0 B9R1.69 C1=C(C(=NC(=N1)Cl)Cl)Br 9840 [0,0,0,0,0,0|2,1,1]=4 1 B9R1.69 C1=C(C(=NC(=N1)Cl)Cl)F 6451 [0,0,0,0,0,0|2,0,1]=3 2 B9R1.69 C1=C(C(=O)NC(=O)N1)I 6652 [0,0,0,0,0,0|1,1,1]=3 3 B9R1.69 C1=CC(=C(C=C1Br)Br)F 6201 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.69 C1=CC(=C(C=C1Br)Cl)F 5541 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.69 C1=CC(=C(C=C1Br)F)F 6000 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.69 C1=CC(=C(C=C1Br)N)N 5041 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.69 C1=CC(=C(C=C1Br)N)O 8620 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.69 C1=CC(=C(C=C1Cl)Br)F 6484 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.69 C1=CC(=C(C=C1Cl)Cl)F 5400 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.69 C1=CC(=C(C=C1Cl)N)Br 10527 [0,0,0,0,0,0|3,1,0]=4 11 B9R1.69 C1=CC(=C(C=C1Cl)N)F 5788 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.69 C1=CC(=C(C=C1Cl)N)N 10655 [0,0,0,0,0,0|4,0,0]=4 13 B9R1.69 C1=CC(=C(C=C1F)N)Br 5466 [0,0,0,0,0,0|3,1,0]=4 14 B9R1.69 C1=CC(=C(C=C1F)N)Cl 8573 [0,0,0,0,0,0|3,1,0]=4 15 B9R1.69 C1=CC(=C(C=C1F)N)F 5391 [0,0,0,0,0,0|3,0,0]=3 16 B9R1.69 C1=CC(=C(C=C1F)N)N 8159 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.69 C1=CC(=C(C=C1F)N)O 9491 [0,0,0,0,0,0|4,0,0]=4 18 B9R1.69 C1=CC(=C(C=C1I)Cl)F 8917 [0,0,0,0,0,0|4,0,0]=4 19 B9R1.69 C1=CC(=C(C=C1I)F)F 8933 [0,0,0,0,0,0|4,0,0]=4 20 B9R1.69 C1=CC(=C(C=C1N)Br)F 9837 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.69 C1=CC(=C(C=C1N)Cl)F 6046 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.69 C1=CC(=C(C=C1N)Cl)F 9805 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.69 C1=CC(=C(C=C1N)F)F 6033 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.69 C1=CC(=C(C=C1O)F)F 10058 [0,0,0,0,0,0|3,0,1]=4 25 B9R1.69 C1=CC(=C(C=C1O)N)F 8132 [0,0,0,0,0,0|2,0,1]=3 26 B9R1.69 C1=CC(=NC(=C1F)F)F 8652 [0,0,0,0,0,0|3,0,1]=4 27 B9R1.69 CC1=C(C=C(C=C1)F)N 6050 [0,0,0,0,0,0|4,0,0]=4 28 B9R1.69 CC1=C(C=CC(=C1)Br)F 6043 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.69 