030952,0,2,3,94.78,5.5942
136,141
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0,15,3
361.425995707512,0,5,3,117.54,2.76
146,119
4
0,14,3
331.399996399879,0,4,3,108.31,2.7514
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375.452995419502,0,5,2,108.75,2.7843
146,119
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0,38,3
345.42699611187,0,4,2,99.52,2.7757
141,124
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0,51,3
405.312994718552,0,2,3,94.78,4.8317
136,141
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0,0,0
332.359993457794,0,6,4,133.58,1.48397
116,135
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113,120
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380.403992176056,0,6,4,133.58,2.78397
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168,67
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168,67
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168,67
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168,67
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168,67
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129,134
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1
pK
pKi/pIC50
1,0,x,0.142857,-0.428571,0.5
4.678
0.239683
3
6.854
0.550553
6
6.854
0.550553
6
6.409
0.486991
5
4.469
0.209789
3
4
0.142857
2
3.896
0.128028
2
5
0.285714
4
4.585
0.226432
3
5
0.285714
4
5
0.285714
4
5
0.285714
4
5
0.285714
4
5
0.285714
4
6.745
0.534961
6
6.959
0.565515
6
7.013
0.573318
6
7.495
0.642121
7
7.143
0.59181
6
7.237
0.605225
6
8.076
0.725103
8
7.523
0.646126
7
6.222
0.460264
5
5.699
0.385567
4
6.301
0.471576
5
5.796
0.399411
5
5.553
0.364692
4
8.367
0.766647
8
5.564
0.366262
4
6.409
0.486991
5
8
0.714286
7
7.77
0.681364
7
7.119
0.588455
6
6.62
0.517113
6
6.114
0.444787
5
7.469
0.63836
7
5.155
0.307843
4
7.523
0.646126
7
5.745
0.392104
5
7.187
0.598155
6
4.824
0.260558
3
7.244
0.606304
6
5.796
0.399411
5
6.959
0.565515
6
4.854
0.264839
3
7.201
0.600094
6
4.635
0.233502
3
7.523
0.646126
7
5.244
0.320589
4
7.046
0.577965
6
4.775
0.253527
3
7.046
0.577965
6
6.229
0.461307
5
7.495
0.642121
7
6.357
0.479507
5
7.638
0.66261
7
5.733
0.390404
5
7
0.571429
6
5.161
0.308736
4
7.854
0.69341
7
6.678
0.525397
6
7.553
0.650406
7
6.959
0.565515
6
8.456
0.779419
8
6
0.428571
5
8.569
0.795519
8
4.975
0.282099
4
7.658
0.665368
7
6.051
0.435801
5
7.745
0.677818
7
6.086
0.440884
5
7.585
0.655004
7
5.268
0.323944
4
8.102
0.72891
8
7.796
0.685126
7
8.143
0.734667
8
7.824
0.68913
7
8
0.714286
7
7.276
0.610818
6
8.398
0.771134
8
8.569
0.795519
8
8.538
0.791086
8
7.658
0.665368
7
7.538
0.648229
7
7.42
0.631459
7
7.585
0.655004
7
7.796
0.685126
7
6.824
0.546273
6
7.569
0.652662
7
6.523
0.503268
6
7.125
0.589277
6
7.481
0.640212
7
6.886
0.555151
6
6.854
0.550553
6
4.523
0.217554
3
5.921
0.41726
5
6.432
0.490257
5
5.301
0.328719
4
4.398
0.199706
3
5.229
0.31845
4
4.745
0.249247
3
4.699
0.24271
3
4.699
0.24271
3
6.032
0.433074
5
0
1
name
M1
M2
M3
M4
M5
M6
M7
M8
M9
M10
M11
M12
M13
M14
M15
M16
M17
M18
M19
M20
M21
M22
M23
M24
M25
M26
M27
M28
M29
M30
M31
M32
M33
M34
M35
M36
M37
M38
M39
M40
M41
M42
M43
M44
M45
M46
M47
M48
M49
M50
M51
M52
M53
M54
M55
M56
M57
M58
M59
M60
M61
M62
M63
M64
M65
M66
M67
M68
M69
M70
M71
M72
M73
M74
M75
M76
M77
M78
M79
M80
M81
M82
M83
M84
M85
M86
M87
M88
M89
M90
M91
M92
M93
M94
M95
M96
M97
M98
M99
M100
M101
M102
M103
M104
Scaffold,R1,R2,R3
722,1184,5,12
120,80,5,1,118,30,2,239,30,3,360,30,4,481,30,5,602,30
112,88,5,19,0,116,13,0,205,10,0,294,11,0,383,12,0,472,6,0,561,7,0,650,9,0,739,8,0,828,1,0,917,5,0,1006,4,0,1095
119,117,120,88,121,89
118,0,604,30,0,0,118,116
738,5030,5,42
120,80,5,1,134,30,2,255,30,3,376,30,4,497,30,5,618,30
128,116,5,2,0,116,15,0,233,14,0,350,17,0,467,18,0,584,38,0,701,49,0,818,41,0,935,42,0,1052,46,0,1169,47,0,1286,44,0,1403,45,0,1520,39,0,1637,40,0,1754,50,0,1871,33,0,1988,34,0,2105,37,0,2222,43,0,2339,48,0,2456,35,0,2573,36,0,2690,51,0,2807,52,0,2924,16,0,3041,32,0,3158,30,0,3275,31,0,3392,21,0,3509,26,0,3626,29,0,3743,20,0,3860,25,0,3977,27,0,4094,28,0,4211,56,0,4328,24,0,4445,55,0,4562,22,0,4679,23,0,4796,54,0,4913
