0 B9R1.15 BrC1=CC=CN=C1OC AK-33153 [0,0,0,0,0,0|2,1,0]=3 1 B9R1.15 BrC1=CN=CN=C1NC AK-31820 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.15 BrC1=NC=CC=C1C=O AK-33078 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.15 BrCC1=NC=CC=C1Br AK158877 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.15 C(C)C1=NC=NC=C1F AK-23771 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.15 C1=C(C(=CC=C1)Br)CC AK-46714 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.15 C1=C(C(=NC=C1)Cl)C#N AK-36024 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.15 C1=C(I)C(=NC=C1)OC AK-25295 [0,0,0,0,0,0|2,1,0]=3 8 B9R1.15 C1=CC=CC(=C1NN)C AK-46554 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.15 C1=CC=CC(=C1OC)F AK-46555 [0,0,0,0,0,0|3,1,0]=4 10 B9R1.15 C1=CC=NC(=C1C#N)Br AK-23604 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.15 C1=CC=NC(=C1C)C#N AK-25587 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.15 C1=CC=NC(=C1C=O)Cl AK-25854 [0,0,0,0,0,0|4,0,0]=4 13 B9R1.15 C1=CC=NC(=C1C=O)F AK-29226 [0,0,0,0,0,0|4,0,0]=4 14 B9R1.15 C1=CN=C(C(=N1)C#N)Cl AK-21979 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.15 C1=NC(=C(C=C1)CO)N AK-23581 [0,0,0,0,0,0|4,0,0]=4 16 B9R1.15 C1=NC(=C(N=C1)Cl)NN AK-24564 [0,0,0,0,0,0|3,0,0]=3 17 B9R1.15 CC1=CC=CC=C1CC AK-49977 [0,0,0,0,0,0|3,0,0]=3 18 B9R1.15 CC1=CC=CN=C1CCl AK-77025 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.15 CC1=CC=CN=C1OC AK126197 [0,0,0,0,0,0|1,1,0]=2 20 B9R1.15 CC1=CC=NN=C1NN AK129520 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.15 CC1=NC=CC=C1C#N AK-32548 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.15 CC1=NC=CN=C1CC AK114356 [0,0,0,0,0,0|1,0,0]=1 23 B9R1.15 CCC1=C(Cl)N=CC=N1 AK-54851 [0,0,0,0,0,0|2,0,0]=2 24 B9R1.15 CCC1=CN=CN=C1Cl AK-25151 [0,0,0,0,0,0|4,0,0]=4 25 B9R1.15 CCC1=NC=CC=C1Br AK128590 [0,0,0,0,0,0|3,0,0]=3 26 B9R1.15 CCC1=NC=NC=C1Br AK105597 [0,0,0,0,0,0|4,0,0]=4 27 B9R1.15 CNC1=CC=CC=C1Cl AK163346 [0,0,0,0,0,0|4,0,0]=4 28 B9R1.15 CNC1=CC=CC=C1F AK-48931 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.15 CNC1=CC=CN=C1Cl AK115045 [0,0,0,0,0,0|3,0,0]=3 30 B9R1.15 CNC1=NC=CC=C1Cl AK140218 [0,0,0,0,0,0|3,0,0]=3 31 B9R1.15 CNC1=NC=CN=C1N AK-23939 [0,0,0,0,0,0|2,0,0]=2 32 B9R1.15 COC1=C(Br)N=CC=N1 AK-37282 [0,0,0,0,0,0|1,1,0]=2 33 B9R1.15 COC1=C(C)N=CC=N1 AK-29085 [0,0,0,0,0,0|0,1,0]=1 34 B9R1.15 COC1=CC=CC=C1Br AK-76806 [0,0,0,0,0,0|3,1,0]=4 35 B9R1.15 COC1=CC=CN=C1Br AK-29048 [0,0,0,0,0,0|2,1,0]=3 36 B9R1.15 COC1=CC=CN=C1F AK-63160 [0,0,0,0,0,0|2,1,0]=3 37 B9R1.15 COC1=CN=CN=C1Cl AK-30681 [0,0,0,0,0,0|3,1,0]=4 38 B9R1.15 COC1=NC=CC=C1Cl AK-33154 [0,0,0,0,0,0|2,1,0]=3 39 B9R1.15 COC1=NC=CC=C1F AK-33314 [0,0,0,0,0,0|2,1,0]=3 40 B9R1.15 COC1=NC=CN=C1I AK-94547 [0,0,0,0,0,0|1,1,0]=2 41 B9R1.15 COC1=NC=NC=C1Br AK133377 [0,0,0,0,0,0|3,1,0]=4 42 B9R1.15 COC1=NC=NC=C1Cl AK147276 [0,0,0,0,0,0|3,1,0]=4 43 B9R1.15 COC1=NC=NC=C1I AK-37534 [0,0,0,0,0,0|3,1,0]=4 44 B9R1.15 CSC1=NC=CN=C1C AK-53396 [0,0,0,0,0,0|0,0,0]=0 45 B9R1.15 ClC1=CC=CN=C1CBr AK138503 [0,0,0,0,0,0|4,0,0]=4 46 B9R1.15 ClC1=CC=CN=C1NN AK-34224 [0,0,0,0,0,0|4,0,0]=4 47 B9R1.15 ClC1=NC=CN=C1CCl AK-37298 [0,0,0,0,0,0|3,0,0]=3 48 B9R1.15 ClC1=NC=CN=C1OC AK-25926 [0,0,0,0,0,0|1,1,0]=2 49 B9R1.15 ClCC1=NC=CC=C1Cl AK109982 [0,0,0,0,0,0|4,0,0]=4 50 B9R1.15 ClCC1=NC=CC=C1Cl AK138192 [0,0,0,0,0,0|4,0,0]=4 51 B9R1.15 FC1=CC=CN=C1C=O AK-25751 [0,0,0,0,0,0|4,0,0]=4 52 B9R1.15 FC1=CC=CN=C1CBr AK128379 [0,0,0,0,0,0|4,0,0]=4 53 B9R1.15 FC1=CC=CN=C1CCl AK109609 [0,0,0,0,0,0|4,0,0]=4 54 B9R1.15 FC1=CC=CN=C1CO AK-29127 [0,0,0,0,0,0|4,0,0]=4 55 B9R1.15 FC1=NC=CC=C1C#C AK128642 [0,0,0,0,0,0|3,0,1]=4 56 B9R1.15 FC1=NC=CC=C1CN AK-30140 [0,0,0,0,0,0|4,0,0]=4 57 B9R1.15 N#CC1=C(F)N=CC=C1 AK-37334 [0,0,0,0,0,0|4,0,0]=4 58 B9R1.15 N#CC1=NC=CC=C1Br AK-32446 [0,0,0,0,0,0|4,0,0]=4 59 B9R1.15 N#CC1=NC=CC=C1Cl AK-34934 [0,0,0,0,0,0|4,0,0]=4 60 B9R1.15 N#CC1=NC=CC=C1F AK-29631 [0,0,0,0,0,0|4,0,0]=4 61 B9R1.15 N#CC1=NC=CN=C1N AK-27803 [0,0,0,0,0,0|3,0,0]=3 62 B9R1.15 NC1=CC=CC=C1NC AK-35283 [0,0,0,0,0,0|4,0,0]=4 63 B9R1.15 NC1=CC=CN=C1OC AK-28363 [0,0,0,0,0,0|2,1,0]=3 64 B9R1.15 NC1=NC=CC=C1C#C AK-81032 [0,0,0,0,0,0|3,0,1]=4 65 B9R1.15 NC1=NC=CC=C1OC AK-25256 [0,0,0,0,0,0|2,1,0]=3 66 B9R1.15 NC1=NC=CN=C1C#C AK-24395 [0,0,0,0,0,0|2,0,1]=3 67 B9R1.15 NC1=NC=CN=C1C=O AK-30729 [0,0,0,0,0,0|3,0,0]=3 68 B9R1.15 NC1=NC=CN=C1CC AK-30572 [0,0,0,0,0,0|2,0,0]=2 69 B9R1.15 NC1=NC=CN=C1OC AK-23933 [0,0,0,0,0,0|1,1,0]=2 70 B9R1.15 NC1=NC=NC=C1OC AK115134 [0,0,0,0,0,0|3,1,0]=4 71 B9R1.15 NCC1=CC=CC=C1C AK-89642 [0,0,0,0,0,0|4,0,0]=4 72 B9R1.15 NCC1=NC=CC=C1C AK122548 [0,0,0,0,0,0|3,0,0]=3 73 B9R1.15 NCC1=NC=CC=C1Cl AK-41569 [0,0,0,0,0,0|4,0,0]=4 74 B9R1.15 NCC1=NC=CN=C1Cl AK-42166 [0,0,0,0,0,0|3,0,0]=3 75 B9R1.15 NCC1=NC=CN=C1Cl AK-64298 [0,0,0,0,0,0|3,0,0]=3 76 B9R1.15 O=C1C(CC)=NC=CN1 AK198883 [0,0,0,0,0,0|2,0,1]=3 77 B9R1.15 O=CC1=C(C)N=CC=C1 AK-35801 [0,0,0,0,0,0|3,0,0]=3 78 B9R1.15 O=CC1=CC=CN=C1N AK-24791 [0,0,0,0,0,0|4,0,0]=4 79 B9R1.15 O=CC1=NC=CC=C1C AK-26127 [0,0,0,0,0,0|3,0,0]=3 80 B9R1.15 O=CC1=NC=CC=C1Cl AK-28957 [0,0,0,0,0,0|4,0,0]=4 81 B9R1.15 OC1=C(C=O)N=CC=C1 AK-47968 [0,0,0,0,0,0|4,0,0]=4 82 B9R1.15 OC1=CC=CC=C1OC AK114448 [0,0,0,0,0,0|3,1,0]=4 83 B9R1.15 OC1=CC=CN=C1C#N AK-28336 [0,0,0,0,0,0|4,0,0]=4 84 B9R1.15 OC1=CC=CN=C1CN AK-82086 [0,0,0,0,0,0|4,0,0]=4 85 B9R1.15 OC1=CC=CN=C1OC AK261041 [0,0,0,0,0,0|2,1,0]=3 86 B9R1.15 OC1=NC=CC=C1C#C AK-78040 [0,0,0,0,0,0|3,0,1]=4 87 B9R1.15 OCC1=C(Cl)N=CC=N1 AK-39229 [0,0,0,0,0,0|3,0,0]=3 88 B9R1.15 OCC1=CC=CN=C1Cl AK-23619 [0,0,0,0,0,0|4,0,0]=4 89 B9R1.15 OCC1=CC=CN=C1F AK-33110 [0,0,0,0,0,0|4,0,0]=4 90 B9R1.15 OCC1=NC=CC=C1Cl AK133056 [0,0,0,0,0,0|4,0,0]=4 91 B8R1.2 BrCC1=CC=CN=C1 AK-44682 [1,0,0,0,0,0|3,0,0]=4 92 B8R1.2 BrCC1=NC=CC=C1 AK-78919 [1,0,0,0,0,0|3,0,0]=4 93 B8R1.2 BrCC1=NC=CN=C1 AK143784 [1,0,0,0,0,0|2,0,0]=3 94 B8R1.2 C#CC1=CC=CN=C1 AK-39524 [1,0,0,0,0,0|2,0,1]=4 95 B8R1.2 C#CC1=NC=CN=C1 AK185335 [1,0,0,0,0,0|1,0,1]=3 96 B8R1.2 C1=C(N=CC=C1)C#C AK-39840 [1,0,0,0,0,0|2,0,1]=4 97 B8R1.2 C1=C(N=CC=N1)CN AK-23965 [1,0,0,0,0,0|2,0,0]=3 98 B8R1.2 C1=NC=C(N=C1)CO AK-45812 [1,0,0,0,0,0|2,0,0]=3 99 B8R1.2 CNC1=CC=CN=C1 AK-72893 [1,0,0,0,0,0|2,0,0]=3 100 B8R1.2 CNC1=CC=NN=C1 AK545083 [1,0,0,0,0,0|3,0,0]=4 101 B8R1.2 CNC1=NC=CC=N1 AK-27708 [1,0,0,0,0,0|3,0,0]=4 102 B8R1.2 COC1=CC=CN=C1 AK-76565 [1,0,0,0,0,0|1,1,0]=3 103 B8R1.2 COC1=CC=CN=N1 AK-28954 [1,0,0,0,0,0|2,1,0]=4 104 B8R1.2 COC1=CN=CN=C1 AK-31068 [1,0,0,0,0,0|2,1,0]=4 105 B8R1.2 CSC1=NC=CN=C1 AK-41535 [1,0,0,0,0,0|0,0,0]=1 106 B8R1.2 CSC1=NC=CN=N1 AK-48101 [1,0,0,0,0,0|1,0,0]=2 107 B8R1.2 N#CC1=CN=CC=C1 AK-76753 [1,0,0,0,0,0|3,0,0]=4 108 B8R1.2 N#CC1=NC=CC=C1 AK-76752 [1,0,0,0,0,0|3,0,0]=4 109 B8R1.2 N#CC1=NC=CN=C1 AK-47995 [1,0,0,0,0,0|2,0,0]=3 110 B8R1.2 NCC1=NC=CN=C1 AK-50813 [1,0,0,0,0,0|2,0,0]=3 111 B8R1.2 NNC1=CC=CN=C1 AK-40869 [1,0,0,0,0,0|3,0,0]=4 112 B8R1.2 NNC1=CC=CN=C1 AK-75799 [1,0,0,0,0,0|3,0,0]=4 113 B8R1.2 NNC1=NC=CC=C1 AK-26026 [1,0,0,0,0,0|3,0,0]=4 114 B8R1.2 NNC1=NC=CN=C1 AK-44383 [1,0,0,0,0,0|2,0,0]=3 115 B8R1.2 OCC1=CC=CN=C1 AK-46173 [1,0,0,0,0,0|3,0,0]=4 116 B8R1.2 OCC1=NC=CC=C1 AK-53905 [1,0,0,0,0,0|3,0,0]=4 117 B8R1.5 BrC1=CC=CN=C1C AK-25896 [1,0,0,0,0,0|2,0,0]=3 118 B8R1.5 BrC1=CC=CN=C1N AK-25389 [1,0,0,0,0,0|3,0,0]=4 119 B8R1.5 BrC1=CN=CN=C1C AK-24717 [1,0,0,0,0,0|3,0,0]=4 120 B8R1.5 BrC1=NC=CC=C1Cl AK-26478 [1,0,0,0,0,0|3,0,0]=4 121 B8R1.5 BrC1=NC=CN=C1Br AK-26790 [1,0,0,0,0,0|2,0,0]=3 122 B8R1.5 C1=C(C(=NC=C1)Br)O AK-30294 [1,0,0,0,0,0|2,1,0]=4 123 B8R1.5 C1=C(C(=NC=C1)Cl)Cl AK-39485 [1,0,0,0,0,0|3,0,0]=4 124 B8R1.5 C1=C(C(=NC=C1)Cl)O AK-30100 [1,0,0,0,0,0|2,1,0]=4 125 B8R1.5 C1=C(C(=NC=C1)F)C AK-34277 [1,0,0,0,0,0|2,0,0]=3 126 B8R1.5 C1=CC=NC(=C1Br)Br AK-32432 [1,0,0,0,0,0|3,0,0]=4 127 B8R1.5 C1=CC=NC(=C1Br)Cl AK-27263 [1,0,0,0,0,0|3,0,0]=4 128 B8R1.5 C1=CC=NC(=C1C)Cl AK-25527 [1,0,0,0,0,0|2,0,0]=3 129 B8R1.5 C1=CC=NC(=C1I)Cl AK-26334 [1,0,0,0,0,0|3,0,0]=4 130 B8R1.5 C1=CC=NC(=C1O)I AK-25929 [1,0,0,0,0,0|2,1,0]=4 131 B8R1.5 C1=CC=NC(=C1O)N AK-32377 [1,0,0,0,0,0|2,1,0]=4 132 B8R1.5 C1=CN=C(C(=C1)Cl)F AK-33350 [1,0,0,0,0,0|3,0,0]=4 133 B8R1.5 C1=CN=C(C(=C1)I)N AK-39162 [1,0,0,0,0,0|3,0,0]=4 134 B8R1.5 C1=CN=C(C(=N1)C)Cl AK-28587 [1,0,0,0,0,0|1,0,0]=2 135 B8R1.5 C1=CN=C(C(=N1)Cl)N AK-21993 [1,0,0,0,0,0|2,0,0]=3 136 B8R1.5 C1=CN=C(N)C(=N1)N AK-23932 [1,0,0,0,0,0|2,0,0]=3 137 B8R1.5 C1=NC(=C(C=N1)N)C AK-28385 [1,0,0,0,0,0|3,0,0]=4 138 B8R1.5 CC1=C(Br)N=CC=N1 AK-31997 [1,0,0,0,0,0|1,0,0]=2 139 B8R1.5 CC1=C(Cl)N=NC=C1 AK-36098 [1,0,0,0,0,0|3,0,0]=4 140 B8R1.5 CC1=C(I)C=NC=N1 AK-30883 [1,0,0,0,0,0|3,0,0]=4 141 B8R1.5 CC1=CC=CC=C1I AK-77011 [1,0,0,0,0,0|3,0,0]=4 142 B8R1.5 CC1=CC=CN=C1Br AK-23603 [1,0,0,0,0,0|2,0,0]=3 143 B8R1.5 CC1=CC=CN=C1O AK-75629 [1,0,0,0,0,0|1,1,0]=3 144 B8R1.5 CC1=CC=CNC1=O AK-32442 [1,0,0,0,0,0|1,1,1]=4 145 B8R1.5 CC1=CN=CN=C1O AK-27176 [1,0,0,0,0,0|2,1,0]=4 146 B8R1.5 CC1=NC=CC=C1F AK-33505 [1,0,0,0,0,0|2,0,0]=3 147 B8R1.5 ClC1=CC=CN=C1I AK-36351 [1,0,0,0,0,0|3,0,0]=4 148 B8R1.5 ClC1=NC=CC=C1N AK-30071 [1,0,0,0,0,0|3,0,0]=4 149 B8R1.5 ClC1=NC=NC=C1C AK-25152 [1,0,0,0,0,0|3,0,0]=4 150 B8R1.5 FC1=CC=CN=C1O AK-28818 [1,0,0,0,0,0|2,1,0]=4 151 B8R1.5 FC1=NC=CC=C1Br AK-25851 [1,0,0,0,0,0|3,0,0]=4 152 B8R1.5 FC1=NC=CC=C1O AK-24443 [1,0,0,0,0,0|2,1,0]=4 153 B8R1.5 IC1=CC=CN=C1Br AK-61736 [1,0,0,0,0,0|3,0,0]=4 154 B8R1.5 IC1=CC=CN=C1F AK-23632 [1,0,0,0,0,0|3,0,0]=4 155 B8R1.5 IC1=NC=CC=C1F AK140084 [1,0,0,0,0,0|3,0,0]=4 156 B8R1.5 NC1=CC=CN=C1Br AK-25918 [1,0,0,0,0,0|3,0,0]=4 157 B8R1.5 NC1=CC=CN=C1C AK-28661 [1,0,0,0,0,0|2,0,0]=3 158 B8R1.5 NC1=CC=CN=C1F AK-28850 [1,0,0,0,0,0|3,0,0]=4 159 B8R1.5 NC1=CC=CN=C1I AK-25585 [1,0,0,0,0,0|3,0,0]=4 160 B8R1.5 NC1=NC=CC=C1Cl AK-23510 [1,0,0,0,0,0|3,0,0]=4 161 B8R1.5 NC1=NC=CC=C1F AK-23511 [1,0,0,0,0,0|3,0,0]=4 162 B8R1.5 NC1=NC=CN=C1Br