0 B9R1.6 C(N)(=N)C1=NC=CC=N1 AK-33208 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.6 C1=C(C(=O)C)C=CN=C1 AK-65203 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.6 C1=C(C(C)=O)N=CC=C1 AK-53417 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.6 C1=C(C(N)=O)C=CN=C1 AK-47864 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.6 C1=C(C=CC=C1)B(O)O AK-50285 [0,0,0,0,0,0|3,0,1]=4 5 B9R1.6 C1=C(N=CC=N1)C(=O)C AK-16901 [0,0,0,0,0,0|2,0,0]=2 6 B9R1.6 C1=C(N=NC=C1)C(O)=O AK-28139 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.6 C1=CN=CN=C1C(=O)O AK-23926 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.6 C1=NC=C(B(O)O)C=N1 AK-25129 [0,0,0,0,0,0|3,0,1]=4 9 B9R1.6 C1=NC=CN=C1C(N)=N AK-24427 [0,0,0,0,0,0|2,0,0]=2 10 B9R1.6 C1=NC=CN=C1C(O)=O AK-47505 [0,0,0,0,0,0|2,0,0]=2 11 B9R1.6 C1=NC=NC=C1C(=O)O AK-24470 [0,0,0,0,0,0|2,0,0]=2 12 B9R1.6 CC(=O)C1=CC=CN=N1 AK-83539 [0,0,0,0,0,0|2,0,0]=2 13 B9R1.6 CC(=O)C1=CC=NN=C1 AK-30816 [0,0,0,0,0,0|2,0,0]=2 14 B9R1.6 CC(=O)C1=NC=CC=N1 AK-35526 [0,0,0,0,0,0|4,0,0]=4 15 B9R1.6 CC(C1=CN=CN=C1)=O AK-32388 [0,0,0,0,0,0|2,0,0]=2 16 B9R1.6 CC(C1=NC=NC=C1)=O AK-40767 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.6 CC(N)C1=CC=CN=C1 AK-35649 [0,0,0,0,0,0|1,0,1]=2 18 B9R1.6 CC(N)C1=CN=CC=N1 AK-31016 [0,0,0,0,0,0|2,0,1]=3 19 B9R1.6 C[C@@H](N)C1=CC=CC=C1 AK668263 [0,0,0,0,0,0|2,0,1]=3 20 B9R1.6 C[C@@H](N)C1=CC=CN=C1 AK152012 [0,0,0,0,0,0|1,0,1]=2 21 B9R1.6 C[C@@H](N)C1=NC=CC=C1 AK122419 [0,0,0,0,0,0|3,0,1]=4 22 B9R1.6 C[C@@H](O)C1=CC=CC=C1 AK-79205 [0,0,0,0,0,0|2,0,2]=4 23 B9R1.6 C[C@H](N)C1=CC=CN=C1 AK151271 [0,0,0,0,0,0|1,0,1]=2 24 B9R1.6 N1=C(C=CC=C1)C(N)=S AK-65332 [0,0,0,0,0,0|2,1,0]=3 25 B9R1.6 N1=C(C=CC=C1)[C@@H](C)N AK-37082 [0,0,0,0,0,0|3,0,1]=4 26 B9R1.6 N1=C(N=CC=C1)C(=O)O AK-24353 [0,0,0,0,0,0|4,0,0]=4 27 B9R1.6 N1=NC=C(C=C1)C(=O)O AK-26044 [0,0,0,0,0,0|2,0,0]=2 28 B9R1.6 N=C(C1=NC=CC=N1)N AK164164 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.6 N=C(N)C1=CC=CC=C1 AK-47930 [0,0,0,0,0,0|2,0,0]=2 30 B9R1.6 N=C(N)C1=CC=NC=C1 AK-84875 [0,0,0,0,0,0|3,0,0]=3 31 B9R1.6 N=C(N)C1=CC=NC=C1 AK546382 [0,0,0,0,0,0|3,0,0]=3 32 B9R1.6 N=C(N)C1=CN=CC=C1 AK-76662 [0,0,0,0,0,0|1,0,0]=1 33 B9R1.6 N=C(N)C1=NC=CC=C1 AK-26055 [0,0,0,0,0,0|3,0,0]=3 34 B9R1.6 NC(=N)C1=CC=CC=C1 AK-48017 [0,0,0,0,0,0|2,0,0]=2 35 B9R1.6 NC(=O)C1=CN=CC=N1 AK-94813 [0,0,0,0,0,0|1,0,0]=1 36 B9R1.6 NC(C1=CC=CC=C1)=S AK-46849 [0,0,0,0,0,0|1,1,0]=2 