135,117,120,116,121,117
134,0,604,30,0,0,134,116
650,238,5,2
120,80,5,1,46,30,2,167,30,3,288,30,4,409,30,5,530,30
40,60,5,3,0,116,53,0,177
47,117,120,60,121,61
46,0,604,30,0,0,46,116
917,623,12,5
120,88,5,19,126,124,13,187,30,10,248,124,11,309,30,12,370,124,6,431,30,7,492,124,9,553,30,8,614,124,1,675,30,5,736,124,4,797,30,0,126,30,0,858,124
120,80,5,1,0,218,2,0,299,3,0,380,4,0,461,5,0,542
158,219,60,80,61,81
126,0,791,30,0,0,126,218
925,5132,12,42
120,88,5,19,134,124,13,195,30,10,256,124,11,317,30,12,378,124,6,439,30,7,500,124,9,561,30,8,622,124,1,683,30,5,744,124,4,805,30,0,134,30,0,866,124
128,116,5,2,0,218,15,0,335,14,0,452,17,0,569,18,0,686,38,0,803,49,0,920,41,0,1037,42,0,1154,46,0,1271,47,0,1388,44,0,1505,45,0,1622,39,0,1739,40,0,1856,50,0,1973,33,0,2090,34,0,2207,37,0,2324,43,0,2441,48,0,2558,35,0,2675,36,0,2792,51,0,2909,52,0,3026,16,0,3143,32,0,3260,30,0,3377,31,0,3494,21,0,3611,26,0,3728,29,0,3845,20,0,3962,25,0,4079,27,0,4196,28,0,4313,56,0,4430,24,0,4547,55,0,4664,22,0,4781,23,0,4898,54,0,5015
166,219,60,116,61,117
134,0,791,30,0,0,134,218
837,340,12,2
120,88,5,19,46,124,13,107,30,10,168,124,11,229,30,12,290,124,6,351,30,7,412,124,9,473,30,8,534,124,1,595,30,5,656,124,4,717,30,0,46,30,0,778,124
40,60,5,3,0,218,53,0,279
78,219,60,60,61,61
46,0,791,30,0,0,46,218
2919,679,42,5
128,116,5,2,126,152,15,191,30,14,256,152,17,321,30,18,386,152,38,451,30,49,516,152,41,581,30,42,646,152,46,711,30,47,776,152,44,841,30,45,906,152,39,971,30,40,1036,152,50,1101,30,33,1166,152,34,1231,30,37,1296,152,43,1361,30,48,1426,152,35,1491,30,36,1556,152,51,1621,30,52,1686,152,16,1751,30,32,1816,152,30,1881,30,31,1946,152,21,2011,30,26,2076,152,29,2141,30,20,2206,152,25,2271,30,27,2336,152,28,2401,30,56,2466,152,24,2531,30,55,2596,152,22,2661,30,23,2726,152,54,2791,30,0,126,30,0,2856,152
120,80,5,1,0,274,2,0,355,3,0,436,4,0,517,5,0,598
160,275,64,80,65,81
126,0,2793,30,0,0,126,274
2911,1342,42,12
128,116,5,2,118,152,15,183,30,14,248,152,17,313,30,18,378,152,38,443,30,49,508,152,41,573,30,42,638,152,46,703,30,47,768,152,44,833,30,45,898,152,39,963,30,40,1028,152,50,1093,30,33,1158,152,34,1223,30,37,1288,152,43,1353,30,48,1418,152,35,1483,30,36,1548,152,51,1613,30,52,1678,152,16,1743,30,32,1808,152,30,1873,30,31,1938,152,21,2003,30,26,2068,152,29,2133,30,20,2198,152,25,2263,30,27,2328,152,28,2393,30,56,2458,152,24,2523,30,55,2588,152,22,2653,30,23,2718,152,54,2783,30,0,118,30,0,2848,152
112,88,5,19,0,274,13,0,363,10,0,452,11,0,541,12,0,630,6,0,719,7,0,808,9,0,897,8,0,986,1,0,1075,5,0,1164,4,0,1253
152,275,64,88,65,89
118,0,2793,30,0,0,118,274
2839,396,42,2
128,116,5,2,46,152,15,111,30,14,176,152,17,241,30,18,306,152,38,371,30,49,436,152,41,501,30,42,566,152,46,631,30,47,696,152,44,761,30,45,826,152,39,891,30,40,956,152,50,1021,30,33,1086,152,34,1151,30,37,1216,152,43,1281,30,48,1346,152,35,1411,30,36,1476,152,51,1541,30,52,1606,152,16,1671,30,32,1736,152,30,1801,30,31,1866,152,21,1931,30,26,1996,152,29,2061,30,20,2126,152,25,2191,30,27,2256,152,28,2321,30,56,2386,152,24,2451,30,55,2516,152,22,2581,30,23,2646,152,54,2711,30,0,46,30,0,2776,152
40,60,5,3,0,274,53,0,335
80,275,64,60,65,61
46,0,2793,30,0,0,46,274
247,481,2,5
60,40,5,3,126,30,53,187,30
120,80,5,1,0,76,2,0,157,3,0,238,4,0,319,5,0,400
127,77,60,80,61,81
126,0,121,30,0,0,126,76
239,1144,2,12
60,40,5,3,118,30,53,179,30
112,88,5,19,0,76,13,0,165,10,0,254,11,0,343,12,0,432,6,0,521,7,0,610,9,0,699,8,0,788,1,0,877,5,0,966,4,0,1055
119,77,60,88,61,89
118,0,121,30,0,0,118,76
255,4990,2,42
60,40,5,3,134,30,53,195,30
128,116,5,2,0,76,15,0,193,14,0,310,17,0,427,18,0,544,38,0,661,49,0,778,41,0,895,42,0,1012,46,0,1129,47,0,1246,44,0,1363,45,0,1480,39,0,1597,40,0,1714,50,0,1831,33,0,1948,34,0,2065,37,0,2182,43,0,2299,48,0,2416,35,0,2533,36,0,2650,51,0,2767,52,0,2884,16,0,3001,32,0,3118,30,0,3235,31,0,3352,21,0,3469,26,0,3586,29,0,3703,20,0,3820,25,0,3937,27,0,4054,28,0,4171,56,0,4288,24,0,4405,55,0,4522,22,0,4639,23,0,4756,54,0,4873