CC1=C(C=CC(=C1)F)F 5294 [0,0,0,0,0,0|4,0,0]=4 30 B9R1.69 CC1=C(C=CC(=C1)F)F 8711 [0,0,0,0,0,0|4,0,0]=4 31 B9R1.69 CC1=C(C=CC(=C1)I)F 6231 [0,0,0,0,0,0|4,0,0]=4 32 B9R1.69 CC1=C(C=CC(=C1)N)F 5275 [0,0,0,0,0,0|4,0,0]=4 33 B9R1.69 CC1=C(C=CC(=C1)O)F 6307 [0,0,0,0,0,0|3,0,1]=4 34 B9R1.69 CC1=C(C=CC(=N1)Cl)F 5081 [0,0,0,0,0,0|3,0,1]=4 35 B9R1.69 CC1=CC(=C(C=C1)C)N 5322 [0,0,0,0,0,0|4,0,0]=4 36 B9R1.69 CC1=CC(=C(C=C1)F)Br 6183 [0,0,0,0,0,0|4,0,0]=4 37 B9R1.69 CC1=CC(=C(C=C1)F)Cl 6423 [0,0,0,0,0,0|4,0,0]=4 38 B9R1.69 CC1=CC(=C(C=C1)F)I 6427 [0,0,0,0,0,0|4,0,0]=4 39 B9R1.69 CC1=CC(=C(C=C1)F)N 6577 [0,0,0,0,0,0|3,0,0]=3 40 B9R1.69 CC1=CC(=C(C=C1)F)O 5573 [0,0,0,0,0,0|4,0,0]=4 41 B9R1.69 CC1=CC(=C(C=C1)N)N 6659 [0,0,0,0,0,0|4,0,0]=4 42 B9R1.69 CC1=CC(=C(C=C1)O)N 8098 [0,0,0,0,0,0|4,0,0]=4 43 B9R1.69 CC1=CC(=NC=C1Br)Br 8455 [0,0,0,0,0,0|3,1,0]=4 44 B9R1.69 c1cc(c(cc1Cl)N)N C0263 [0,0,0,0,0,0|4,0,0]=4 45 B8R1.3 C1=C(C=NC(=N1)Cl)Br 5202 [1,0,0,0,0,0|1,1,1]=4 46 B8R1.3 C1=C(C=NC(=N1)Cl)Br 9321 [1,0,0,0,0,0|1,1,1]=4 47 B8R1.3 C1=C(C=NC(=N1)Cl)F 6642 [1,0,0,0,0,0|1,0,1]=3 48 B8R1.3 C1=C(C=NC(=N1)I)Br 10468 [1,0,0,0,0,0|1,1,1]=4 49 B8R1.3 C1=C(C=NC(=N1)N)Br 10687 [1,0,0,0,0,0|1,1,1]=4 50 B8R1.3 C1=C(C=NC(=N1)N)Cl 5105 [1,0,0,0,0,0|1,1,1]=4 51 B8R1.3 C1=C(C=NC(=O)N1)Br 10164 [1,0,0,0,0,0|0,1,0]=2 52 B8R1.3 C1=CC(=CC=C1F)Br 6014 [1,0,0,0,0,0|3,0,0]=4 53 B8R1.3 C1=CC(=CC=C1F)Cl 9763 [1,0,0,0,0,0|3,0,0]=4 54 B8R1.3 C1=CC(=CC=C1F)F 10591 [1,0,0,0,0,0|3,0,0]=4 55 B8R1.3 C1=CC(=CC=C1N)F 5032 [1,0,0,0,0,0|3,0,0]=4 56 B8R1.3 C1=CC(=NC=C1Br)Br 5443 [1,0,0,0,0,0|2,1,0]=4 57 B8R1.3 C1=CC(=NC=C1Br)Cl 9228 [1,0,0,0,0,0|2,1,0]=4 58 B8R1.3 C1=CC(=NC=C1Br)I 9334 [1,0,0,0,0,0|2,1,0]=4 59 B8R1.3 C1=CC(=NC=C1Br)N 10514 [1,0,0,0,0,0|2,1,0]=4 60 B8R1.3 C1=CC(=NC=C1Cl)Br 6467 [1,0,0,0,0,0|2,1,0]=4 61 B8R1.3 C1=CC(=NC=C1Cl)N 8218 [1,0,0,0,0,0|2,1,0]=4 62 B8R1.3 C1=CC(=NC=C1F)Br 10006 [1,0,0,0,0,0|2,0,0]=3 63 B8R1.3 C1=CC(=NC=C1F)Br 6615 [1,0,0,0,0,0|2,0,0]=3 64 B8R1.3 C1=CC(=NC=C1F)Cl 9957 [1,0,0,0,0,0|2,0,0]=3 65 B8R1.3 C1=CC(=NC=C1F)F 5247 [1,0,0,0,0,0|2,0,0]=3 66 B8R1.3 C1=CC(=NC=C1F)N 10320 [1,0,0,0,0,0|2,0,0]=3 67 B8R1.3 C1=CC(=NC=C1I)Br 9940 [1,0,0,0,0,0|2,1,0]=4 68 B8R1.3 C1=CC(=NC=C1I)Cl 5225 [1,0,0,0,0,0|2,1,0]=4 69 B8R1.3 C1=CC(=NC=C1I)N 5110 [1,0,0,0,0,0|2,1,0]=4 70 B8R1.3 C1=CC(=NC=C1O)Br 10436 [1,0,0,0,0,0|3,0,0]=4 71 B8R1.3 C1=CC(=NC=C1O)Cl 9958 [1,0,0,0,0,0|3,0,0]=4 72 B8R1.3 C1=CC(=O)NC=C1Br 8266 [1,0,0,0,0,0|1,1,0]=3 73 B8R1.3 C1=CC(=O)NC=C1Cl 10450 [1,0,0,0,0,0|1,1,0]=3 74 B8R1.3 C1=CC(=O)NC=C1F 8617 [1,0,0,0,0,0|1,0,0]=2 75 B8R1.3 CC1=CN=C(C=C1)Br 9393 [1,0,0,0,0,0|3,0,0]=4 76 B8R1.3 CC1=CN=C(C=C1)F 5449 [1,0,0,0,0,0|3,0,0]=4 77 B8R1.3 CC1=CNC(=O)C=C1 9951 [1,0,0,0,0,0|2,0,0]=3 78 B8R1.3 CC1=NC=C(C=C1)Br 5076 [1,0,0,0,0,0|2,1,0]=4 79 B8R1.3 CC1=NC=C(C=C1)N 10240 [1,0,0,0,0,0|3,0,0]=4 80 B8R1.3 c1c(cnc(n1)F)Br B1994 [1,0,0,0,0,0|1,1,1]=4 81 B8R1.3 c1c(cnc(n1)N)Br A0051 [1,0,0,0,0,0|1,1,1]=4 82 B8R1.3 c1cc(ccc1F)Br B0238 [1,0,0,0,0,0|3,0,0]=4 83 B8R1.3 c1cc(ccc1N)F F0045 [1,0,0,0,0,0|3,0,0]=4 84 B8R1.4 C1=CC(=CC(=C1)Br)N 8582 [1,0,0,0,0,0|3,0,0]=4 85 B8R1.4 C1=CC(=CC(=C1)Br)N 8583 [1,0,0,0,0,0|3,0,0]=4 86 B8R1.4 C1=CC(=NC(=C1)Cl)N 5316 [1,0,0,0,0,0|2,0,1]=4 87 B8R1.4 C1=CC(=NC(=C1)F)N 5229 [1,0,0,0,0,0|2,0,1]=4 88 B8R1.4 C1=CC(=NC(=C1)N)N 6752 [1,0,0,0,0,0|2,0,1]=4 89 B8R1.4 C1=CC(=O)NC(=C1)Cl 10464 [1,0,0,0,0,0|2,0,0]=3 90 B8R1.4 C1=CC(=O)NC(=C1)F 6665 [1,0,0,0,0,0|2,0,0]=3 91 B8R1.4 C1=CN=C(C=C1Br)Br 5241 [1,0,0,0,0,0|3,0,0]=4 92 B8R1.4 C1=CN=C(C=C1Br)Cl 8808 [1,0,0,0,0,0|3,0,0]=4 93 B8R1.4 C1=CN=C(C=C1Br)F 6500 [1,0,0,0,0,0|3,0,0]=4 94 B8R1.4 C1=CN=C(C=C1Br)N 8459 [1,0,0,0,0,0|3,0,0]=4 95 B8R1.4 C1=CN=C(C=C1Cl)Cl 5661 [1,0,0,0,0,0|3,0,0]=4 96 B8R1.4 C1=CN=C(C=C1I)F 8362 [1,0,0,0,0,0|3,0,0]=4 97 B8R1.4 C1=CN=C(C=C1N)Br 9320 [1,0,0,0,0,0|2,0,0]=3 98 B8R1.4 C1=CN=C(C=C1N)Cl 5451 [1,0,0,0,0,0|2,0,0]=3 99 B8R1.4 C1=CN=C(N=C1N)Cl 6711 [1,0,0,0,0,0|1,0,1]=3 100 B8R1.4 C1=CN=C(N=C1N)N 9571 [1,0,0,0,0,0|1,0,1]=3 101 B8R1.4 C1=CNC(=O)C=C1O 10547 [1,0,0,0,0,0|2,0,1]=4 102 B8R1.4 C1=NC(=O)NC(=N1)N 8219 [1,0,0,0,0,0|1,0,0]=2 103 