37 B9R1.6 N[C@@H](C1=CC=NC=C1)C AK202973 [0,0,0,0,0,0|3,0,1]=4 38 B9R1.6 N[C@H](C1=NC=CC=C1)C AK-37110 [0,0,0,0,0,0|3,0,1]=4 39 B9R1.6 O=C(Cl)C1=NC=CC=C1 AK-49118 [0,0,0,0,0,0|3,0,0]=3 40 B9R1.6 O=C(N)C1=CC=CC=C1 AK-77684 [0,0,0,0,0,0|1,0,0]=1 41 B9R1.6 O=C(N)C1=CN=CC=C1 AK112769 [0,0,0,0,0,0|0,0,0]=0 42 B9R1.6 O=C(N)C1=NC=CC=C1 AK106190 [0,0,0,0,0,0|2,0,0]=2 43 B9R1.6 O=C(O)C1=CN=CC=C1 AK-46486 [0,0,0,0,0,0|1,0,0]=1 44 B9R1.6 O=C(O)C1=NC=CC=C1 AK-50286 [0,0,0,0,0,0|3,0,0]=3 45 B9R1.6 O=S(C1=CC=CC=C1)[O-] AK162411 [0,0,0,0,0,0|3,0,0]=3 46 B9R1.6 OB(C1=CC=CN=C1)O AK-26799 [0,0,0,0,0,0|2,0,1]=3 47 B9R1.6 OC(=O)C1=CC=NC=C1 AK-49896 [0,0,0,0,0,0|3,0,0]=3 48 B8R1.2 BrCC1=CC=CN=C1 AK-44682 [1,0,0,0,0,0|1,0,1]=3 49 B8R1.2 BrCC1=CN=CN=C1 AK150782 [1,0,0,0,0,0|2,0,1]=4 50 B8R1.2 BrCC1=NC=CN=C1 AK143784 [1,0,0,0,0,0|2,0,1]=4 51 B8R1.2 BrCC1=NN=CC=C1 AK-77169 [1,0,0,0,0,0|2,0,1]=4 52 B8R1.2 C#CC1=CC=CN=C1 AK-39524 [1,0,0,0,0,0|1,0,1]=3 53 B8R1.2 C#CC1=NC=CN=C1 AK185335 [1,0,0,0,0,0|2,0,1]=4 54 B8R1.2 C(#C)C1=CN=CN=C1 AK-31058 [1,0,0,0,0,0|2,0,1]=4 55 B8R1.2 C1=C(N=CC=N1)CN AK-23965 [1,0,0,0,0,0|1,0,1]=3 56 B8R1.2 C1=NC=C(N=C1)CO AK-45812 [1,0,0,0,0,0|1,0,2]=4 57 B8R1.2 CNC1=CC=CN=C1 AK-72893 [1,0,0,0,0,0|2,0,0]=3 58 B8R1.2 CNC1=CC=NN=C1 AK545083 [1,0,0,0,0,0|3,0,0]=4 59 B8R1.2 COC1=CC=CN=C1 AK-76565 [1,0,0,0,0,0|2,0,0]=3 60 B8R1.2 COC1=CC=CN=N1 AK-28954 [1,0,0,0,0,0|3,0,0]=4 61 B8R1.2 COC1=CN=CN=C1 AK-31068 [1,0,0,0,0,0|3,0,0]=4 62 B8R1.2 CSC1=NC=CN=C1 AK-41535 [1,0,0,0,0,0|3,0,0]=4 63 B8R1.2 ICC1=CC=CC=C1 AK-54444 [1,0,0,0,0,0|2,0,1]=4 64 B8R1.2 N#CC1=CC=CC=C1 AK-49389 [1,0,0,0,0,0|1,0,2]=4 65 B8R1.2 N#CC1=CN=CC=C1 AK-76753 [1,0,0,0,0,0|0,0,2]=3 66 B8R1.2 N#CC1=CN=CN=C1 AK-21972 [1,0,0,0,0,0|1,0,2]=4 67 B8R1.2 N#CC1=NC=CN=C1 AK-47995 [1,0,0,0,0,0|1,0,2]=4 68 B8R1.2 N1=CN=C(C=C1)C=O AK-23925 [1,0,0,0,0,0|3,0,0]=4 69 B8R1.2 N1=CN=CC(=C1)C=O AK-25240 [1,0,0,0,0,0|1,0,0]=2 70 B8R1.2 NCC1=CC=NC=C1 AK-25866 [1,0,0,0,0,0|2,0,1]=4 71 B8R1.2 NCC1=CC=NC=C1 AK-50006 [1,0,0,0,0,0|2,0,1]=4 72 B8R1.2 NCC1=CC=NN=C1 AK-23789 [1,0,0,0,0,0|1,0,1]=3 73 B8R1.2 NCC1=CN=CN=C1 AK164227 [1,0,0,0,0,0|1,0,1]=3 74 B8R1.2 NCC1=NC=CN=C1 AK-50813 [1,0,0,0,0,0|1,0,1]=3 75 B8R1.2 NNC1=CC=CC=C1 AK114548 [1,0,0,0,0,0|2,0,0]=3 76 B8R1.2 NNC1=CC=CN=C1 AK-40869 [1,0,0,0,0,0|1,0,0]=2 77 B8R1.2 NNC1=CC=CN=C1 AK-75799 [1,0,0,0,0,0|1,0,0]=2 78 B8R1.2 NNC1=CC=CN=N1 AK110987 [1,0,0,0,0,0|2,0,0]=3 79 B8R1.2 NNC1=CC=NC=C1 