AK-24228 [1,0,0,0,0,0|2,0,0]=3 163 B8R1.5 NC1=NC=CN=C1C AK-23583 [1,0,0,0,0,0|1,0,0]=2 164 B8R1.5 NC1=NC=CN=C1I AK-24254 [1,0,0,0,0,0|2,0,0]=3 165 B8R1.5 NC1=NC=NC=C1C AK-27177 [1,0,0,0,0,0|3,0,0]=4 166 B8R1.5 O=C1C(C)=NC=CN1 AK-24748 [1,0,0,0,0,0|0,1,1]=3 167 B8R1.5 O=C1C(N)=NC=CN1 AK-23582 [1,0,0,0,0,0|1,1,1]=4 168 B8R1.5 OC1=C(O)N=CC=C1 AK-46383 [1,0,0,0,0,0|2,1,0]=4 169 B8R1.5 OC1=CC=CN=C1C AK-29777 [1,0,0,0,0,0|1,1,0]=3 170 B8R1.5 OC1=NC=CC=C1Cl AK-27733 [1,0,0,0,0,0|2,1,0]=4 171 B10R1.2 BrC1=CC=CC(=C1C)OC AK-34653 [0,1,0,0,0,0|2,1,0]=4 172 B10R1.2 CC1=C(Br)C(OC)=NC=C1 AK-92097 [0,1,0,0,0,0|2,1,0]=4 173 B10R1.2 CC1=C(Br)C=CN=C1OC AK-68344 [0,1,0,0,0,0|1,1,0]=3 174 B10R1.2 CC1=C(C)C(OC)=CC=C1 AK117499 [0,1,0,0,0,0|2,1,0]=4 175 B10R1.2 CC1=C(Cl)N=CN=C1NC AK670608 [0,1,0,0,0,0|3,0,0]=4 176 B10R1.2 CC1=C(N)C(OC)=NC=C1 AK-39603 [0,1,0,0,0,0|2,1,0]=4 177 B10R1.2 CC1=C(OC)N=CN=C1Cl AK127062 [0,1,0,0,0,0|2,1,0]=4 178 B10R1.2 COC1=CC=CC(=C1C)N AK-25555 [0,1,0,0,0,0|2,1,0]=4 179 B10R1.4 CC1=CC=CC=C1CCO AK117334 [0,1,0,0,0,0|3,0,0]=4 180 B10R1.4 CC1=CC=CC=C1CNC AK-89673 [0,1,0,0,0,0|3,0,0]=4 181 B10R1.4 CCOC1=NC=CC=C1Br AK-45982 [0,1,0,0,0,0|2,1,0]=4 182 B10R1.4 COCC1=NC=CN=C1Cl AK-52707 [0,1,0,0,0,0|1,1,0]=3 183 B10R1.4 NC1=NC=CN=C1NCC AK-23940 [0,1,0,0,0,0|2,0,0]=3 184 B10R1.4 NC1=NC=CN=C1OCC AK-23934 [0,1,0,0,0,0|1,1,0]=3 185 B10R1.20 CCC1=C(OC)N=CC=N1 AK-61723 [0,1,0,0,0,0|0,1,0]=2 186 B10R1.20 CNC1=NC=CC=C1CO AK-34687 [0,1,0,0,0,0|2,0,0]=3 187 B10R1.20 COC1=CC=CC=C1OC AK-48587 [0,1,0,0,0,0|2,1,0]=4 188 B10R1.20 COC1=CC=CN=C1OC AK-43966 [0,1,0,0,0,0|1,1,0]=3 189 B10R1.20 COC1=CN=CN=C1OC AK340266 [0,1,0,0,0,0|2,1,0]=4 190 B10R1.20 COC1=NC=CC=C1CBr AK-99893 [0,1,0,0,0,0|1,1,0]=3 191 B10R1.20 COC1=NC=CC=C1CN AK133079 [0,1,0,0,0,0|1,1,0]=3 192 B10R1.20 ClCC1=NC=CN=C1CCl AK120649 [0,1,0,0,0,0|2,0,0]=3 193 B10R1.20 N#CC1=NC=CC=C1CBr AK113901 [0,1,0,0,0,0|3,0,0]=4 194 B10R1.20 NCC1=CC=CN=C1OC AK-49721 [0,1,0,0,0,0|1,1,0]=3 195 B10R1.20 NCC1=NC=CC=C1OC AK142747 [0,1,0,0,0,0|1,1,0]=3 196 B10R1.20 O=CC1=C(NC)N=CC=C1 AK106308 [0,1,0,0,0,0|2,0,1]=4 197 B10R1.20 O=CC1=C(OC)N=CC=C1 AK-36180 [0,1,0,0,0,0|1,1,1]=4 198 B10R1.20 OCC1=CC=CC=C1CC AK153193 [0,1,0,0,0,0|3,0,0]=4 199 B10R1.20 OCC1=CC=CN=C1OC AK-46985 [0,1,0,0,0,0|1,1,0]=3 200 B10R1.20 OCC1=NC=CC=C1OC AK-35452 [0,1,0,0,0,0|1,1,0]=3 201 B10R1.25 BrC1=CC(=C(C=C1)OC)C AK-54791 [0,1,0,0,0,0|2,1,0]=4 202 B10R1.25 BrC1=CC(=CN=C1OC)Br AK-28772 [0,1,0,0,0,0|2,1,0]=4 203 B10R1.25 BrC1=CN=C(C(=C1)Cl)OC AK-36542 [0,1,0,0,0,0|2,1,0]=4 204 B10R1.25 CC1=CC(Br)=CN=C1OC AK-39075 [0,1,0,0,0,0|1,1,0]=3 205 B10R1.25 CC1=CC(Cl)=NN=C1OC AK145360 [0,1,0,0,0,0|2,1,0]=4 206 B10R1.25 CC1=CC(I)=CC=C1OC AK135933 [0,1,0,0,0,0|2,1,0]=4 207 B10R1.25 CC1=CC=C(OC)C(Br)=N1 AK-59810 [0,1,0,0,0,0|2,1,0]=4 208 B10R1.25 CC1=CC=C(OC)C(Cl)=N1 AK150744 [0,1,0,0,0,0|2,1,0]=4 209 B10R1.25 CC1=CN=C(CBr)C(C)=C1 AK147252 [0,1,0,0,0,0|3,0,0]=4 210 B10R1.25 CC1=CN=C(CCl)C(C)=C1 AK103627 [0,1,0,0,0,0|3,0,0]=4 211 B10R1.25 CC1=CN=C(CO)C(C)=C1 AK102022 [0,1,0,0,0,0|3,0,0]=4 212 B10R1.25 CC1=CN=C(OC)C(Br)=C1 AK-40365 [0,1,0,0,0,0|2,1,0]=4 213 B10R1.25 CC1=CN=C(OC)C(C)=N1 AK-55018 [0,1,0,0,0,0|0,1,0]=2 214 B10R1.25 CC1=CN=C(OC)C(Cl)=C1 AK133238 [0,1,0,0,0,0|2,1,0]=4 215 B10R1.25 CC1=NC(Cl)=NC=C1OC AK167435 [0,1,0,0,0,0|2,1,0]=4 216 B10R1.25 CCC1=NC=C(Cl)N=C1Cl AK167678 [0,1,0,0,0,0|2,0,0]=3 217 B10R1.25 COC1=C(Br)C=C(F)C=N1 AK-39228 [0,1,0,0,0,0|2,1,0]=4 218 B10R1.25 COC1=C(F)C=C(N)C=N1 AK-26405 [0,1,0,0,0,0|2,1,0]=4 219 B10R1.25 COC1=CC=C(Br)N=C1Br AK126934 [0,1,0,0,0,0|2,1,0]=4 220 B10R1.25 COC1=CC=C(Br)N=C1N AK-55165 [0,1,0,0,0,0|2,1,0]=4 221 B10R1.25 COC1=CC=C(I)N=C1Br AK155410 [0,1,0,0,0,0|2,1,0]=4 222 B10R1.25 COC1=NC=C(Br)C=C1F AK-33037 [0,1,0,0,0,0|2,1,0]=4 223 B10R1.25 COC1=NC=C(Br)C=C1I AK112522 [0,1,0,0,0,0|2,1,0]=4 224 B10R1.25 COC1=NC=C(Cl)C=C1Br AK-30230 [0,1,0,0,0,0|2,1,0]=4 225 B10R1.25 COC1=NC=C(Cl)C=C1Cl AK104164 [0,1,0,0,0,0|2,1,0]=4 226 B10R1.25 COC1=NC=C(F)C=C1N AK100186 [0,1,0,0,0,0|2,1,0]=4 227 B10R1.25 N#CC1=C(C)N=C(F)C=C1 AK-37414 [0,1,0,0,0,0|3,0,0]=4 228 B10R1.25 N#CC1=NC=C(Br)C=C1C AK-39491 [0,1,0,0,0,0|3,0,0]=4 229 B10R1.25 N#CC1=NC=C(Cl)C=C1C AK-76922 [0,1,0,0,0,0|3,0,0]=4 230 B10R1.25 N#CC1=NC=C(Cl)N=C1Cl AK-31179 [0,1,0,0,0,0|3,0,0]=4 231 B10R1.25 NC1=CC(Br)=C(OC)N=C1 AK-35515 [0,1,0,0,0,0|2,1,0]=4 232 B10R1.25 NC1=CC(Br)=CN=C1OC AK-27997 [0,1,0,0,0,0|2,1,0]=4 233 B10R1.25 NC1=CC(C)=C(OC)N=C1 AK-44782 [0,1,0,0,0,0|1,1,0]=3 234 B10R1.25 NC1=CC(Cl)=C(OC)N=C1 AK123524 [0,1,0,0,0,0|2,1,0]=4 235 B10R1.25 NC1=CC=C(OC)C(C)=C1 AK-33185 [0,1,0,0,0,0|2,1,0]=4 236 B10R1.25 OC1=CC(Br)=C(OC)N=C1 AK137299 [0,1,0,0,0,0|2,1,0]=4 237 B10R1.25 OCC1=CC=C(F)N=C1C AK117653 [0,1,0,0,0,0|3,0,0]=4 238 B10R1.30 BrC1=CN=C(C(=C1)OC)N AK-41580 [0,1,0,0,0,0|2,1,0]=4 239 B10R1.30 BrC1=CN=C(C(=N1)OC)N AK-22068 [0,1,0,0,0,0|1,1,0]=3 240 B10R1.30 C1=C(N)C=CC(=C1OC)C AK-33584 [0,1,0,0,0,0|2,1,0]=4 