B8R1.4 C1=NNC(=O)NC1=O 5252 [1,0,0,0,0,0|2,0,1]=4 104 B8R1.4 CC1=CC(=NC=C1)Br 9012 [1,0,0,0,0,0|3,0,0]=4 105 B8R1.4 CC1=CC(=NC=C1)Cl 5069 [1,0,0,0,0,0|3,0,0]=4 106 B8R1.4 CC1=CC(=NC=C1)F 5561 [1,0,0,0,0,0|3,0,0]=4 107 B8R1.4 CC1=CC(=NC=C1)F 6308 [1,0,0,0,0,0|3,0,0]=4 108 B8R1.4 CC1=NC(=NC=C1)Br B1240 [1,0,0,0,0,0|2,0,1]=4 109 B8R1.4 CC1=NC(=NC=C1)Cl 5673 [1,0,0,0,0,0|2,0,1]=4 110 B8R1.4 CC1=NC=CC(=C1)N 6613 [1,0,0,0,0,0|2,0,0]=3 111 B8R1.4 Cc1ccnc(n1)N A0244 [1,0,0,0,0,0|2,0,1]=4 112 B8R1.4 Cc1ccnc(n1)O H0124 [1,0,0,0,0,0|1,0,2]=4 113 B8R1.5 C1=CC(=C(N=C1)Cl)F 5206 [1,0,0,0,0,0|2,0,1]=4 114 B8R1.5 C1=CC(=C(N=C1)F)F 5471 [1,0,0,0,0,0|2,0,1]=4 115 B8R1.5 C1=CC(=C(N=C1)N)Br 6715 [1,0,0,0,0,0|1,1,1]=4 116 B8R1.5 C1=CC(=C(N=C1)N)Cl 10389 [1,0,0,0,0,0|1,1,1]=4 117 B8R1.5 C1=CC(=C(N=C1)N)F 10619 [1,0,0,0,0,0|1,0,1]=3 118 B8R1.5 C1=CC(=C(N=C1)N)N 9712 [1,0,0,0,0,0|2,0,1]=4 119 B8R1.5 C1=CC=C(C(=C1)F)Br 6002 [1,0,0,0,0,0|3,0,0]=4 120 B8R1.5 C1=CC=C(C(=C1)F)Cl 10274 [1,0,0,0,0,0|3,0,0]=4 121 B8R1.5 C1=CC=C(C(=C1)F)Cl 6006 [1,0,0,0,0,0|3,0,0]=4 122 B8R1.5 C1=CC=C(C(=C1)F)F 6007 [1,0,0,0,0,0|3,0,0]=4 123 B8R1.5 C1=CC=C(C(=C1)F)F 8369 [1,0,0,0,0,0|3,0,0]=4 124 B8R1.5 C1=CC=C(C(=C1)N)Br 5510 [1,0,0,0,0,0|2,1,0]=4 125 B8R1.5 C1=CC=C(C(=C1)N)F 6030 [1,0,0,0,0,0|2,0,0]=3 126 B8R1.5 C1=CC=C(C(=C1)N)I 9774 [1,0,0,0,0,0|2,1,0]=4 127 B8R1.5 C1=CN=CC(=C1Br)Cl 6714 [1,0,0,0,0,0|2,1,0]=4 128 B8R1.5 C1=CN=CC(=C1Cl)Cl 6626 [1,0,0,0,0,0|2,1,0]=4 129 B8R1.5 C1=CN=CC(=C1Cl)F 6867 [1,0,0,0,0,0|2,0,0]=3 130 B8R1.5 C1=CN=CC(=C1I)F 8281 [1,0,0,0,0,0|2,0,0]=3 131 B8R1.5 C1=CN=CC(=C1N)Br 9751 [1,0,0,0,0,0|1,1,0]=3 132 B8R1.5 C1=CN=CC(=C1N)N 9425 [1,0,0,0,0,0|2,0,0]=3 133 B8R1.5 CC1=C(C=CN=C1)Cl 9936 [1,0,0,0,0,0|3,0,0]=4 134 B8R1.5 CC1=C(C=NC=C1)Br 10003 [1,0,0,0,0,0|2,1,0]=4 135 B8R1.5 c1ccc(c(c1)N)F F0011 [1,0,0,0,0,0|2,0,0]=3 136 B10R1.22 C1(=C(NC(=NC1=O)N)N)N 9726 [0,1,0,0,0,0|2,0,0]=3 137 B10R1.22 CC1=CC(=O)NC(=C1C)O 6842 [0,1,0,0,0,0|3,0,0]=4 138 B10R1.30 C1=CC(=C(C=C1Cl)CN)F 9760 [0,1,0,0,0,0|3,0,0]=4 139 B10R1.30 C1=CC(=C(C=C1F)CN)F 