AK-51295 [1,0,0,0,0,0|3,0,0]=4 80 B8R1.2 NNC1=NC=CC=C1 AK-26026 [1,0,0,0,0,0|3,0,0]=4 81 B8R1.2 NNC1=NC=CN=C1 AK-44383 [1,0,0,0,0,0|2,0,0]=3 82 B8R1.2 NOC1=CC=CC=C1 AK-77703 [1,0,0,0,0,0|2,0,0]=3 83 B8R1.2 O=CC1=CC=NC=C1 AK-50192 [1,0,0,0,0,0|2,0,0]=3 84 B8R1.2 OCC1=CC=CN=C1 AK-46173 [1,0,0,0,0,0|0,0,2]=3 85 B8R1.2 OCC1=CN=CN=C1 AK-32022 [1,0,0,0,0,0|1,0,2]=4 86 B8R1.2 ONC1=CC=CC=C1 AK139965 [1,0,0,0,0,0|2,0,1]=4 87 B10R1.13 BrC1=CN=C(C=N1)C(=O)O AK-24192 [0,1,0,0,0,0|2,0,0]=3 88 B10R1.13 BrC1=NC=C(C=N1)[N+](=O)[O-] AK-28086 [0,1,0,0,0,0|3,0,0]=4 89 B10R1.13 C(C)(=O)C1=CC=C(N=C1)Br AK-25404 [0,1,0,0,0,0|1,0,0]=2 90 B10R1.13 C1=C(C(=N)N)C=CC(=C1)Cl AK-49053 [0,1,0,0,0,0|2,0,0]=3 91 B10R1.13 C1=C(C=CC(=N1)Cl)B(O)O AK-29256 [0,1,0,0,0,0|2,0,1]=4 92 B10R1.13 C1=C(C=CC(=N1)F)B(O)O AK-29209 [0,1,0,0,0,0|2,0,1]=4 93 B10R1.13 C1=C(C=CC(=N1)F)[N+]([O-])=O AK-25997 [0,1,0,0,0,0|2,0,0]=3 94 B10R1.13 C1=C(C=NC(=C1)N)C(=O)O AK-25111 [0,1,0,0,0,0|1,0,0]=2 95 B10R1.13 C1=C(C=NC(=N1)Cl)[N+]([O-])=O AK-24170 [0,1,0,0,0,0|3,0,0]=4 96 B10R1.13 C1=C(C=NC(=N1)N)[N+]([O-])=O AK-27269 [0,1,0,0,0,0|3,0,0]=4 97 B10R1.13 C1=C(N=CC(=C1)C(C)=O)C AK-25853 [0,1,0,0,0,0|1,0,0]=2 98 B10R1.13 C1=CC(=CC=C1C(C)=O)F AK-41690 [0,1,0,0,0,0|2,0,0]=3 99 B10R1.13 C1=CC(=CC=C1C(N)=O)F AK-47676 [0,1,0,0,0,0|1,0,0]=2 100 B10R1.13 C1=CC(=CC=C1C(O)=O)Br AK-50463 [0,1,0,0,0,0|2,0,0]=3 101 B10R1.13 C1=CC(=CC=C1C(O)=O)F AK-73077 [0,1,0,0,0,0|2,0,0]=3 102 B10R1.13 C1=CC(=CN=C1C(O)=O)C AK-27814 [0,1,0,0,0,0|3,0,0]=4 103 B10R1.13 C1=CC(=NC=C1C(N)=O)C AK-48877 [0,1,0,0,0,0|0,0,0]=1 104 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])Br AK-35205 [0,1,0,0,0,0|2,0,0]=3 105 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])Cl AK-25992 [0,1,0,0,0,0|2,0,0]=3 106 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])N AK-30014 [0,1,0,0,0,0|2,0,0]=3 107 B10R1.13 C1=NC(=CC=C1C(=O)O)F AK-25936 [0,1,0,0,0,0|1,0,0]=2 108 B10R1.13 C1=NC(=CN=C1C(=O)N)Cl AK-28055 [0,1,0,0,0,0|1,0,0]=2 109 B10R1.13 C1=NC(=CN=C1C(=O)O)Cl AK-24710 [0,1,0,0,0,0|2,0,0]=3 110 B10R1.13 CC(=O)C1=CC=C(N)N=C1 AK-67650 [0,1,0,0,0,0|1,0,0]=2 111 B10R1.13 CC(C1=CC=C(Br)C=C1)=O AK124422 [0,1,0,0,0,0|2,0,0]=3 112 B10R1.13 CC(C1=CC=C(C)C=C1)=O AK-41305 [0,1,0,0,0,0|2,0,0]=3 113 B10R1.13 CC(C1=CC=C(F)N=C1)=O AK-29672 [0,1,0,0,0,0|1,0,0]=2 114 B10R1.13 CC(C1=CC=C(N)C=C1)=O AK110424 [0,1,0,0,0,0|2,0,0]=3 115 B10R1.13 CC(C1=CC=C(O)C=C1)=O AK-86441 [0,1,0,0,0,0|2,0,0]=3 116 B10R1.13 CC(C1=CC=C(O)N=C1)=O AK-40333 [0,1,0,0,0,0|1,0,0]=2 117 B10R1.13 CC(C1=CN=C(Cl)N=C1)=O AK135579 [0,1,0,0,0,0|2,0,0]=3 118 B10R1.13 CC(C1=CN=C(N)C=C1)C AK-81363 [0,1,0,0,0,0|2,0,1]=4 119 B10R1.13 CC(C1=NC=C(Br)C=C1)=O AK-28454 [0,1,0,0,0,0|3,0,0]=4 120 B10R1.13 CC(C1=NC=C(Cl)C=C1)=O AK-77099 [0,1,0,0,0,0|3,0,0]=4 121 B10R1.13 CC(C1=NC=C(Cl)N=C1)=O AK-42149 [0,1,0,0,0,0|2,0,0]=3 122 B10R1.13 CC(C1=NC=C(O)C=C1)=O AK116053 [0,1,0,0,0,0|3,0,0]=4 123 B10R1.13 CC(C1=NC=C(O)N=C1)=O AK134806 [0,1,0,0,0,0|2,0,0]=3 124 B10R1.13 CC(N)C1=CC=C(C)N=C1 AK684509 [0,1,0,0,0,0|1,0,1]=3 125 B10R1.13 CC(N)C1=CC=C(I)C=C1 AK-77292 [0,1,0,0,0,0|2,0,1]=4 126 B10R1.13 CC(O)C1=CN=C(C)C=C1 AK-32149 [0,1,0,0,0,0|1,0,2]=4 127 B10R1.13 CC1=CC=C(S(O)=O)C=C1 AK-46949 [0,1,0,0,0,0|3,0,0]=4 128 B10R1.13 CC1=NC=C(C=C1)B(O)O AK-27039 [0,1,0,0,0,0|2,0,1]=4 129 B10R1.13 CC1=NC=C(C=N1)C(=O)O AK-25207 [0,1,0,0,0,0|2,0,0]=3 130 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 AK-45030 [0,1,0,0,0,0|2,0,1]=4 131 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 AK-89611 [0,1,0,0,0,0|2,0,1]=4 132 B10R1.13 C[C@@H](N)C1=CC=C(I)C=C1 AK-43006 [0,1,0,0,0,0|2,0,1]=4 133 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 AK-34471 [0,1,0,0,0,0|2,0,1]=4 134 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 AK548805 [0,1,0,0,0,0|2,0,1]=4 135 B10R1.13 ClC1=CC=C(C(C)=O)C=N1 AK-26129 [0,1,0,0,0,0|1,0,0]=2 136 B10R1.13 ClC1=CC=C(N=C1)C(=O)O AK-26702 [0,1,0,0,0,0|3,0,0]=4 137 B10R1.13 ClC1=CC=C(N=N1)C(=O)N AK-28115 [0,1,0,0,0,0|1,0,0]=2 138 B10R1.13 ClC1=CC=C(N=N1)C(=O)O AK-23862 [0,1,0,0,0,0|2,0,0]=3 139 B10R1.13 FC1=CC=C(N=C1)C(=O)O AK-28724 [0,1,0,0,0,0|3,0,0]=4 140 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 AK-89169 [0,1,0,0,0,0|2,0,0]=3 141 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 AK107083 [0,1,0,0,0,0|2,0,0]=3 142 B10R1.13 N=C(N)C1=CC=C(F)C=C1 AK-35244 [0,1,0,0,0,0|2,0,0]=3 143 B10R1.13 N=C(N)C1=CC=C(N)C=C1 AK-34349 [0,1,0,0,0,0|2,0,0]=3 144 B10R1.13 N=C(N)C1=CC=C(O)C=C1 AK-16801 [0,1,0,0,0,0|2,0,0]=3 145 B10R1.13 N=C(N)C1=CN=C(Cl)C=C1 AK-67868 [0,1,0,0,0,0|1,0,0]=2 146 B10R1.13 N=C(N)C1=NC=C(F)C=C1 AK130362 [0,1,0,0,0,0|3,0,0]=4 147 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 AK-76760 [0,1,0,0,0,0|1,0,0]=2 148 B10R1.13 NC(=O)C1=NC=C(N)C=N1 AK-82639 [0,1,0,0,0,0|3,0,0]=4 149 B10R1.13 NC(=O)C1=NC=C(N)N=C1 AK102768 [0,1,0,0,0,0|1,0,0]=2 150 B10R1.13 