135,77,60,116,61,117
134,0,121,30,0,0,134,76
1,3,3,1,4,3,1,5,3,1,6,3,1,7,3,1,8,3,1,9,2,1,10,3,1,11,3,1,12,3
1,1,2,1,24,3,1,25,3,1,26,3,1,37,3,1,39,3,1,42,3,3,6,1,3,7,1,3,8,1,3,9,1,3,10,1,3,11,1,3,12,1,3,13,1,3,14,1,3,15,1,3,16,1,3,17,1,3,18,1,3,19,1,3,20,1,3,21,1,3,22,1,3,23,1,3,24,1,3,25,1,3,27,1,3,28,1,3,29,1,3,30,1,3,31,1,3,32,1,3,33,1,3,34,1,3,35,1,3,36,1,3,37,1,3,38,1,3,39,1,3,40,1,3,41,1,3,42,1
1,2,4,3,2,0
1,1,2,1,24,3,1,25,3,1,26,3,1,37,3,1,39,3,1,42,3,2,1,2,2,6,2,2,7,2,2,8,2,2,9,2,2,10,2,2,11,2,2,12,2,2,13,2,2,14,2,2,15,2,2,16,3,2,17,2,2,18,2,2,19,3,2,20,2,2,21,2,2,22,2,2,23,2,2,24,2,2,25,2,2,27,3,2,28,3,2,29,3,2,30,3,2,31,3,2,32,3,2,33,3,2,34,3,2,35,3,2,36,3,2,37,2,2,38,3,2,39,2,2,40,3,2,41,3,2,42,2,3,2,2,3,3,2,3,4,2,3,5,2,3,6,2,3,7,2,3,8,2,3,9,2,3,10,2,3,11,2,3,12,2,3,13,2,3,14,2,3,15,2,3,16,3,3,17,2,3,18,2,3,19,3,3,20,2,3,21,2,3,22,2,3,23,2,3,27,3,3,28,3,3,29,3,3,30,3,3,31,3,3,32,3,3,33,3,3,34,3,3,35,3,3,36,3,3,38,3,3,40,3,3,41,3,4,2,2,4,3,2,4,4,2,4,5,2,4,6,2,4,7,2,4,8,2,4,9,2,4,10,2,4,11,2,4,12,2,4,13,2,4,14,2,4,15,2,4,16,3,4,17,2,4,18,2,4,19,3,4,20,2,4,21,2,4,22,2,4,23,2,4,27,3,4,28,3,4,29,3,4,30,3,4,31,3,4,32,3,4,33,3,4,34,3,4,35,3,4,36,2,4,38,3,4,40,2,4,41,3,5,2,2,5,3,2,5,4,2,5,5,2,5,6,2,5,7,2,5,8,2,5,9,2,5,10,2,5,11,2,5,12,2,5,13,2,5,14,2,5,15,2,5,16,3,5,17,2,5,18,2,5,19,2,5,20,2,5,21,2,5,22,2,5,23,2,5,27,2,5,28,2,5,29,2,5,30,2,5,31,2,5,32,2,5,33,2,5,34,2,5,35,2,5,36,2,5,38,2,5,40,2,5,41,2,6,2,2,6,3,2,6,4,2,6,5,2,6,6,2,6,7,2,6,8,2,6,9,2,6,10,2,6,11,2,6,12,2,6,13,2,6,14,2,6,15,2,6,16,3,6,17,2,6,18,2,6,19,2,6,20,2,6,21,2,6,22,2,6,23,2,6,27,2,6,28,2,6,29,2,6,30,2,6,31,2,6,32,2,6,33,2,6,34,2,6,35,2,6,36,2,6,38,2,6,40,2,6,41,2,7,2,2,7,3,2,7,4,2,7,5,2,7,6,2,7,7,2,7,8,2,7,9,2,7,10,2,7,11,2,7,12,2,7,13,2,7,14,2,7,15,2,7,16,3,7,17,2,7,18,2,7,19,3,7,20,2,7,21,2,7,22,2,7,23,2,7,27,2,7,28,2,7,29,2,7,30,2,7,31,3,7,32,2,7,33,2,7,34,3,7,35,3,7,36,2,7,38,2,7,40,2,7,41,2,8,2,2,8,3,2,8,4,2,8,5,2,8,6,2,8,7,2,8,8,2,8,9,2,8,10,2,8,11,2,8,12,2,8,13,2,8,14,2,8,15,2,8,16,3,8,17,2,8,18,2,8,19,3,8,20,2,8,21,2,8,22,2,8,23,2,8,27,2,8,28,2,8,29,3,8,30,2,8,31,3,8,32,2,8,33,2,8,34,3,8,35,3,8,36,2,8,38,2,8,40,2,8,41,2,9,2,2,9,3,2,9,4,2,9,5,2,9,6,2,9,7,2,9,8,2,9,9,2,9,10,2,9,11,2,9,12,2,9,13,2,9,14,2,9,15,2,9,16,2,9,17,2,9,18,2,9,19,2,9,20,2,9,21,2,9,22,2,9,23,2,9,27,2,9,28,2,9,29,2,9,30,2,9,31,2,9,32,2,9,33,2,9,34,2,9,35,2,9,36,2,9,38,2,9,40,2,9,41,2,10,2,2,10,3,2,10,4,2,10,5,2,10,6,2,10,7,2,10,8,2,10,9,2,10,10,2,10,11,2,10,12,2,10,13,2,10,14,2,10,15,2,10,16,3,10,17,2,10,18,2,10,19,3,10,20,2,10,21,2,10,22,2,10,23,2,10,27,3,10,28,3,10,29,3,10,30,3,10,31,3,10,32,3,10,33,3,10,34,3,10,35,3,10,36,2,10,38,3,10,40,3,10,41,3,11,2,2,11,3,2,11,4,2,11,5,2,11,6,2,11,7,2,11,8,2,11,9,2,11,10,2,11,11,2,11,12,2,11,13,2,11,14,2,11,15,2,11,16,3,11,17,2,11,18,2,11,19,2,11,20,2,11,21,2,11,22,2,11,23,2,11,27,2,11,28,2,11,29,2,11,30,2,11,31,2,11,32,2,11,33,2,11,34,2,11,35,2,11,36,2,11,38,2,11,40,2,11,41,2,12,2,2,12,3,2,12,4,2,12,5,2,12,6,2,12,7,2,12,8,2,12,9,2,12,10,2,12,11,2,12,12,2,12,13,2,12,14,2,12,15,2,12,16,3,12,17,2,12,18,2,12,19,2,12,20,2,12,21,2,12,22,2,12,23,2,12,27,2,12,28,2,12,29,2,12,30,2,12,31,2,12,32,2,12,33,2,12,34,2,12,35,2,12,36,2,12,38,2,12,40,2,12,41,2
1,2,4,2,2,3
4,2,4,5,2,4,7,2,4,8,2,4,9,2,4,10,2,4,11,2,4,12,2,4,13,2,4,14,2,4,15,2,4,16,2,4,17,2,4,18,2,4,19,2,4,20,2,4,21,2,4,22,2,4,23,2,4,27,2,4,28,2,4,29,2,4,30,2,4,31,2,4,32,2,4,33,2,4,34,2,4,35,2,4,36,2,4,38,2,4,40,2,4,41,2,4
137
1,0.601186,1,13,50,3
1,0.601051,1,11,50,3
1,0.60141,1,10,50,3
1,0.600616,1,9,50,3
1,0.600566,1,7,50,3
1,0.600225,1,6,50,3
1,0.600193,1,5,50,3
1,0.600193,1,4,50,3
1,0.601129,1,1,50,3
1,0.610091,1,19,56,3
1,0.611394,1,19,55,3
1,0.611394,1,19,54,3
1,0.60828,1,19,52,3
1,0.608691,1,19,51,3
1,0.61177,1,19,16,3
1,0.648547,1,19,50,53
1,0.524302,3,19,56,3