241 B10R1.30 CC1=CC=C(Br)C=C1OC AK-65070 [0,1,0,0,0,0|2,1,0]=4 242 B10R1.30 CC1=CC=C(F)C(OC)=N1 AK-34807 [0,1,0,0,0,0|2,1,0]=4 243 B10R1.30 CC1=CC=C(N)C(OC)=N1 AK-28935 [0,1,0,0,0,0|2,1,0]=4 244 B10R1.30 CC1=CC=C(O)C(CC)=N1 AK-28571 [0,1,0,0,0,0|3,0,0]=4 245 B10R1.30 CC1=NC(C#N)=C(C)N=C1 AK-80653 [0,1,0,0,0,0|2,0,0]=3 246 B10R1.30 CCC1=NC(C)=CC=C1O AK-57887 [0,1,0,0,0,0|3,0,0]=4 247 B10R1.30 COC1=C(Br)C=CC(N)=N1 AK104900 [0,1,0,0,0,0|2,1,0]=4 248 B10R1.30 COC1=C(Br)N=CC(N)=C1 AK-51183 [0,1,0,0,0,0|2,1,0]=4 249 B10R1.30 COC1=C(C)C=CC(C)=C1 AK-60854 [0,1,0,0,0,0|2,1,0]=4 250 B10R1.30 COC1=C(Cl)N=CC(Br)=N1 AK103765 [0,1,0,0,0,0|1,1,0]=3 251 B10R1.30 COC1=CC(Br)=CN=C1C AK110292 [0,1,0,0,0,0|1,1,0]=3 252 B10R1.30 COC1=CC(Br)=CN=C1Cl AK-34524 [0,1,0,0,0,0|2,1,0]=4 253 B10R1.30 COC1=NC(Br)=CN=C1I AK-24222 [0,1,0,0,0,0|1,1,0]=3 254 B10R1.30 COC1=NC(C)=CC=C1Br AK-87081 [0,1,0,0,0,0|2,1,0]=4 255 B10R1.30 COC1=NC(Cl)=CC=C1Br AK-91433 [0,1,0,0,0,0|2,1,0]=4 256 B10R1.30 CSC1=NC(Cl)=NC=C1Br AK-40213 [0,1,0,0,0,0|3,0,0]=4 257 B10R1.30 ClC1=NC(C#N)=C(Cl)N=C1 AK100229 [0,1,0,0,0,0|3,0,0]=4 258 B10R1.30 N#CC1=C(C)N=CC(Cl)=C1 AK100889 [0,1,0,0,0,0|3,0,0]=4 259 B10R1.30 N#CC1=NC(Br)=CN=C1N AK-22018 [0,1,0,0,0,0|3,0,0]=4 260 B10R1.30 N#CC1=NC(Cl)=CC=C1C AK-68845 [0,1,0,0,0,0|3,0,0]=4 261 B10R1.30 NC1=CC(OC)=C(Cl)N=C1 AK-48874 [0,1,0,0,0,0|2,1,0]=4 262 B10R1.30 NC1=CC=C(Br)N=C1OC AK-48998 [0,1,0,0,0,0|2,1,0]=4 263 B10R1.30 NC1=NC=C(C)N=C1OC AK-93223 [0,1,0,0,0,0|1,1,0]=3 264 B10R1.30 NC1=NC=C(N=C1C#C)Br AK-24394 [0,1,0,0,0,0|2,0,1]=4 265 B10R1.30 NC1=NC=C(N=C1OC)Cl AK-26837 [0,1,0,0,0,0|1,1,0]=3 266 B10R1.30 O=C1C(OC)=NC(Br)=CN1 AK165564 [0,1,0,0,0,0|1,1,1]=4 267 B10R1.30 O=CC1=C(C)N=CC(F)=C1 AK146841 [0,1,0,0,0,0|3,0,0]=4 268 B10R1.30 O=CC1=NC(Cl)=CN=C1Cl AK134684 [0,1,0,0,0,0|3,0,0]=4 269 B10R1.30 O=CC1=NC(Cl)=CN=C1N AK136126 [0,1,0,0,0,0|3,0,0]=4 270 B10R1.30 OC1=CC=C(C)N=C1CC AK-41005 [0,1,0,0,0,0|3,0,0]=4 271 B10R1.61 BrC1=NC=CN=C1C(=O)O AK-30736 [0,1,0,0,0,0|3,0,0]=4 272 B10R1.61 C1=CC=NC(=C1C)C(O)=O AK-26613 [0,1,0,0,0,0|3,0,0]=4 273 B10R1.61 C1=CN=C(C(=N1)C(O)=O)N AK-16902 [0,1,0,0,0,0|3,0,0]=4 274 B10R1.61 CC(=O)C1=C(C)N=CC=N1 AK-89662 [0,1,0,0,0,0|1,0,0]=2 275 B10R1.61 CC(=O)C1=CC=CN=C1F AK-36408 [0,1,0,0,0,0|3,0,0]=4 276 B10R1.61 CC(=O)C1=CC=CN=C1N AK-61895 [0,1,0,0,0,0|3,0,0]=4 277 B10R1.61 CC(=O)C1=NC=CC=C1F AK-36671 [0,1,0,0,0,0|3,0,0]=4 278 B10R1.61 CC(C1=CC=CC=C1C)=O AK-76969 [0,1,0,0,0,0|3,0,0]=4 279 B10R1.61 CC(C1=CC=CN=C1C)=O AK-60286 [0,1,0,0,0,0|2,0,0]=3 280 B10R1.61 CC(C1=NC=CC=C1Br)=O AK-91392 [0,1,0,0,0,0|3,0,0]=4 281 B10R1.61 CC(C1=NC=CC=C1Cl)=O AK128527 [0,1,0,0,0,0|3,0,0]=4 282 B10R1.61 CC(C1=NC=CC=C1O)=O AK-57786 [0,1,0,0,0,0|3,0,0]=4 283 B10R1.61 CC(N)C1=NC=CC=C1C AK670791 [0,1,0,0,0,0|2,0,0]=3 284 B10R1.61 CC(O)C1=CC=CN=C1Cl AK118779 [0,1,0,0,0,0|3,0,0]=4 285 B10R1.61 CC1=C(C(=O)N)C=CC=N1 AK-39636 [0,1,0,0,0,0|3,0,0]=4 286 B10R1.61 CC1=C(C(=O)O)C=CC=N1 AK-25768 [0,1,0,0,0,0|3,0,0]=4 287 B10R1.61 CC1=NC=CC=C1B(O)O AK142095 [0,1,0,0,0,0|3,0,0]=4 288 B10R1.61 CC1=NC=CC=C1N(=O)=O AK-26710 [0,1,0,0,0,0|3,0,0]=4 289 B10R1.61 CC1=NC=CN=C1C(=O)O AK-25946 [0,1,0,0,0,0|2,0,0]=3 290 B10R1.61 CN(C)C1=NC=CN=C1Cl AK124994 [0,1,0,0,0,0|2,0,0]=3 291 B10R1.61 C[C@@H](N)C1=CC=CC=C1C AK-45079 [0,1,0,0,0,0|3,0,0]=4 292 B10R1.61 C[C@H](N)C1=CC=CC=C1C AK162902 [0,1,0,0,0,0|3,0,0]=4 293 B10R1.61 ClC1=NC=CN=C1C(=O)O AK-24100 [0,1,0,0,0,0|3,0,0]=4 294 B10R1.61 N=C(N)C1=NC=CC=C1C AK130359 [0,1,0,0,0,0|3,0,0]=4 295 B10R1.61 NC1=NC=CN=C1N(C)C AK-23941 [0,1,0,0,0,0|2,0,0]=3 296 B10R1.61 O=C(C1=NC=CN=C1Cl)N AK-80835 [0,1,0,0,0,0|3,0,0]=4 297 B10R1.61 O=C(C1=NC=CN=C1I)O AK-30598 [0,1,0,0,0,0|3,0,0]=4 298 B10R1.61 O=C(C1=NC=CN=C1O)N AK-39215 [0,1,0,0,0,0|3,0,0]=4 299 B10R1.61 O=C(N)C1=NC=CC=C1C AK-48603 [0,1,0,0,0,0|3,0,0]=4 300 B10R1.61 O=[N+](C1=CC=CN=C1C)[O-] AK-23642 [0,1,0,0,0,0|3,0,0]=4 301 B10R1.61 O=[N+](C1=NC=CN=C1Cl)[O-] AK-27354 [0,1,0,0,0,0|3,0,0]=4 302 B10R1.61 OB(C1=NC=CC=C1C)O AK-36898 [0,1,0,0,0,0|3,0,0]=4 303 B10R1.245 CC1=NC=CC(Cl)=C1OC AK135384 [0,1,0,0,0,0|1,1,0]=3 304 B10R2.7 C12=C(NCC1)C=CC=C2 AK-49832 [0,0,0,1,0,0|3,0,0]=4 305 B10R2.7 C12=NC=CC=C1CCN2 AK-23969 [0,0,0,1,0,0|2,0,0]=3 306 B10R2.7 C12=NC=CC=C1CNC2 AK-27514 [0,0,0,1,0,0|3,0,0]=4 307 B10R2.7 C12=NC=CN=C1N=CN2 AK113549 [0,0,0,1,0,0|2,0,1]=4 308 B10R2.7 C1=CC=CC2=C1CCO2 AK-35322 [0,0,0,1,0,0|2,1,0]=4 309 B10R2.7 N1=C2C=CSC2=NC=C1 AK-30775 [0,0,0,1,0,0|0,0,2]=3 310 B10R2.7 S1C=CC2=C1C=CC=N2 AK-55220 [0,0,0,1,0,0|1,0,2]=4 311 B10R2.7 S1C=CC2=C1N=CC=C2 AK-30780 [0,0,0,1,0,0|1,0,2]=4 312 B8R1.11 C1=CN=C(C=O)[N]1C AK-38404 [0,0,0,0,1,0|3,0,0]=4 313 B8R1.11 C=CC1=C(C)N=CS1 AK306978 [0,0,0,0,1,0|2,0,1]=4 314 B8R1.11 CC1=C(C=O)N=CS1 AK-74018 [0,0,0,0,1,0|3,0,0]=4 315 B8R1.11 CC1=C(SC=N1)C=O AK-36462 [0,0,0,0,1,0|3,0,0]=4 316 B8R1.11 CC1=NSC=C1C#N AK-82179 [0,0,0,0,1,0|3,0,0]=4 317 B8R1.11 CC1=N[NH]C=C1C=O AK-27719 [0,0,0,0,1,0|3,0,0]=4 318 B8R1.11 CCN1N=CC=C1N AK-57067 [0,0,0,0,1,0|3,0,0]=4 319 B8R1.11 CN1C=CN=C1CCl AK-45446 [0,0,0,0,1,0|3,0,0]=4 320 B8R1.11 CN1C=CN=C1CN AK-38431 [0,0,0,0,1,0|3,0,0]=4 321 B8R1.11 CN1CCN=C1SC AK-31537 [0,0,0,0,1,0|1,0,2]=4 322 B8R1.11 CSC1=C(C)OC=C1 AK307519 [0,0,0,0,1,0|1,0,0]=2 323 B8R1.11 CSC1=NC=CN1C AK175602 [0,0,0,0,1,0|1,0,0]=2 324 B8R1.11 C[N]1C(=CC=N1)C=O AK-34470 [0,0,0,0,1,0|3,0,0]=4 325 B8R1.11 N#CC1=CNN=C1C AK-76070 [0,0,0,0,1,0|3,0,0]=4 326 B8R1.11 NC1=NNC=C1CC AK-75653 [0,0,0,0,1,0|3,0,0]=4 327 B8R1.11 NCC1=CC=NN1C AK-76608 [0,0,0,0,1,0|3,0,0]=4 328 B8R1.11 O=CC1=C(C)NC=N1 AK117462 [0,0,0,0,1,0|2,0,1]=4 329 B8R1.11 OCC1=C(C)N=CN1 AK-34958 [0,0,0,0,1,0|2,0,1]=4 330 B8R1.11 OCC1=CC=NN1C AK-65816 [0,0,0,0,1,0|3,0,0]=4 331 B8R1.11 OCC1=NC=CN1C AK-23555 [0,0,0,0,1,0|3,0,0]=4 332 B7R1.3 BrC1=NC=CN=C1 AK-21911 [2,0,0,0,0,0|1,0,0]=3 333 B7R1.3 C1=C(C)C=NC=N1 AK-30562 [2,0,0,0,0,0|2,0,0]=4 334 B7R1.3 C1=C(C)C=NN=C1 AK-30760 [2,0,0,0,0,0|2,0,0]=4 335 B7R1.3 CC1=CN=CC=N1 AK-88672 [2,0,0,0,0,0|0,0,0]=2 336 B7R1.3 CC1=NC=NC=C1 AK-34763 [2,0,0,0,0,0|2,0,0]=4 337 B7R1.3 IC1=CC=CN=C1 AK-46371 [2,0,0,0,0,0|2,0,0]=4 338 B7R1.3 IC1=CN=CC=N1 AK-23638 [2,0,0,0,0,0|1,0,0]=3 339 B7R1.3 IC1=NC=CC=C1 AK-43060 [2,0,0,0,0,0|2,0,0]=4 340 B7R1.3 NC1=NC=CN=C1 AK-24896 [2,0,0,0,0,0|1,0,0]=3 341 B7R1.3 NC1=NC=CN=N1 AK-39292 [2,0,0,0,0,0|2,0,0]=4 342 B7R1.3 O=C1NC=CN=C1 AK-24500 [2,0,0,0,0,0|0,1,1]=4 343 B7R1.3 OC1=CC=CN=C1 AK-44238 [2,0,0,0,0,0|1,1,0]=4 344 B9R1.1 BrC1=CN=C(C=C1)CC AK-34965 [1,1,0,0,0,0|2,0,0]=4 345 B9R1.1 BrC1=CN=C(C=C1)NC AK-46585 [1,1,0,0,0,0|2,0,0]=4 346 B9R1.1 BrC1=CN=C(N=C1)SC AK-25120 [1,1,0,0,0,0|2,0,0]=4 347 B9R1.1 BrC1=NC=C(C=C1)OC AK-25274 [1,1,0,0,0,0|1,1,0]=4 348 B9R1.1 BrC1=NC=C(N=C1)C#N AK-24125 [1,1,0,0,0,0|2,0,0]=4 349 B9R1.1 C1=CC(=CN=C1OC)Br AK-32435 [1,1,0,0,0,0|1,1,0]=4 350 B9R1.1 C1=CC(=CN=C1OC)N AK-24754 [1,1,0,0,0,0|1,1,0]=4 351 B9R1.1 CC1=CN=C(C=N1)CO AK-24727 [1,1,0,0,0,0|2,0,0]=4 352 B9R1.1 CC1=CN=C(CCl)C=N1 AK138019 [1,1,0,0,0,0|2,0,0]=4 353 B9R1.1 CC1=CN=C(OC)C=C1 AK-58301 [1,1,0,0,0,0|1,1,0]=4 354 B9R1.1 CCC1=CN=C(C=N1)C AK-58106 [1,1,0,0,0,0|1,0,0]=3 355 B9R1.1 CCC1=CN=C(Cl)C=C1 AK-48582 [1,1,0,0,0,0|2,0,0]=4 356 B9R1.1 CCC1=NC=C(Cl)C=C1 AK134672 [1,1,0,0,0,0|2,0,0]=4 357 B9R1.1 CNC1=NC=C(Br)N=C1 AK136913 [1,1,0,0,0,0|1,0,0]=3 358 B9R1.1 CNC1=NC=C(Cl)C=C1 AK123580 [1,1,0,0,0,0|2,0,0]=4 359 B9R1.1 COC1=CN=C(Br)C=N1 AK-24261 [1,1,0,0,0,0|0,1,0]=3 360 B9R1.1 COC1=CN=C(Cl)C=C1 AK-33219 [1,1,0,0,0,0|1,1,0]=4 361 B9R1.1 COC1=CN=C(F)C=C1 AK-61561 [1,1,0,0,0,0|1,1,0]=4 362 B9R1.1 COC1=NC=C(Cl)C=C1 AK-44270 [1,1,0,0,0,0|1,1,0]=4 363 B9R1.1 COC1=NC=C(Cl)N=C1 AK-64586 [1,1,0,0,0,0|0,1,0]=3 364 B9R1.1 COC1=NC=C(F)C=C1 AK-27023 [1,1,0,0,0,0|1,1,0]=4 365 B9R1.1 COC1=NC=C(I)C=C1 AK-58302 [1,1,0,0,0,0|1,1,0]=4 366 B9R1.1 CSC1=CN=C(Br)C=N1 AK-47704 [1,1,0,0,0,0|0,0,0]=2 367 B9R1.1 CSC1=CN=C(Cl)N=C1 AK147845 [1,1,0,0,0,0|2,0,0]=4 368 B9R1.1 CSC1=CN=C(N)C=C1 AK-40039 [1,1,0,0,0,0|1,0,0]=3 369 B9R1.1 ClC1=NC=C(C=O)N=C1 AK-87373 [1,1,0,0,0,0|2,0,0]=4 370 B9R1.1 ClC1=NC=C(N=C1)C#N AK-24124 [1,1,0,0,0,0|2,0,0]=4 371 B9R1.1 N#CC1=NC=C(N)N=C1 AK-21935 [1,1,0,0,0,0|2,0,0]=4 372 B9R1.1 NC1=CC=C(CC)N=C1 AK-78651 [1,1,0,0,0,0|2,0,0]=4 373 B9R1.1 NC1=CN=C(NC)C=C1 AK-75542 [1,1,0,0,0,0|2,0,0]=4 374 B9R1.1 NC1=CN=C(NC)C=C1 AK141591 [1,1,0,0,0,0|2,0,0]=4 375 B9R1.1 NC1=NC=C(C=C1)OC AK-27987 [1,1,0,0,0,0|1,1,0]=4 376 B9R1.1 NC1=NC=C(N=C1)CC AK-26631 [1,1,0,0,0,0|1,0,0]=3 377 B9R1.1 NC1=NC=C(N=C1)OC AK-24108 [1,1,0,0,0,0|0,1,0]=3 378 B9R1.1 O=CC1=NC=C(C)N=C1 AK-40389 [1,1,0,0,0,0|2,0,0]=4 379 B9R1.1 OC1=CN=C(C=C1)OC AK-26060 [1,1,0,0,0,0|1,1,0]=4 380 B9R1.1 OCC1=NC=C(Cl)N=C1 AK-43110 [1,1,0,0,0,0|2,0,0]=4 381 B9R1.2 BrC1=CC(=CN=C1)CC AK-54800 [1,1,0,0,0,0|2,0,0]=4 382 B9R1.2 BrC1=NC(=CN=C1)C#N AK-24988 [1,1,0,0,0,0|2,0,0]=4 383 B9R1.2 C1=C(C=CN=C1OC)N AK-28456 [1,1,0,0,0,0|1,1,0]=4 384 B9R1.2 C1=CC=C(N=C1OC)Br AK-25939 [1,1,0,0,0,0|1,1,0]=4 385 B9R1.2 C1=CC=C(N=C1OC)C AK-44038 [1,1,0,0,0,0|1,1,0]=4 386 B9R1.2 C1=CC=C(N=C1OC)Cl AK-25492 [1,1,0,0,0,0|1,1,0]=4 387 B9R1.2 C1=NC=C(C#N)N=C1Cl AK-24986 [1,1,0,0,0,0|2,0,0]=4 388 B9R1.2 CC1=CC(OC)=NC=C1 AK-39493 [1,1,0,0,0,0|1,1,0]=4 389 B9R1.2 CCC1=CC=CC(Br)=N1 AK-65167 [1,1,0,0,0,0|2,0,0]=4 390 B9R1.2 CCC1=NC=CC(Br)=C1 AK129552 [1,1,0,0,0,0|2,0,0]=4 391 B9R1.2 CNC1=NC(Cl)=CC=C1 AK-48574 [1,1,0,0,0,0|2,0,0]=4 392 B9R1.2 CNC1=NC=CC(Br)=C1 AK141589 [1,1,0,0,0,0|2,0,0]=4 393 B9R1.2 COC1=CC=CC(F)=N1 AK130132 [1,1,0,0,0,0|1,1,0]=4 394 B9R1.2 COC1=CN=CC(=C1)O AK-28499 [1,1,0,0,0,0|1,1,0]=4 395 B9R1.2 COC1=CN=CC(Br)=C1 AK-26045 [1,1,0,0,0,0|1,1,0]=4 396 B9R1.2 COC1=CN=CC(I)=N1 AK-94548 [1,1,0,0,0,0|0,1,0]=3 397 B9R1.2 COC1=NC=CC(Br)=C1 AK-47404 [1,1,0,0,0,0|1,1,0]=4 398 B9R1.2 COC1=NC=CC(F)=C1 AK-77188 [1,1,0,0,0,0|1,1,0]=4 399 B9R1.2 COC1=NC=CC(I)=C1 AK-37008 [1,1,0,0,0,0|1,1,0]=4 400 B9R1.2 CSC1=CC(Br)=NC=N1 AK143712 [1,1,0,0,0,0|2,0,0]=4 