NC1=CC=C([N+]([O-])=O)C=C1 AK136006 [0,1,0,0,0,0|3,0,0]=4 151 B10R1.13 NC1=CN=C(C=C1)C(=O)O AK-25651 [0,1,0,0,0,0|3,0,0]=4 152 B10R1.13 NC1=NC=C(C=C1)B(O)O AK-36570 [0,1,0,0,0,0|2,0,1]=4 153 B10R1.13 NC1=NC=C(N=C1)C(=O)O AK-24195 [0,1,0,0,0,0|2,0,0]=3 154 B10R1.13 N[C@@H](C1=CC=C(Br)C=C1)C AK-35249 [0,1,0,0,0,0|2,0,1]=4 155 B10R1.13 N[C@@H](C1=CC=C(C)C=C1)C AK-45033 [0,1,0,0,0,0|2,0,1]=4 156 B10R1.13 N[C@H](C1=CC=C(F)C=C1)C AK-98664 [0,1,0,0,0,0|2,0,1]=4 157 B10R1.13 O=C(C1=CC=C(Cl)N=C1)N AK-44668 [0,1,0,0,0,0|0,0,0]=1 158 B10R1.13 O=C(C1=CN=C(Cl)N=C1)O AK-25020 [0,1,0,0,0,0|2,0,0]=3 159 B10R1.13 O=C(C1=CN=C(N)N=C1)O AK-17303 [0,1,0,0,0,0|2,0,0]=3 160 B10R1.13 O=C(C1=CN=C(O)N=C1)O AK-55017 [0,1,0,0,0,0|2,0,0]=3 161 B10R1.13 O=C(C1=CNC(C=N1)=O)O AK-24756 [0,1,0,0,0,0|2,0,1]=4 162 B10R1.13 O=C(C1=NC=C(Br)C=C1)N AK-36812 [0,1,0,0,0,0|2,0,0]=3 163 B10R1.13 O=C(C1=NC=C(Br)C=C1)O AK-25747 [0,1,0,0,0,0|3,0,0]=4 164 B10R1.13 O=C(C1=NC=C(Br)C=N1)N AK-75832 [0,1,0,0,0,0|3,0,0]=4 165 B10R1.13 O=C(C1=NC=C(Br)N=C1)N AK156282 [0,1,0,0,0,0|1,0,0]=2 166 B10R1.13 O=C(C1=NC=C(N)C=C1)N AK-40127 [0,1,0,0,0,0|2,0,0]=3 167 B10R1.13 O=C(C1=NN=C(N)C=C1)O AK-26163 [0,1,0,0,0,0|2,0,0]=3 168 B10R1.13 O=C(C1=NN=C(O)C=C1)O AK-25880 [0,1,0,0,0,0|2,0,0]=3 169 B10R1.13 O=C(C1=NN=C(O)C=C1)O AK601861 [0,1,0,0,0,0|2,0,0]=3 170 B10R1.13 O=C(N)C1=CC=C(Cl)C=C1 AK113058 [0,1,0,0,0,0|1,0,0]=2 171 B10R1.13 O=C(N)C1=CC=C(N)C=C1 AK151254 [0,1,0,0,0,0|1,0,0]=2 172 B10R1.13 O=C(N)C1=CC=C(O)C=C1 AK151255 [0,1,0,0,0,0|1,0,0]=2 173 B10R1.13 O=C(N)C1=CN=C(Br)C=C1 AK-41744 [0,1,0,0,0,0|0,0,0]=1 174 B10R1.13 O=C(N)C1=CN=C(N)C=C1 AK161454 [0,1,0,0,0,0|0,0,0]=1 175 B10R1.13 O=C(N)C1=NC=C(Cl)C=C1 AK142780 [0,1,0,0,0,0|2,0,0]=3 176 B10R1.13 O=C(N)C1=NC=C(F)C=C1 AK110171 [0,1,0,0,0,0|2,0,0]=3 177 B10R1.13 O=C(O)C1=CC=C(C)C=C1 AK106262 [0,1,0,0,0,0|2,0,0]=3 178 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 AK-44086 [0,1,0,0,0,0|2,0,0]=3 179 B10R1.13 O=C(O)C1=CC=C(I)C=C1 AK-73094 [0,1,0,0,0,0|2,0,0]=3 180 B10R1.13 O=C(O)C1=CC=C(N)C=C1 AK-41178 [0,1,0,0,0,0|2,0,0]=3 181 B10R1.13 O=C(O)C1=CC=C(O)C=C1 AK106263 [0,1,0,0,0,0|2,0,0]=3 182 B10R1.13 O=C(O)C1=CN=C(C)C=C1 AK-29149 [0,1,0,0,0,0|1,0,0]=2 183 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 AK-26081 [0,1,0,0,0,0|1,0,0]=2 184 B10R1.13 O=C(O)C1=CNC(C=C1)=O AK-26034 [0,1,0,0,0,0|1,0,1]=3 185 B10R1.13 O=C(O)C1=NC=C(O)C=C1 AK-24769 [0,1,0,0,0,0|3,0,0]=4 186 B10R1.13 