1,0.526174,3,19,55,3
1,0.526174,3,19,54,3
1,0.522221,3,19,52,3
1,0.52396,3,19,38,3
1,0.52281,3,19,51,3
1,0.528411,3,19,50,3
1,0.526227,3,19,49,3
1,0.525454,3,19,48,3
1,0.525672,3,19,47,3
1,0.524933,3,19,46,3
1,0.52552,3,19,45,3
1,0.524921,3,19,44,3
1,0.525009,3,19,43,3
1,0.525123,3,19,42,3
1,0.524721,3,19,41,3
1,0.52658,3,19,40,3
1,0.525501,3,19,39,3
1,0.527794,3,19,37,3
1,0.525415,3,19,36,3
1,0.52641,3,19,35,3
1,0.526304,3,19,34,3
1,0.526046,3,19,33,3
1,0.526985,3,19,32,3
1,0.527283,3,19,31,3
1,0.527009,3,19,30,3
1,0.52716,3,19,29,3
1,0.526537,3,19,28,3
1,0.527502,3,19,27,3
1,0.527649,3,19,26,3
1,0.527623,3,19,25,3
1,0.526866,3,19,24,3
1,0.526762,3,19,23,3
1,0.526661,3,19,22,3
1,0.526803,3,19,21,3
1,0.526985,3,19,20,3
1,0.514054,3,19,15,53
1,0.64588,1,19,18,53
1,0.646288,1,19,49,53
1,0.645488,1,19,48,53
1,0.645712,1,19,47,53
1,0.644948,1,19,46,53
1,0.645555,1,19,45,53
1,0.644936,1,19,44,53
1,0.645027,1,19,43,53
1,0.645144,1,19,42,53
1,0.644729,1,19,41,53
1,0.645216,1,19,17,53
1,0.646653,1,19,40,53
1,0.645536,1,19,39,53
1,0.600693,1,13,37,3
1,0.600545,1,11,37,3
1,0.600903,1,10,37,3
1,0.600622,1,1,37,3
1,0.647909,1,19,37,53
1,0.645447,1,19,36,53
1,0.646476,1,19,35,53
1,0.646367,1,19,34,53
1,0.6461,1,19,33,53
1,0.600398,1,13,32,3
1,0.60024,1,11,32,3
1,0.600601,1,10,32,3
1,0.600318,1,1,32,3
1,0.647821,1,19,32,53
1,0.600636,1,13,31,3
1,0.600485,1,11,31,3
1,0.600845,1,10,31,3
1,0.600563,1,1,31,3
1,0.648129,1,19,31,53
1,0.600417,1,13,30,3
1,0.60026,1,11,30,3
1,0.60062,1,10,30,3
1,0.600338,1,1,30,3
1,0.647846,1,19,30,53
1,0.600538,1,13,29,3
1,0.600384,1,11,29,3
1,0.600745,1,10,29,3
1,0.600462,1,1,29,3
1,0.648002,1,19,29,53
1,0.600234,1,10,28,3
1,0.647358,1,19,28,53
1,0.600811,1,13,27,3
1,0.600665,1,11,27,3
1,0.601026,1,10,27,3
1,0.600227,1,9,27,3
1,0.600177,1,7,27,3
1,0.600743,1,1,27,3
1,0.648357,1,19,27,53
1,0.600928,1,13,26,3
1,0.600785,1,11,26,3
1,0.601146,1,10,26,3
1,0.600348,1,9,26,3
1,0.600297,1,7,26,3
1,0.600864,1,1,26,3
1,0.648509,1,19,26,53
1,0.600907,1,13,25,3
1,0.600764,1,11,25,3
1,0.601124,1,10,25,3
1,0.600326,1,9,25,3
1,0.600275,1,7,25,3
1,0.600842,1,1,25,3
1,0.648481,1,19,25,53
1,0.600303,1,13,24,3
1,0.600503,1,10,24,3
1,0.600221,1,1,24,3
1,0.647698,1,19,24,53
1,0.600221,1,13,23,3
1,0.600418,1,10,23,3
1,0.647591,1,19,23,53
1,0.600336,1,10,22,3
1,0.647486,1,19,22,53
1,0.600254,1,13,21,3
1,0.600452,1,10,21,3
1,0.600169,1,1,21,3
1,0.647633,1,19,21,53
1,0.600398,1,13,20,3
1,0.60024,1,11,20,3
1,0.600601,1,10,20,3
1,0.600318,1,1,20,3
1,0.647821,1,19,20,53
1,0.635463,1,13,18,53
0000000120001000019008860243809155A1442817,0000000000000000800000110000036000D0B2D41E
0000000120001000019008860243809155A1442817,0000000000000000800000110000076000D0B6D41E
0000000120001000019008860243809155A1442817,00000000000000008000001100000F6000D0B6D41E
0000000120001020019048044246821174A161AC17,000000000000000000000000000000000000000000
000000012840100001908D80020380115421402817,0000000000200000800002110900036070D0F2FD1F
000000012840100001908D80020380115421402817,0000000000200000000002500900036070D0F0FD1F
000000012840100001908D80020380115421402817,0000000000200000800030110900076270D0BAFD1F
000000012840100001908D80020380115421402817,0000000000200000000030500900076270D0B8FD1F
000000012840100001908D80020380115421402817,0000000000200020010456904804021370A168AD17
000000012840100001908D80020380115421402817,0000000000000000800002110900036050D0F2FD1F
000000012840100001908D80020380115421402817,0000000000000000000002500900036050D0F0FD1F
000000012840100001908D80020380115421402817,0000000000000000800030110900076250D0BAFD1F
000000012840100001908D80020380115421402817,0000000000000000000030500900076250D0B8FD1F
000000012840100001908D80020380115421402817,0000000000000020010456804804021370A168AD17
000000012000100001900816821A81755CEDE7FF1F,000000000000000000000000000000000000000000
000000012000100001900816821AA1755DEDE7FF1F,000000000000000000000000000000000000000000