401 B9R1.2 CSC1=CC=CC(Br)=N1 AK159822 [1,1,0,0,0,0|1,0,0]=3 402 B9R1.2 CSC1=NC(Cl)=NC=C1 AK-29307 [1,1,0,0,0,0|2,0,0]=4 403 B9R1.2 CSC1=NC=CC(Br)=N1 AK-28067 [1,1,0,0,0,0|2,0,0]=4 404 B9R1.2 CSC1=NC=CC(Cl)=N1 AK-29306 [1,1,0,0,0,0|2,0,0]=4 405 B9R1.2 CSC1=NC=CC(N1)=O AK-26630 [1,1,0,0,0,0|2,0,0]=4 406 B9R1.2 ClC1=CC(=NC=C1)OC AK-26290 [1,1,0,0,0,0|1,1,0]=4 407 B9R1.2 ClC1=CC(=NC=C1)SC AK-25786 [1,1,0,0,0,0|1,0,0]=3 408 B9R1.2 ClC1=CN=CC(=N1)NC AK-41779 [1,1,0,0,0,0|1,0,0]=3 409 B9R1.2 ClC1=NC(=CN=C1)OC AK-29172 [1,1,0,0,0,0|0,1,0]=3 410 B9R1.2 ClC1=NC(C=O)=CN=C1 AK-64725 [1,1,0,0,0,0|2,0,0]=4 411 B9R1.2 ClC1=NC=NC(=C1)SC AK-25177 [1,1,0,0,0,0|2,0,0]=4 412 B9R1.2 NC1=CC(=CN=C1)OC AK-27775 [1,1,0,0,0,0|1,1,0]=4 413 B9R1.2 NC1=CC(NC)=NC=C1 AK118733 [1,1,0,0,0,0|2,0,0]=4 414 B9R1.2 NC1=CC=CC(SC)=C1 AK162933 [1,1,0,0,0,0|2,0,0]=4 415 B9R1.2 NC1=NC(=CC=C1)OC AK-27734 [1,1,0,0,0,0|1,1,0]=4 416 B9R1.2 NC1=NC(=CN=C1)C#N AK-24987 [1,1,0,0,0,0|2,0,0]=4 417 B9R1.2 NC1=NC(=CN=C1)OC AK-24224 [1,1,0,0,0,0|0,1,0]=3 418 B9R1.2 NC1=NC(CC)=CC=C1 AK-28992 [1,1,0,0,0,0|2,0,0]=4 419 B9R1.2 NCC1=NC(Cl)=CN=C1 AK130178 [1,1,0,0,0,0|2,0,0]=4 420 B9R1.2 O=C1NC(SC)=NC=C1 AK-43583 [1,1,0,0,0,0|2,0,0]=4 421 B9R1.2 OC1=CC(OC)=NC=C1 AK-68345 [1,1,0,0,0,0|1,1,0]=4 422 B9R1.2 OCC1=CN=CC(Br)=N1 AK-68017 [1,1,0,0,0,0|2,0,0]=4 423 B9R1.2 OCC1=NC(Cl)=CN=C1 AK-98157 [1,1,0,0,0,0|2,0,0]=4 424 B9R1.6 C1=C(C(C)=O)N=CC=C1 AK-53417 [1,1,0,0,0,0|2,0,0]=4 425 B9R1.6 C1=C(N=CC=N1)C(=O)C AK-16901 [1,1,0,0,0,0|1,0,0]=3 426 B9R1.6 C1=NC(=CC=C1)C(C)C AK-46532 [1,1,0,0,0,0|2,0,0]=4 427 B9R1.6 C1=NC=CN=C1C(N)=N AK-24427 [1,1,0,0,0,0|2,0,0]=4 428 B9R1.6 C1=NC=CN=C1C(O)=O AK-47505 [1,1,0,0,0,0|2,0,0]=4 429 B9R1.6 CC(N)C1=CC=CN=C1 AK-35649 [1,1,0,0,0,0|2,0,0]=4 430 B9R1.6 CC(N)C1=CN=CC=N1 AK-31016 [1,1,0,0,0,0|1,0,0]=3 431 B9R1.6 CC(O)C1=NC=CC=C1 AK-53453 [1,1,0,0,0,0|2,0,0]=4 432 B9R1.6 CN(C)C1=NC=CC=C1 AK-78706 [1,1,0,0,0,0|2,0,0]=4 433 B9R1.6 C[C@@H](N)C1=CC=CN=C1 AK152012 [1,1,0,0,0,0|2,0,0]=4 434 B9R1.6 C[C@@H](N)C1=NC=CC=C1 AK122419 [1,1,0,0,0,0|2,0,0]=4 435 B9R1.6 C[C@@H](O)C1=NC=CC=C1 AK-79201 [1,1,0,0,0,0|2,0,0]=4 436 B9R1.6 C[C@H](N)C1=CC=CN=C1 AK151271 [1,1,0,0,0,0|2,0,0]=4 437 B9R1.6 N1=C(C=CC=C1)[C@@H](C)N AK-37082 [1,1,0,0,0,0|2,0,0]=4 438 B9R1.6 NC(=O)C1=CN=CC=N1 AK-94813 [1,1,0,0,0,0|2,0,0]=4 439 B9R1.6 N[C@H](C1=NC=CC=C1)C AK-37110 [1,1,0,0,0,0|2,0,0]=4 440 B9R1.8 C1=C(CCN)N=CC=C1 AK-73075 [1,1,0,0,0,0|2,0,0]=4 441 B9R1.8 C1=C(N=CC=C1)COC AK-32294 [1,1,0,0,0,0|1,1,0]=4 442 B9R1.8 CCCC1=NC=CN=C1 AK305719 [1,1,0,0,0,0|1,0,0]=3 443 B9R1.8 CCNC1=CC=CN=C1 AK126739 [1,1,0,0,0,0|2,0,0]=4 444 B9R1.8 CCNC1=NC=CN=C1 AK159718 [1,1,0,0,0,0|1,0,0]=3 445 B9R1.8 CCOC1=NC=CC=C1 AK-88755 [1,1,0,0,0,0|1,1,0]=4 446 B9R1.8 CNCC1=CC=CN=C1 AK-77094 [1,1,0,0,0,0|2,0,0]=4 447 B9R1.8 CNCC1=NC=CC=C1 AK-82805 [1,1,0,0,0,0|2,0,0]=4 448 B9R1.8 CNCC1=NC=CN=C1 AK-32984 [1,1,0,0,0,0|1,0,0]=3 449 B9R1.8 NCCC1=CC=CN=C1 AK-45879 [1,1,0,0,0,0|2,0,0]=4 450 B9R1.8 OCCC1=NC=CN=C1 AK-45393 [1,1,0,0,0,0|1,0,0]=3 451 B9R1.3 CC1=C(Br)C(C)=NC=C1 AK-29971 [1,1,0,0,0,0|2,0,0]=4 452 B9R1.3 CC1=C(Br)C=CN=C1C AK-68333 [1,1,0,0,0,0|1,0,0]=3 453 B9R1.3 CC1=C(Br)C=CN=C1Cl AK-33079 [1,1,0,0,0,0|2,0,0]=4 454 B9R1.3 CC1=C(Br)C=CN=C1F AK-48974 [1,1,0,0,0,0|2,0,0]=4 455 B9R1.3 CC1=C(Br)C=CN=C1N AK-80737 [1,1,0,0,0,0|2,0,0]=4 456 B9R1.3 CC1=C(C)C(Br)=NC=C1 AK137351 [1,1,0,0,0,0|2,0,0]=4 457 B9R1.3 CC1=C(C)C(Cl)=NC=C1 AK137975 [1,1,0,0,0,0|2,0,0]=4 458 B9R1.3 CC1=C(C)C(Cl)=NC=N1 AK125273 [1,1,0,0,0,0|2,0,0]=4 459 B9R1.3 CC1=C(I)C=CN=C1F AK-28806 [1,1,0,0,0,0|2,0,0]=4 460 B9R1.3 CC1=C(N)C=CN=C1Cl AK-82327 [1,1,0,0,0,0|2,0,0]=4 461 B9R1.3 CC1=NC=CC(Cl)=C1F AK-76733 [1,1,0,0,0,0|2,0,0]=4 462 B9R1.3 CC1=NC=CC(N)=C1N AK-28845 [1,1,0,0,0,0|2,0,0]=4 463 B9R1.3 NC1=C(F)C(C)=NC=C1 AK321851 [1,1,0,0,0,0|2,0,0]=4 464 B9R1.3 NC1=NC=CC(C)=C1C AK-39823 [1,1,0,0,0,0|2,0,0]=4 465 B9R1.3 NC1=NC=CC(Cl)=C1C AK123469 [1,1,0,0,0,0|2,0,0]=4 466 B9R1.3 NC1=NC=NC(C)=C1C AK125553 [1,1,0,0,0,0|2,0,0]=4 467 B9R1.69 BrC1=CC=C(N=C1C)Cl AK-25366 [1,1,0,0,0,0|2,0,0]=4 468 B9R1.69 BrC1=CN=C(C(=C1)C)C AK-55129 [1,1,0,0,0,0|1,0,0]=3 469 B9R1.69 BrC1=CN=C(C(=C1)N)C AK-36852 [1,1,0,0,0,0|2,0,0]=4 470 B9R1.69 BrC1=CN=C(C(=C1)O)C AK-54789 [1,1,0,0,0,0|1,1,0]=4 471 B9R1.69 BrC1=NC(=C(C=C1)Br)C AK-30361 [1,1,0,0,0,0|2,0,0]=4 472 B9R1.69 BrC1=NC(=CN=C1O)Br AK-23947 [1,1,0,0,0,0|1,1,0]=4 473 B9R1.69 BrC1=NC=C(C=C1C)F AK-37290 [1,1,0,0,0,0|2,0,0]=4 474 B9R1.69 C1=C(Br)C=NC(=C1C)Br AK-25803 [1,1,0,0,0,0|2,0,0]=4 475 B9R1.69 C1=C(C(=NC=C1Br)Cl)C AK-29098 [1,1,0,0,0,0|2,0,0]=4 476 B9R1.69 C1=CC(=C(N=C1Br)C)F AK-25869 [1,1,0,0,0,0|2,0,0]=4 477 B9R1.69 C1=CC(=NC(=C1N)C)Cl AK-27752 [1,1,0,0,0,0|2,0,0]=4 478 B9R1.69 CC1=C(Br)C=CC(N)=N1 AK-25963 [1,1,0,0,0,0|2,0,0]=4 479 B9R1.69 CC1=C(Br)N=C(N)C=N1 AK102607 [1,1,0,0,0,0|1,0,0]=3 480 B9R1.69 CC1=C(Br)N=CC(N)=N1 AK-31830 [1,1,0,0,0,0|1,0,0]=3 481 B9R1.69 CC1=C(C)C=C(I)C=C1 