O=C([O-])C1=CC=C(N)C=C1 AK116649 [0,1,0,0,0,0|2,0,0]=3 187 B10R1.13 O=C([O-])C1=CC=C(O)C=C1 AK306852 [0,1,0,0,0,0|2,0,0]=3 188 B10R1.13 O=C1C=CC(C(O)=O)=CO1 AK-46024 [0,1,0,0,0,0|2,0,0]=3 189 B10R1.13 O=C1N=CC(=CN1)[N+]([O-])=O AK-24169 [0,1,0,0,0,0|3,0,0]=4 190 B10R1.13 O=S(C1=CC=C(C)C=C1)O AK143296 [0,1,0,0,0,0|3,0,0]=4 191 B10R1.13 O=S(C1=CC=C(C)C=C1)[O-] AK106973 [0,1,0,0,0,0|3,0,0]=4 192 B10R1.13 O=S(C1=CC=C(F)C=C1)[O-] AK114760 [0,1,0,0,0,0|3,0,0]=4 193 B10R1.13 O=[N+](C1=CN=C(C)C=C1)[O-] AK-28977 [0,1,0,0,0,0|2,0,0]=3 194 B10R1.13 O=[N+]([O-])C1=CNC(=O)C=C1 AK-29363 [0,1,0,0,0,0|2,0,1]=4 195 B10R1.13 O=[S@@](C1=CC=C(C)C=C1)N AK-81446 [0,1,0,0,0,0|2,0,0]=3 196 B10R1.13 OB(C1=CC=C(O)N=C1)O AK-40749 [0,1,0,0,0,0|2,0,1]=4 197 B10R1.13 OB(C1=CN=C(Br)C=C1)O AK-27206 [0,1,0,0,0,0|2,0,1]=4 198 B10R1.13 OC(=O)C1=CC=C(Br)N=C1 AK-26208 [0,1,0,0,0,0|1,0,0]=2 199 B10R1.13 OC(=O)C1=NC=C(I)C=C1 AK-29144 [0,1,0,0,0,0|3,0,0]=4 200 B10R1.13 OC1=CC=C(C(=S)N)C=C1 AK-21819 [0,1,0,0,0,0|1,1,0]=3 201 B10R1.13 OC1=CC=C(C(C)=C)C=C1 AK117164 [0,1,0,0,0,0|3,0,0]=4 202 B10R1.13 OC1=CC=C([C@H](N)C)C=C1 AK608003 [0,1,0,0,0,0|2,0,1]=4 203 B10R1.15 C1=C(C(OC)=O)C=CN=C1 AK-46755 [0,1,0,0,0,0|3,0,0]=4 204 B10R1.15 C1=C(C(OC)=O)N=CC=C1 AK-46574 [0,1,0,0,0,0|3,0,0]=4 205 B10R1.15 C1=CC=NC=C1C(OC)=O AK-47410 [0,1,0,0,0,0|1,0,0]=2 206 B10R1.15 C1=NC=CN=C1C(OC)=O AK-47365 [0,1,0,0,0,0|2,0,0]=3 207 B10R1.15 CC(C1=CC=CC=C1)CN AK-67959 [0,1,0,0,0,0|2,0,1]=4 208 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 AK-47624 [0,1,0,0,0,0|2,0,1]=4 209 B10R1.15 C[C@@H](NC)C1=CC=CC=C1 AK140531 [0,1,0,0,0,0|2,0,1]=4 210 B10R1.15 N1=NC=C(C=C1)C(=O)OC AK-48857 [0,1,0,0,0,0|2,0,0]=3 211 B10R1.15 NCC(C1=CC=CC=C1)=O AK-26107 [0,1,0,0,0,0|1,0,0]=2 212 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 AK-45230 [0,1,0,0,0,0|1,0,2]=4 213 B10R1.15 NC[C@@H](O)C1=CC=CN=C1 AK-96401 [0,1,0,0,0,0|0,0,2]=3 214 B10R1.15 NNC(=O)C1=CC=NC=C1 AK-46317 [0,1,0,0,0,0|2,0,0]=3 215 B10R1.15 NNC(C1=CC=CN=C1)=O AK-44810 [0,1,0,0,0,0|0,0,0]=1 216 B10R1.15 N[C@H](C1=CC=CC=C1)CO AK-41249 [0,1,0,0,0,0|1,0,2]=4 217 B10R1.15 O=C(C1=NC=CC=C1)CBr AK-44981 [0,1,0,0,0,0|3,0,0]=4 218 B10R1.15 O=C(C1=NC=NC=C1)NN AK-68698 [0,1,0,0,0,0|3,0,0]=4 219 B10R1.15 O=C(C1=NN=CC=C1)OC AK-68100 [0,1,0,0,0,0|2,0,0]=3 220 B10R1.15 O=C(NC)C1=CC=CC=C1 AK323662 [0,1,0,0,0,0|1,0,0]=2 221 B10R1.15 O=C(NN)C1=NC=CC=C1 AK117449 [0,1,0,0,0,0|2,0,0]=3 222 B10R1.15 