000001012000100001900812820A81355CE5E7FE1F,000000000000000000000000000000000000000000
000001012000100001900816820A81355CE5E7FE1F,000000000000000000000000000000000000000000
000001012000100001900816820AA1355DE5E7FE1F,000000000000000000000000000000000000000000
000000012000100001900816820AA1B55DE5E7FE1F,000000000000000000000000000000000000000000
000000012000100001900816820AA1B55DE5E7FE1F,000000000000000000000000000000000000000000
000000012000100001900816820AA1B55DE5E7FE1F,000000000000000000000000000000000000000000
000000012000100001900812021A817554EDE3FF1F,000000000000000000000000000000000000000000
000000012000100001900812021A817554EDE3FF1F,000000000000000000000000000000000000000000
000001012000100001900813021A817554EDE3FF1F,000000000000000000000000000000000000000000
000001012000100001900812021A817554EDE3FF1F,000000000000000000000000000000000000000000
0000000120001000819008130202817154F1F3FC1F,000000000000000000000000000000000000000000
000000012000100001900800020380115421412817,0000000000000000000000100008036000D0B0D41E
0000000120001000819008130202817154F1F3FC1F,000000000000000000000000000000000000000000
0000000120001020019048044246821174A161AC17,000000000000000000000000000000000000000000
000000012000100001900800020380115421412817,0000000000000000800002110900036050D0F2FD1F
000000012000100001900800020380115421412817,0000000000000000000000100008036000D0B0D41E
000000012000100001D00800020380115421412817,00000000000000000000020008010210500041AD17
000000012000100001900800020380115421412817,00000000000000000000020008010210500051AD17
000000012000100001D00800020380115421412817,000000000000008400008100000002000000008516
000000012000100001900800020380115421412817,000000000000008400008100000002000000108516
000000012000100001D00800020380115421412817,000000000000008400008100000102100000018516
000000012000100001900800020380115421412817,000000000000008400008100000102100000118516
000000012000100001D00800020380115421412817,000000000000008400008100000002000000108516
000000012000100001900800020380115421412817,000000000000008400008100000002000000108516
000000012000100001D00800020380115421412817,000000000000008400008100000002000000108516
000000012000100001900800020380115421412817,000000000000008400008100000002000000108516
000000012000100001D00800020380115421412817,00000000000000840000811000000320004090951E
000000012000100001900800020380115421412817,00000000000000840000811000000320004090951E
000000012000100001D00800020380115421412817,00000000000000840000811000000320004090951E
000000012000100001900800020380115421412817,00000000000000840000811000000320004090951E
000000012000100001D00800020380115421412817,0000000000000084800081100000036000D0B0D51E
000000012000100001900800020380115421412817,0000000000000084800081100000036000D0B0D51E
000000012000100001D00800020380115421412817,00000000000000840000C100400402002000008516
000000012000100001900800020380115421412817,00000000000000840000C100400402002000108516
000000012000100001D00800020380115421412817,00000000000000840000C100400402002000008516
000000012000100001900800020380115421412817,00000000000000840000C100400402002000108516
000000012000100001D00800020380115421412817,00000000000000000000420048040200700040AD17
000000012000100001900800020380115421412817,00000000000000000000420048040200700050AD17
000000012000100001D00800020380115421412817,0000000000000000000002100908032050D0F0BD1F
000000012000100001900800020380115421412817,0000000000000000000002100908032050D0F0BD1F
000000012000100001D00800020380115421412817,0000000000000000000002500808032050D0F0BD1F
000000012000100001900800020380115421412817,0000000000000000000002500808032050D0F0BD1F
000000012000100001D00800020380115421412817,0000000000000000000002500900036050D0F0FD1F
000000012000100001900800020380115421412817,0000000000000000000002500900036050D0F0FD1F
000000012000100001D00800020380115421412817,0000000000000000000030500900076250D0B8FD1F
000000012000100001900800020380115421412817,0000000000000000000030500900076250D0B8FD1F