AK-87089 [1,1,0,0,0,0|2,0,0]=4 482 B9R1.69 CC1=C(C)N=C(Br)C=N1 AK100474 [1,1,0,0,0,0|0,0,0]=2 483 B9R1.69 CC1=C(C)N=C(Cl)C=N1 AK100473 [1,1,0,0,0,0|0,0,0]=2 484 B9R1.69 CC1=C(I)C=CC(N)=N1 AK-29500 [1,1,0,0,0,0|2,0,0]=4 485 B9R1.69 CC1=CC(Br)=CN=C1F AK-25719 [1,1,0,0,0,0|2,0,0]=4 486 B9R1.69 CC1=CC(Cl)=CN=C1Br AK-28447 [1,1,0,0,0,0|2,0,0]=4 487 B9R1.69 CC1=CC(Cl)=CN=C1Cl AK-35794 [1,1,0,0,0,0|2,0,0]=4 488 B9R1.69 CC1=CC(Cl)=CN=C1O AK-84432 [1,1,0,0,0,0|1,1,0]=4 489 B9R1.69 CC1=CC(I)=CN=C1Br AK-30274 [1,1,0,0,0,0|2,0,0]=4 490 B9R1.69 CC1=CC(I)=CN=C1Cl AK-30039 [1,1,0,0,0,0|2,0,0]=4 491 B9R1.69 CC1=CC(N)=CN=C1Br AK-25887 [1,1,0,0,0,0|2,0,0]=4 492 B9R1.69 CC1=CC(N)=CN=C1F AK-25540 [1,1,0,0,0,0|2,0,0]=4 493 B9R1.69 CC1=CC(O)=CN=C1Br AK-41464 [1,1,0,0,0,0|2,0,0]=4 494 B9R1.69 CC1=CC=C(Br)C(C)=N1 AK-25808 [1,1,0,0,0,0|2,0,0]=4 495 B9R1.69 CC1=CC=C(C)C(N)=N1 AK-29554 [1,1,0,0,0,0|2,0,0]=4 496 B9R1.69 CC1=CC=C(Cl)N=C1C AK121756 [1,1,0,0,0,0|1,0,0]=3 497 B9R1.69 CC1=CC=C(Cl)N=C1Cl AK-35762 [1,1,0,0,0,0|2,0,0]=4 498 B9R1.69 CC1=CC=C(N)N=C1N AK-55063 [1,1,0,0,0,0|2,0,0]=4 499 B9R1.69 CC1=CN=C(Br)C(C)=C1 AK-41105 [1,1,0,0,0,0|2,0,0]=4 500 B9R1.69 CC1=CN=C(C)C(C)=N1 AK114354 [1,1,0,0,0,0|0,0,0]=2 501 B9R1.69 CC1=CN=C(C)C(Cl)=N1 AK-44807 [1,1,0,0,0,0|1,0,0]=3 502 B9R1.69 CC1=CN=C(Cl)C(C)=N1 AK-32060 [1,1,0,0,0,0|1,0,0]=3 503 B9R1.69 CC1=CN=C(F)C(C)=C1 AK-61470 [1,1,0,0,0,0|2,0,0]=4 504 B9R1.69 CC1=NC(Br)=CC=C1Cl AK-51011 [1,1,0,0,0,0|2,0,0]=4 505 B9R1.69 CC1=NC(Br)=CC=C1N AK-25062 [1,1,0,0,0,0|2,0,0]=4 506 B9R1.69 CC1=NC(Cl)=CC=C1I AK-29931 [1,1,0,0,0,0|2,0,0]=4 507 B9R1.69 CC1=NC(Cl)=CN=C1Cl AK167866 [1,1,0,0,0,0|1,0,0]=3 508 B9R1.69 CC1=NC(F)=CC=C1Br AK-34913 [1,1,0,0,0,0|2,0,0]=4 509 B9R1.69 CC1=NC(F)=CC=C1O AK478670 [1,1,0,0,0,0|1,1,0]=4 510 B9R1.69 CC1=NC(I)=C(C)N=C1 AK-80700 [1,1,0,0,0,0|1,0,0]=3 511 B9R1.69 CC1=NC=C(Br)C=C1Br AK-29994 [1,1,0,0,0,0|2,0,0]=4 512 B9R1.69 CC1=NC=C(Br)C=C1Cl AK-84453 [1,1,0,0,0,0|2,0,0]=4 513 B9R1.69 ClC1=CC=C(C(=N1)C)F AK-30362 [1,1,0,0,0,0|2,0,0]=4 514 B9R1.69 ClC1=CN=C(Br)C(N)=N1 AK-31255 [1,1,0,0,0,0|2,0,0]=4 515 B9R1.69 ClC1=CN=C(C(=C1)C)F AK-27062 [1,1,0,0,0,0|2,0,0]=4 516 B9R1.69 ClC1=NC(Cl)=C(Cl)N=C1 AK-54498 [1,1,0,0,0,0|2,0,0]=4 517 B9R1.69 ClC1=NC=C(Br)N=C1Br AK-30889 [1,1,0,0,0,0|2,0,0]=4 518 B9R1.69 ClC1=NC=C(C=C1C)F AK-29981 [1,1,0,0,0,0|2,0,0]=4 519 B9R1.69 FC1=CN=C(C(=C1)C)N AK-26810 [1,1,0,0,0,0|2,0,0]=4 520 B9R1.69 IC1=NC=C(Cl)N=C1Cl AK-50532 [1,1,0,0,0,0|2,0,0]=4 521 B9R1.69 NC1=C(N)N=C(Cl)C=N1 AK-54497 [1,1,0,0,0,0|2,0,0]=4 522 B9R1.69 NC1=CC(C)=C(Cl)N=C1 AK-25886 [1,1,0,0,0,0|2,0,0]=4 523 B9R1.69 NC1=CC=C(C)N=C1C AK-39495 [1,1,0,0,0,0|2,0,0]=4 524 B9R1.69 NC1=NC(=C(C=C1)F)C AK-37271 [1,1,0,0,0,0|2,0,0]=4 525 B9R1.69 NC1=NC(=C(N=C1)Br)Cl AK-23979 [1,1,0,0,0,0|2,0,0]=4 526 B9R1.69 NC1=NC(Br)=C(Br)N=C1 AK143816 [1,1,0,0,0,0|2,0,0]=4 527 B9R1.69 NC1=NC(Br)=CC=C1C AK152582 [1,1,0,0,0,0|2,0,0]=4 528 B9R1.69 NC1=NC(Br)=CN=C1Br AK-30892 [1,1,0,0,0,0|2,0,0]=4 529 B9R1.69 NC1=NC(Br)=CN=C1Cl AK-30890 [1,1,0,0,0,0|2,0,0]=4 530 B9R1.69 NC1=NC(C)=C(C)C=C1 AK130279 [1,1,0,0,0,0|1,0,0]=3 531 B9R1.69 NC1=NC(C)=C(C)N=C1 AK-92908 [1,1,0,0,0,0|0,0,0]=2 532 B9R1.69 NC1=NC(C)=CN=C1C AK-80606 [1,1,0,0,0,0|1,0,0]=3 533 B9R1.69 NC1=NC(C)=CN=C1Cl AK137305 [1,1,0,0,0,0|2,0,0]=4 534 B9R1.69 NC1=NC(Cl)=C(C)C=C1 AK-31304 [1,1,0,0,0,0|2,0,0]=4 535 B9R1.69 NC1=NC(Cl)=CN=C1Cl AK-54502 [1,1,0,0,0,0|2,0,0]=4 536 B9R1.69 NC1=NC=C(Br)C=C1C AK-25805 [1,1,0,0,0,0|2,0,0]=4 537 B9R1.69 NC1=NC=C(Br)N=C1Br AK-21825 [1,1,0,0,0,0|2,0,0]=4 538 B9R1.69 NC1=NC=C(Br)N=C1N AK-23946 [1,1,0,0,0,0|2,0,0]=4 539 B9R1.69 NC1=NC=C(C)C(C)=N1 AK121479 [1,1,0,0,0,0|2,0,0]=4 540 B9R1.69 NC1=NC=C(C)C=C1C AK-68338 [1,1,0,0,0,0|2,0,0]=4 541 B9R1.69 NC1=NC=C(Cl)C=C1C AK-30404 [1,1,0,0,0,0|2,0,0]=4 542 B9R1.69 NC1=NC=C(I)C=C1C AK-30269 [1,1,0,0,0,0|2,0,0]=4 543 B9R1.69 NC1=NC=C(N=C1Br)C AK-24581 [1,1,0,0,0,0|2,0,0]=4 544 B9R1.69 NC1=NC=C(N=C1Br)Cl AK-23980 [1,1,0,0,0,0|2,0,0]=4 545 B9R1.69 NC1=NC=C(N=C1C)Br AK-24942 [1,1,0,0,0,0|1,0,0]=3 546 B9R1.69 NC1=NC=C(N=C1Cl)Br AK-25099 [1,1,0,0,0,0|2,0,0]=4 547 B9R1.69 NC1=NC=C(N=C1Cl)C AK-23580 [1,1,0,0,0,0|2,0,0]=4 548 B9R1.69 NC1=NC=C(N=C1Cl)Cl AK-24809 [1,1,0,0,0,0|2,0,0]=4 549 B9R1.69 OC1=CC(C)=C(Cl)N=C1 AK-29367 [1,1,0,0,0,0|2,0,0]=4 550 B9R1.69 OC1=CC(Cl)=C(C)N=C1 AK150753 [1,1,0,0,0,0|2,0,0]=4 551 B9R1.69 OC1=CC=C(Br)N=C1C AK-61491 [1,1,0,0,0,0|1,1,0]=4 552 B9R1.69 OC1=CC=C(C)N=C1C AK-28572 [1,1,0,0,0,0|1,1,0]=4 553 B9R1.69 OC1=CC=C(Cl)N=C1C AK-84114 [1,1,0,0,0,0|1,1,0]=4 554 B9R1.69 OC1=NC(C)=C(Br)C=C1 AK-27759 [1,1,0,0,0,0|2,0,0]=4 555 B9R1.69 OC1=NC=C(Br)N=C1C AK136185 [1,1,0,0,0,0|0,1,0]=3 556 B9R1.69 OC1=NC=C(I)C=C1C AK102572 [1,1,0,0,0,0|1,1,0]=4 557 B9R1.33 C1=NC(=C(S1)CCO)C AK-30249 [0,1,0,0,1,0|2,0,0]=4 558 B9R1.33 CC1=NC=CN1CCN AK-55496 [0,1,0,0,1,0|2,0,0]=4 559 B9R1.33 CCOC1=C(C)N=CO1 AK-51318 [0,1,0,0,1,0|1,1,0]=4 560 B9R1.41 CN1C=CN=C1C(C)=O