O=C(NN)C1=NC=CN=C1 AK-48495 [0,1,0,0,0,0|1,0,0]=2 223 B10R1.15 O=CN(C)C1=CC=CC=C1 AK-48601 [0,1,0,0,0,0|3,0,0]=4 224 B10R1.15 O=S(C1=CC=CC=C1)OC AK109245 [0,1,0,0,0,0|3,0,0]=4 225 B10R1.15 OCC(=O)C1=CC=CC=C1 AK-94786 [0,1,0,0,0,0|2,0,0]=3 226 B10R1.15 OCC(N)C1=CC=CC=C1 AK-47370 [0,1,0,0,0,0|1,0,2]=4 227 B10R1.15 [C@H](N)(C1=CC=CC=C1)CO AK-41260 [0,1,0,0,0,0|1,0,2]=4 228 B10R1.28 C1=C([S](O)(=O)=O)C=CC=C1 AK-51336 [0,1,0,0,0,0|3,0,0]=4 229 B10R1.28 CC(N)(C1=CC=CC=C1)C AK116559 [0,1,0,0,0,0|2,0,1]=4 230 B10R1.28 CC(N)(C1=CC=CN=C1)C AK-86166 [0,1,0,0,0,0|1,0,1]=3 231 B10R1.28 ClC(C1=CC=CN=C1)(Cl)Cl AK198586 [0,1,0,0,0,0|2,0,1]=4 232 B10R1.28 F[B-](F)(F)C1=CC=CN=C1 AK101215 [0,1,0,0,0,0|3,0,0]=4 233 B10R1.28 N1=CC(=CC=C1)[S](=O)(=O)Cl AK-27033 [0,1,0,0,0,0|2,0,0]=3 234 B10R1.28 N1=CC(=CC=C1)[S](=O)(=O)Cl AK-27053 [0,1,0,0,0,0|2,0,0]=3 235 B10R1.28 O=S(C1=CC=CC=C1)(N)=O AK-77414 [0,1,0,0,0,0|2,0,0]=3 236 B10R1.28 O=S(C1=CC=CN=C1)(O)=O AK-47361 [0,1,0,0,0,0|2,0,0]=3 237 B10R1.28 O=S(C1=NC=CC=C1)(N)=O AK-67939 [0,1,0,0,0,0|3,0,0]=4 238 B10R1.61 BrC1=C(C(=O)N)C=CN=C1 AK-29834 [0,1,0,0,0,0|2,0,0]=3 239 B10R1.61 BrC1=C(C=CN=C1)C(=O)O AK-23517 [0,1,0,0,0,0|3,0,0]=4 240 B10R1.61 BrC1=CC=CN=C1C(=O)O AK-25745 [0,1,0,0,0,0|3,0,0]=4 241 B10R1.61 BrC1=NC=CN=C1C(=O)O AK-30736 [0,1,0,0,0,0|2,0,0]=3 242 B10R1.61 C1=C(C(=NC=C1)Cl)C(N)=O AK-39181 [0,1,0,0,0,0|0,0,0]=1 243 B10R1.61 C1=C(C(=NC=C1)Cl)C(O)=O AK-27015 [0,1,0,0,0,0|1,0,0]=2 244 B10R1.61 C1=C(C(=NC=C1)F)C(O)=O AK-25163 [0,1,0,0,0,0|1,0,0]=2 245 B10R1.61 C1=C(C(=NC=C1)N)[N+](=O)[O-] AK-25955 [0,1,0,0,0,0|2,0,0]=3 246 B10R1.61 C1=CC=CC(=C1C(C)=O)Br AK-48030 [0,1,0,0,0,0|2,0,0]=3 247 B10R1.61 C1=CC=CC(=C1C(C)=O)N AK-27106 [0,1,0,0,0,0|2,0,0]=3 248 B10R1.61 C1=CC=CC(=C1C(O)=O)F AK-40433 [0,1,0,0,0,0|2,0,0]=3 249 B10R1.61 C1=CC=CC(=C1O)C(=O)C AK-44482 [0,1,0,0,0,0|2,0,0]=3 250 B10R1.61 C1=CC=NC(=C1C)C(O)=O AK-26613 [0,1,0,0,0,0|3,0,0]=4 251 B10R1.61 C1=CC=NC(=C1[N+]([O-])=O)Br AK-33945 [0,1,0,0,0,0|2,0,0]=3 252 B10R1.61 C1=CN=C(C(=C1)C(=O)N)F AK-25200 [0,1,0,0,0,0|0,0,0]=1 253 B10R1.61 C1=CN=C(C(=N1)C(O)=O)N AK-16902 [0,1,0,0,0,0|2,0,0]=3 254 B10R1.61 C1=CN=CC(=C1C(=O)O)F AK-25903 [0,1,0,0,0,0|3,0,0]=4 255 B10R1.61 C1=NC=CC(=C1C(O)=O)C AK-34679 [0,1,0,0,0,0|1,0,0]=2 256 B10R1.61 C1=NC=CC(=C1[N+]([O-])=O)Cl AK-25355 [0,1,0,0,0,0|2,0,0]=3 257 B10R1.61 CC(=O)C1=C(C)N=CC=N1 AK-89662 [0,1,0,0,0,0|2,0,0]=3 258 B10R1.61 CC(=O)C1=C(I)C=CC=C1 