000000012000100001D00800020380115421412817,000000000000000000000211090003605050D0FD1F
000000012000100001900800020380115421412817,000000000000000000000211090003605050D0FD1F
000000012000100001D00800020380115421412817,0000000000000000800002110900036050D0F2FD1F
000000012000100001900800020380115421412817,0000000000000000800002110900036050D0F2FD1F
000000012000100001D00800020380115421412817,0000000000020000000002500886032070C0F0BD1F
000000012000100001900800020380115421412817,0000000000020000000002500886032070C0F0BD1F
000000012000100001D00800020380115421412817,000000000002000000000210098603207040D0BD1F
000000012000100001900800020380115421412817,000000000002000000000210098603207040D0BD1F
000000012000100001D00800020380115421412817,000000000000000000000000000106100000058416
000000012000100001900800020380115421412817,000000000000000000000000000106100000158416
000000012000100001D00800020380115421412817,0000000000000000000000100008076000D0B4D41E
000000012000100001900800020380115421412817,0000000000000000000000100008076000D0B4D41E
000000012000100001900800020380115421412817,00000000000000000000020008080200509070AD17
000000012000100001900800020380115421412817,0000000000000000000002100808032050D0F0BD1F
000000012000100001900800020380115421412817,0000000000000000000002500800032050D0F0BD1F
000000012000100001900800020380115421412817,0000000000000000000002510800036050D0F0FD1F
000000012000100001900800020380115421412817,0000000000000000000030510800076250D0B8FD1F
000000012000100001900800020380115421412817,00000000000000000000301109000762505098FD1F
000000012000100001900800020380115421412817,0000000000000000800002100900036050D0F0FD1F
000000012000100001900800020380115421412817,0000000000000000800030100900076250D0B8FD1F
000000012000100001900800020380115421412817,0000000000000000000002440910036050D2F0FD1F
000000012000100001900800020380115421412817,0000000000000000000030500910076250D2B8FD1F
000000012000100001900800020380115421412817,0000000000020000000030500886072270D0B8BD1F
000000012000100001900800020380115421412817,00000000000000000000020608012290518055AD17
000000012000100001900800020380115421412817,0000000000000000000030100809269251801DAD17
000000012000100001900800020380115421412817,00000000000000000000020008010210500041AD17
000000012000100001900800020380115421412817,00000000000000000000020008010210500041AD17
000000012000100001900800020380115421412817,00000000000000000000420048040200700040AD17
000000012000100001900800020380115421412817,00000000000000000000420048040200700040AD17
000000012000100001900800020380115421412817,000000000000000000004200480C0200708070AD17
000000012000100001900800020380115421412817,0000000000000000800002110900036050D0F2FD1F
000000012000100001900800020380115421412817,0000000000000000000002500900036050D0F0FD1F
000000012000100001900800020380115421412817,000001000000000000000000000000000000008016
000000012000100001900800020380115421412817,000000000000000000000000040000000000008016
000000012000100001900800020380115421412817,000000000000000000000000000006000000048416
000000012000100001900800020380115421412817,0000000000000000000002500900036050D0F0FD1F
000000012000100001900800020380115421412817,0000000000000000000030500900076250D0B8FD1F
000000012000100001900800020380115421412817,0000000000000000000000100008076000D0B4D41E
000000012000100001900800020380115421412817,0000010000000000000000100000016000D0B0D01E
000000012000100001900800020380115421412817,0000000000000000800002110900036050D0F2FD1F
000000012000100001900800020380115421412817,0000000000000000800030110900076250D0BAFD1F
000000012000100001900800020380115421412817,0000000000000000800000110000076000D0B6D41E
4
pK