AK-54843 [0,1,0,0,1,0|2,0,0]=4 561 B9R1.41 CN1N=CC=C1C(C)=O AK-40773 [0,1,0,0,1,0|2,0,0]=4 562 B11R1.8 O=C1N(C)C(SC)=NC(N)=C1 AK-67709 [0,2,0,0,0,0|2,0,0]=4 563 B11R1.265 CC1=NC=CC(OC)=C1OC AK683629 [0,2,0,0,0,0|1,1,0]=4 564 B11R1.86 CC(C)CC1=NC=CN=C1C AK-59003 [0,2,0,0,0,0|1,0,0]=3 565 B11R1.182 CCOC1=NC(Br)=CN=C1N AK-23943 [0,2,0,0,0,0|1,1,0]=4 566 B11R1.182 NC1=NC=C(N=C1NCC)Br AK-23953 [0,2,0,0,0,0|2,0,0]=4 567 B11R1.222 BrC1=NC=CN=C1C(=O)OC AK-30735 [0,2,0,0,0,0|1,1,0]=4 568 B11R1.222 C1=CN=C(C(=N1)C(OC)=O)N AK-29912 [0,2,0,0,0,0|1,1,0]=4 569 B11R1.222 CC1=C(C(=O)OC)C=CC=N1 AK-27990 [0,2,0,0,0,0|1,1,0]=4 570 B11R1.222 CCC(C1=NC=CC=C1C)N AK670798 [0,2,0,0,0,0|2,0,0]=4 571 B11R1.222 COC(=O)C1=C(C)N=CC=N1 AK-97091 [0,2,0,0,0,0|0,1,0]=3 572 B11R1.222 COC(=O)C1=NC=CC=C1C AK-61199 [0,2,0,0,0,0|1,1,0]=4 573 B11R1.222 ClC1=NC=CN=C1C(=O)OC AK-39173 [0,2,0,0,0,0|1,1,0]=4 574 B11R1.222 O=C(C1=NC=CN=C1I)OC AK-30597 [0,2,0,0,0,0|1,1,0]=4 575 B11R1.222 OC1=NC=CN=C1C(=O)OC AK-39232 [0,2,0,0,0,0|1,1,0]=4 576 B11R1.37 BrC1=CN=C(C(=N1)OC)OC AK-39750 [0,2,0,0,0,0|0,1,0]=3 577 B11R1.37 COC1=CC(Br)=CN=C1OC AK-82785 [0,2,0,0,0,0|1,1,0]=4 578 B11R1.37 COC1=NC=C(F)C=C1CO AK-36653 [0,2,0,0,0,0|1,1,0]=4 579 B11R1.37 NCC1=CC=C(Br)N=C1OC AK138583 [0,2,0,0,0,0|1,1,0]=4 580 B11R1.37 NCC1=CC=C(Br)N=C1OC AK687509 [0,2,0,0,0,0|1,1,0]=4 581 B11R1.37 OCC1=CC=C(Br)N=C1OC AK138582 [0,2,0,0,0,0|1,1,0]=4 582 B11R1.53 CCC1=C(N=CC=N1)C(C)=O AK-89658 [0,2,0,0,0,0|1,0,0]=3 583 B11R1.53 COC1=C(N=CC=N1)C(O)=O AK102764 [0,2,0,0,0,0|0,1,1]=4 584 B11R1.53 COC1=CC=CN=C1C(C)=O AK-80679 [0,2,0,0,0,0|1,1,0]=4 585 B11R1.53 COC1=NC=CC=C1C(C)=O AK110016 [0,2,0,0,0,0|1,1,0]=4 586 B11R1.53 COC1=NC=CN=C1C(C)C AK116762 [0,2,0,0,0,0|0,1,0]=3 587 B11R1.166 BrC1=NC(=CN=C1N(C)C)Br AK-23666 [0,2,0,0,0,0|2,0,0]=4 588 B11R1.277 OCC1=NC(C)=C(C)N=C1C AK-95406 [0,2,0,0,0,0|2,0,0]=4 589 B11R1.167 CC1=NC(C(O)=O)=C(C)N=C1 AK-80652 [0,2,0,0,0,0|2,0,0]=4 590 B11R1.167 NC1=NC=C(N=C1N(C)C)Br AK-23954 [0,2,0,0,0,0|2,0,0]=4 591 B9R2.3 C1CN2N=CC=C2C1 AK-40480 [0,0,0,1,1,0|2,0,0]=4 592 B11R2.106 ClC1=C2CCCC2=NC=C1 AK-38590 [0,1,0,1,0,0|2,0,0]=4 593 B11R2.20 C12=C(N=CC=C1)CNCC2 AK-72699 [0,1,0,1,0,0|2,0,0]=4 594 B11R2.20 C12=C(N=CC=C1)CNCC2 AK128835 [0,1,0,1,0,0|2,0,0]=4 595 B11R2.20 C12=CC=CC=C1NCCS2 AK116388 [0,1,0,1,0,0|2,0,0]=4 596 B11R2.20 C12=NC=CC=C1OCCO2 AK-31936 [0,1,0,1,0,0|1,1,0]=4 597 B11R2.20 C1=CC=NC2=C1CCCC2 AK-25273 [0,1,0,1,0,0|2,0,0]=4 598 B11R2.20 C1=NC2=C(N=C1)CCCC2 AK-34766 [0,1,0,1,0,0|1,0,0]=3 599 B11R2.20 C1CNC2=CC=CN=C2C1 AK-59103 [0,1,0,1,0,0|2,0,0]=4 600 B11R2.20 N1CCNC2=C1C=CC=N2 AK-24566 [0,1,0,1,0,0|2,0,0]=4 601 B11R2.1 BrC1=CSC2=NC=CN=C12 AK-30777 [0,1,0,1,0,0|0,0,2]=4 602 B11R2.1 BrC1=NSC2=NC=CN=C12 AK-30773 [0,1,0,1,0,0|1,0,1]=4 603 B11R2.1 CC1CCC2=NC=CN=C21 AK116760 [0,1,0,1,0,0|1,0,0]=3 604 B11R2.1 NC1CCC2=CC=CN=C21 AK-75878 [0,1,0,1,0,0|2,0,0]=4 605 B11R2.1 O=C1CCC2=CC=CN=C21 AK-29125 [0,1,0,1,0,0|2,0,0]=4 606 B11R2.1 OC1CCC2=CC=CN=C21 AK-72486 [0,1,0,1,0,0|2,0,0]=4 607 B11R2.36 BrC1=CN=C2NCCC2=C1 AK-27505 [0,1,0,1,0,0|2,0,0]=4 608 B11R2.36 ClC1=CN=C2NCCC2=C1 AK156379 [0,1,0,1,0,0|2,0,0]=4 609 B7R1.1 CCC1=CC=CS1 AK-76635 [1,0,0,0,1,0|2,0,0]=4 610 B7R1.1 CCC1=NC=CN1 AK161825 [1,0,0,0,1,0|1,0,1]=4 611 B7R1.1 CCC1=NNC=N1 AK124531 [1,0,0,0,1,0|2,0,0]=4 612 B7R1.1 CCN1C=CN=C1 AK-47598 [1,0,0,0,1,0|2,0,0]=4 613 B7R1.1 CCN1N=CC=C1 AK-39994 [1,0,0,0,1,0|2,0,0]=4 614 B7R1.1 CNC1=NC=CS1 AK-32595 [1,0,0,0,1,0|2,0,0]=4 615 B7R1.1 COC1=CC=CS1 AK-60885 [1,0,0,0,1,0|1,1,0]=4 616 B7R1.1 COC1=CNN=C1 AK200730 [1,0,0,0,1,0|1,1,0]=4 617 B7R1.1 COC1=CSC=C1 AK-60944 [1,0,0,0,1,0|1,1,0]=4 618 B7R1.1 COC1=NC=CS1 AK-46322 [1,0,0,0,1,0|1,1,0]=4 619 B7R1.4 BrC1=CC=N[N]1C AK-34841 [1,0,0,0,1,0|2,0,0]=4 620 B7R1.4 C1=C(N)[N](C)N=C1 AK-23556 [1,0,0,0,1,0|2,0,0]=4 621 B7R1.4 C1=CC(=C(S1)Br)C AK-46588 [1,0,0,0,1,0|2,0,0]=4 622 B7R1.4 CC1=C(Br)NC=N1 AK-92496 [1,0,0,0,1,0|1,0,1]=4 623 B7R1.4 CC1=C(Br)SC=N1 AK-40873 [1,0,0,0,1,0|2,0,0]=4 624 B7R1.4 CC1=C(C)N=CN1 AK157739 [1,0,0,0,1,0|0,0,1]=3 625 B7R1.4 CC1=C(C)N=CS1 AK-46395 [1,0,0,0,1,0|1,0,0]=3 626 B7R1.4 CC1=C(I)NC=N1 AK128524 [1,0,0,0,1,0|1,0,1]=4 627 B7R1.4 CC1=CC=NN1C AK-36127 [1,0,0,0,1,0|1,0,0]=3 628 B7R1.4 CC1=CNN=C1C AK111434 [1,0,0,0,1,0|1,0,0]=3 629 B7R1.4 CC1=CNN=C1C AK117330 [1,0,0,0,1,0|1,0,0]=3 630 B7R1.4 CC1=CSC=C1C AK-45919 [1,0,0,0,1,0|2,0,0]=4 631 B7R1.4 CC1=NNC=C1Br AK-24746 [1,0,0,0,1,0|2,0,0]=4 632 B7R1.4 CC1=NNC=C1I AK-73045 [1,0,0,0,1,0|2,0,0]=4 633 B7R1.4 CN1C=CN=C1C AK-60401 [1,0,0,0,1,0|1,0,0]=3 634 B7R1.4 CN1C=CN=C1Cl AK-79282 [1,0,0,0,1,0|2,0,0]=4 635 B7R1.4 CN1C=CN=C1I AK-34893 [1,0,0,0,1,0|2,0,0]=4 636 B7R1.4 CN1N=CN=C1Br AK-49045 [1,0,0,0,1,0|2,0,0]=4 637 B7R1.4 IC1=CC=N[N]1C AK-34754 [1,0,0,0,1,0|2,0,0]=4 638 B7R1.4 NC1=NC=CN1C AK-36047 [1,0,0,0,1,0|2,0,0]=4 639 B7R1.4 NC1=NC=CN1C AK125047 [1,0,0,0,1,0|2,0,0]=4 640 B7R1.4 OC1=CC=N[N]1C AK-39760 [1,0,0,0,1,0|1,1,0]=4