6209 [0,1,0,0,0,0|3,0,0]=4 140 B10R1.118 C1=C(C(=CC(=C1Br)F)F)N 6462 [0,1,0,0,0,0|3,0,0]=4 141 B10R1.118 C1=C(C(=CC(=C1F)F)F)N 9901 [0,1,0,0,0,0|3,0,0]=4 142 B10R1.119 C1=CC(=C(C(=C1F)N)F)F 6061 [0,1,0,0,0,0|3,0,0]=4 143 B10R1.176 C1=CC(=C(C=C1C#N)N)F 10652 [0,1,0,0,0,0|3,0,0]=4 144 B10R1.176 C1=CC(=C(C=C1C=O)Br)F 5548 [0,1,0,0,0,0|3,0,0]=4 145 B10R1.176 C1=CC(=C(C=C1C=O)Cl)F 8322 [0,1,0,0,0,0|3,0,0]=4 146 B10R1.176 C1=CC(=C(C=C1C=O)F)F 5614 [0,1,0,0,0,0|3,0,0]=4 147 B7R0.6 C(=O)(N)\N=N\C(=O)N 5884 [1,0,1,0,0,0|2,0,0]=4 148 B7R1.3 C1=C(C=NC=N1)Br 5441 [2,0,0,0,0,0|0,1,1]=4 149 B7R1.3 C1=C(C=NC=N1)N 10659 [2,0,0,0,0,0|1,0,1]=4 150 B7R1.3 C1=CC(=CN=C1)N 9511 [2,0,0,0,0,0|2,0,0]=4 151 B7R1.3 C1=CC(=CN=C1)O 6695 [2,0,0,0,0,0|2,0,0]=4 152 B7R1.3 C1=CC(=CN=C1)O 6696 [2,0,0,0,0,0|2,0,0]=4 153 B7R1.3 C1=CC=C(C=C1)F 5387 [2,0,0,0,0,0|2,0,0]=4 154 B7R1.3 C1=CC=NC(=C1)Br 6647 [2,0,0,0,0,0|2,0,0]=4 155 B7R1.3 C1=CN=CN=C1N 6491 [2,0,0,0,0,0|0,0,1]=3 156 B7R1.3 CC1=CN=CC=C1 8633 [2,0,0,0,0,0|2,0,0]=4 157 B7R1.3 c1c(cncn1)Br B0314 [2,0,0,0,0,0|0,1,1]=4 158 B7R1.3 c1ccc(cc1)F B0042 [2,0,0,0,0,0|2,0,0]=4 159 B7R1.3 c1ccnc(c1)Br B0025 [2,0,0,0,0,0|2,0,0]=4 160 B7R1.3 c1cnc(nc1)N A0006 [2,0,0,0,0,0|1,0,1]=4 161 B9R1.1 C1=CC(=CC=C1C=O)F 6034 [1,1,0,0,0,0|2,0,0]=4 162 B9R1.1 C1=CC(=NC=C1Br)C=O 5008 [1,1,0,0,0,0|1,1,0]=4 163 B9R1.3 C1=CN=C(C(=C1N)Br)Cl 10232 [1,1,0,0,0,0|2,0,0]=4 164 B9R1.34 C1=C(C=C(N=C1Cl)Cl)N 6593 [1,1,0,0,0,0|2,0,0]=4 165 B9R1.34 C1=C(N=C(N=C1Cl)N)N 10301 [1,1,0,0,0,0|1,0,1]=4 166 B9R1.34 C1=C(N=C(N=C1Cl)N)N 10424 [1,1,0,0,0,0|1,0,1]=4 167 B9R1.34 C1=C(NC(=O)NC1=O)Cl 5189 [1,1,0,0,0,0|1,0,1]=4 168 B9R1.34 CC1=CC(=NC(=S)N1)C 6651 [1,1,0,0,0,0|1,1,0]=4 169 B9R1.34 CC1=CC(=NC(=S)N1)C 8595 [1,1,0,0,0,0|1,1,0]=4 170 B9R1.34 CC1=CC(=O)NC(=O)N1 6750 [1,1,0,0,0,0|1,0,1]=4 171 B9R1.15 C1=CC=C(C(=C1)CN)F 8921 [1,1,0,0,0,0|2,0,0]=4 172 B9R1.15 C1=CC=C(C(=C1)NN)F 5985 [1,1,0,0,0,0|2,0,0]=4 173 B11R1.21 C1=CC(=C(C=C1C(=O)O)N)F 8984 [0,2,0,0,0,0|2,0,0]=4 174 B7R1.2 CC1=CC(=O)NO1 9631 [1,0,0,0,1,0|2,0,0]=4