86.2995,315.438,315.438,268.587,64.2648,14.9304,4,120.229,76.5327,120.229,120.229,120.229,120.229,120.229,303.946,326.467,332.218,382.932,345.848,355.736,444.097,385.884,248.887,193.829,257.225,204.033,178.442,474.719,179.6,268.587,436.124,411.858,343.375,290.79,237.479,380.16,136.54,385.884,198.647,350.525,101.687,356.531,204.033,326.467,104.842,351.954,81.7434,385.884,145.935,335.643,96.504,335.643,249.656,382.932,263.071,398.034,197.394,330.825,137.198,420.737,296.896,389.039,326.467,484.132,225.527,496,117.564,400.067,230.856,409.244,234.602,392.428,148.407,446.903,414.63,451.146,417.581,436.124,359.859,478.026,496,492.732,400.067,387.434,375.073,392.428,414.63,312.283,390.702,280.585,343.981,381.525,318.827,315.438,69.9886,217.189,270.995,151.927,56.8328,144.358,93.3489,88.5307,88.5307,228.846
86.2995,315.438,315.438,268.587,64.2648,14.9304,4,120.229,76.5327,120.229,120.229,120.229,120.229,120.229,303.946,326.467,332.218,382.932,345.848,355.736,444.097,385.884,248.887,193.829,257.225,204.033,178.442,474.719,179.6,268.587,436.124,411.858,343.375,290.79,237.479,380.16,136.54,385.884,198.647,350.525,101.687,356.531,204.033,326.467,104.842,351.954,81.7434,385.884,145.935,335.643,96.504,335.643,249.656,382.932,263.071,398.034,197.394,330.825,137.198,420.737,296.896,389.039,326.467,484.132,225.527,496,117.564,400.067,230.856,409.244,234.602,392.428,148.407,446.903,414.63,451.146,417.581,436.124,359.859,478.026,496,492.732,400.067,387.434,375.073,392.428,414.63,312.283,390.702,280.585,343.981,381.525,318.827,315.438,69.9886,217.189,270.995,151.927,56.8328,144.358,93.3489,88.5307,88.5307,228.846
pK Efficiency
98.8665,316.55,301.23,436.365,64.1758,25.8962,4,124.944,69.92,124.944,142.919,116.994,133.557,116.994,321.395,327.374,350.302,382.797,329.93,374.348,442.833,367.715,215.55,167.298,202.548,159.041,232.339,496,233.692,436.365,396.727,431.729,361.71,292.356,320.479,468.046,150.234,385.694,255.949,410.001,142.651,416.7,246.606,362.952,135.969,390.144,94.2082,385.694,194.354,393.402,136.595,393.402,315.552,446.147,295.315,417.595,225.246,348.878,150.906,419.904,298.35,370.693,344.422,482.129,216.373,451.145,114.479,363.958,221.402,372.298,250.496,392.118,162.368,445.587,457.012,471.899,437.581,435.007,343.153,454.678,493.778,468.557,363.958,336.968,326.136,392.118,394.846,329.92,410.098,351.693,425.771,444.577,304.428,333.146,114.98,295.584,361.599,165.966,62.7185,158.227,106.074,87.0776,80.8242,219.505
98.8665,316.55,301.23,436.365,64.1758,25.8962,4,124.944,69.92,124.944,142.919,116.994,133.557,116.994,321.395,327.374,350.302,382.797,329.93,374.348,442.833,367.715,215.55,167.298,202.548,159.041,232.339,496,233.692,436.365,396.727,431.729,361.71,292.356,320.479,468.046,150.234,385.694,255.949,410.001,142.651,416.7,246.606,362.952,135.969,390.144,94.2082,385.694,194.354,393.402,136.595,393.402,315.552,446.147,295.315,417.595,225.246,348.878,150.906,419.904,298.35,370.693,344.422,482.129,216.373,451.145,114.479,363.958,221.402,372.298,250.496,392.118,162.368,445.587,457.012,471.899,437.581,435.007,343.153,454.678,493.778,468.557,363.958,336.968,326.136,392.118,394.846,329.92,410.098,351.693,425.771,444.577,304.428,333.146,114.98,295.584,361.599,165.966,62.7185,158.227,106.074,87.0776,80.8242,219.505
MW
174.631,203.936,233.242,4,404.309,341.578,433.615,370.884,496,239.476,176.745,268.782,206.051,331.167,178.751,208.056,166.207,195.513,224.818,174.631,203.936,233.242,279.126,279.126,329.314,329.314,90.925,164.151,90.925,4,256.188,164.151,147.404,174.645,78.4397,105.681,183.027,210.269,107.746,134.987,107.746,134.987,141.171,168.413,141.171,168.413,203.903,231.145,150.404,177.645,150.404,177.645,114.78,142.022,134.853,162.095,134.853,162.095,168.279,195.521,197.585,224.827,168.279,195.521,231.011,258.253,247.61,274.852,247.61,274.852,145.339,172.581,166.215,193.457,128.669,162.095,162.095,195.521,224.827,224.827,195.521,224.827,254.133,283.438,304.157,183.069,212.375,145.339,143.275,112.716,110.652,139.957,228.947,164.151,28.1997,32.4116,36.6235,164.151,193.457,162.087,153.663,226.883,256.188,224.818
174.631,203.936,233.242,4,404.309,341.578,433.615,370.884,496,239.476,176.745,268.782,206.051,331.167,178.751,208.056,166.207,195.513,224.818,174.631,203.936,233.242,279.126,279.126,329.314,329.314,90.925,164.151,90.925,4,256.188,164.151,147.404,174.645,78.4397,105.681,183.027,210.269,107.746,134.987,107.746,134.987,141.171,168.413,141.171,168.413,203.903,231.145,150.404,177.645,150.404,177.645,114.78,142.022,134.853,162.095,134.853,162.095,168.279,195.521,197.585,224.827,168.279,195.521,231.011,258.253,247.61,274.852,247.61,274.852,145.339,172.581,166.215,193.457,128.669,162.095,162.095,195.521,224.827,224.827,195.521,224.827,254.133,283.438,304.157,183.069,212.375,145.339,143.275,112.716,110.652,139.957,228.947,164.151,28.1997,32.4116,36.6235,164.151,193.457,162.087,153.663,226.883,256.188,224.818
log P
81.3369,125.595,169.852,147.653,260.961,259.985,263.718,262.742,496,174.454,173.478,177.211,176.235,409.493,29.6856,73.9433,26.5892,70.8469,115.105,92.512,136.77,181.027,177.173,177.173,130.103,130.103,4,100.21,4,147.653,202.468,100.21,158.105,261.735,104.443,208.072,235.276,338.905,139.434,243.063,139.434,243.063,105.418,209.048,105.418,209.048,106.394,210.023,178.572,282.202,178.572,282.202,101.402,205.032,63.239,166.869,63.239,166.869,29.2238,132.853,31.9807,135.61,29.2238,132.853,30.1995,133.829,179.174,282.803,179.174,282.803,147.514,251.143,18.6319,122.261,200.884,166.869,166.869,132.853,135.61,135.61,132.853,135.61,221.369,224.126,285.56,230.597,233.354,226.744,295.383,170.041,238.679,273.67,98.8381,166.501,110.241,197.666,153.958,166.501,169.258,155.909,112.192,167.477,170.233,156.885
81.3369,125.595,169.852,147.653,260.961,259.985,263.718,262.742,496,174.454,173.478,177.211,176.235,409.493,29.6856,73.9433,26.5892,70.8469,115.105,92.512,136.77,181.027,177.173,177.173,130.103,130.103,4,100.21,4,147.653,202.468,100.21,158.105,261.735,104.443,208.072,235.276,338.905,139.434,243.063,139.434,243.063,105.418,209.048,105.418,209.048,106.394,210.023,178.572,282.202,178.572,282.202,101.402,205.032,63.239,166.869,63.239,166.869,29.2238,132.853,31.9807,135.61,29.2238,132.853,30.1995,133.829,179.174,282.803,179.174,282.803,147.514,251.143,18.6319,122.261,200.884,166.869,166.869,132.853,135.61,135.61,132.853,135.61,221.369,224.126,285.56,230.597,233.354,226.744,295.383,170.041,238.679,273.67,98.8381,166.501,110.241,197.666,153.958,166.501,169.258,155.909,112.192,167.477,170.233,156.885
#000000,#F20D0D,#0DF20D,#2B71FF,#F20DF2,#FF8000,#066106,#0DF2F2,#AA3F09
0,1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,31,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,75,76,77,78,79,80,81,82,83,84,85,86,87,88,89,90,91,92,93,94,95,96,97,98,99,100,101,102,103,104
1,28,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,75,76,77,78,79,80,81,82,83,84,85,86,87,88,90,93
2,34,54,56,58,60,62,64,66,68,70,75,76,77,78,79,80,81,82,83,84,85,86,87,88,90,93
3,86,87
4,86
4,87
3,34,88
7,34
7,88
3,54
3,56
3,58
3,60
3,62
3,64
3,66
3,68
3,70
3,75
3,76
3,77
3,78
3,79
3,80
3,81
3,82
3,83
3,84
3,85
3,90
3,93
2,36,38,40,42,44,46,48,50,52
32,36
32,40
32,42
32,44
32,46
32,48
32,50
32,52
32,38
41,38
2,72,74
43,74
43,72
45,72
2,28,32
47,28
47,32
1,31,89,91,92,94,95,96,97,98,99,100,101,102,103,104
50,31,89,91,92,94
51,31
51,91
51,92
51,94
51,89
56,89
50,98,99,102,103
58,102
58,103
58,98
58,99
50,97,100,104
63,100
63,104
63,97
50,95,101
67,101
67,95
50,96
70,96
1,15,16,17,18,19,20,21,22,23,24,25,26,27,29
72,25,26
73,25
73,26
72,23,24
76,23
76,24
72,15
72,16
72,17
72,18
72,19
72,20
72,21
72,22
72,27
72,29
1,5,6,7,8,9,10,11,12,13,14
89,5,6,7,8,9,10,11,12,13,14
90,9,14
91,14
91,9
90,10
90,11
90,12
90,13
90,5
90,6
90,7
90,8
1,1,2,3
102,3
103,3
102,2
105,2
102,1
107,1
1,4,30
109,30
109,4
0,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69,71,73
112,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69,71,73
113,33,53,55,57,59,61,63,65,67,69
114,53
114,55
114,57
114,59
114,61
114,63
114,65
114,67
114,69
114,33
124,33
113,35,37,39,41,43,45,47,49,51
126,35
126,39
126,41
126,43
126,45
126,47
126,49
126,51
126,37
135,37
113,71,73
137,73
137,71
139,71
140