AK-84650 [0,1,0,0,0,0|2,0,0]=3 259 B10R1.61 CC(=O)C1=CC=CN=C1F AK-36408 [0,1,0,0,0,0|1,0,0]=2 260 B10R1.61 CC(=O)C1=CC=CN=C1N AK-61895 [0,1,0,0,0,0|1,0,0]=2 261 B10R1.61 CC(=O)C1=NC=CC=C1F AK-36671 [0,1,0,0,0,0|3,0,0]=4 262 B10R1.61 CC(C1=C(O)C=NC=C1)=O AK-68365 [0,1,0,0,0,0|3,0,0]=4 263 B10R1.61 CC(C1=CC=CC=C1C)=O AK-76969 [0,1,0,0,0,0|2,0,0]=3 264 B10R1.61 CC(C1=CC=CC=C1F)=O AK-44672 [0,1,0,0,0,0|2,0,0]=3 265 B10R1.61 CC(C1=CC=CN=C1C)=O AK-60286 [0,1,0,0,0,0|1,0,0]=2 266 B10R1.61 CC(C1=NC=CC=C1Br)=O AK-91392 [0,1,0,0,0,0|3,0,0]=4 267 B10R1.61 CC(C1=NC=CC=C1Cl)=O AK128527 [0,1,0,0,0,0|3,0,0]=4 268 B10R1.61 CC(C1=NC=CC=C1O)=O AK-57786 [0,1,0,0,0,0|3,0,0]=4 269 B10R1.61 CC(N)C1=CC=CC=C1Br AK548207 [0,1,0,0,0,0|2,0,1]=4 270 B10R1.61 CC(N)C1=CC=CC=C1Cl AK-78769 [0,1,0,0,0,0|2,0,1]=4 271 B10R1.61 CC(N)C1=CC=CC=C1Cl AK133214 [0,1,0,0,0,0|2,0,1]=4 272 B10R1.61 CC(N)C1=CC=CC=C1F AK-78757 [0,1,0,0,0,0|2,0,1]=4 273 B10R1.61 CC(O)C1=CC=CN=C1Cl AK118779 [0,1,0,0,0,0|1,0,2]=4 274 B10R1.61 CC1=C(C(=O)N)C=CC=N1 AK-39636 [0,1,0,0,0,0|0,0,0]=1 275 B10R1.61 CC1=C(C(=O)O)C=CC=N1 AK-25768 [0,1,0,0,0,0|1,0,0]=2 276 B10R1.61 CC1=C(C=NC=C1)[N+]([O-])=O AK104739 [0,1,0,0,0,0|2,0,0]=3 277 B10R1.61 CC1=C(C=NC=N1)C(O)=O AK-32530 [0,1,0,0,0,0|2,0,0]=3 278 B10R1.61 CC1=NC=CC=C1B(O)O AK142095 [0,1,0,0,0,0|2,0,1]=4 279 B10R1.61 CC1=NC=CC=C1N(=O)=O AK-26710 [0,1,0,0,0,0|2,0,0]=3 280 B10R1.61 CC1=NC=CN=C1C(=O)O AK-25946 [0,1,0,0,0,0|2,0,0]=3 281 B10R1.61 C[C@@H](N)C1=CC=CC=C1Br AK114068 [0,1,0,0,0,0|2,0,1]=4 282 B10R1.61 C[C@@H](N)C1=CC=CC=C1Br AK155333 [0,1,0,0,0,0|2,0,1]=4 283 B10R1.61 C[C@@H](N)C1=CC=CC=C1C AK-45079 [0,1,0,0,0,0|2,0,1]=4 284 B10R1.61 C[C@@H](N)C1=CC=CC=C1Cl AK-42131 [0,1,0,0,0,0|2,0,1]=4 285 B10R1.61 C[C@@H](N)C1=CC=CC=C1F AK-33841 [0,1,0,0,0,0|2,0,1]=4 286 B10R1.61 C[C@H](N)C1=CC=CC=C1Br AK-59163 [0,1,0,0,0,0|2,0,1]=4 287 B10R1.61 C[C@H](N)C1=CC=CC=C1Br AK174547 [0,1,0,0,0,0|2,0,1]=4 288 B10R1.61 C[C@H](N)C1=CC=CC=C1C AK162902 [0,1,0,0,0,0|2,0,1]=4 289 B10R1.61 C[C@H](N)C1=CC=CC=C1F AK-36100 [0,1,0,0,0,0|2,0,1]=4 290 B10R1.61 C[C@H](N)C1=CC=CC=C1F AK162903 [0,1,0,0,0,0|2,0,1]=4 291 B10R1.61 ClC1=C(C(=O)O)C=CN=C1 AK-26411 [0,1,0,0,0,0|3,0,0]=4 292 B10R1.61 ClC1=CC=CN=C1C(=O)O AK-23699 [0,1,0,0,0,0|3,0,0]=4 293 B10R1.61 ClC1=CC=NC=C1C(=O)O AK-25252 [0,1,0,0,0,0|1,0,0]=2 294 B10R1.61 ClC1=NC=CC=C1B(O)O AK-29980 [0,1,0,0,0,0|2,0,1]=4 295 B10R1.61 ClC1=NC=CN=C1C(=O)O AK-24100 [0,1,0,0,0,0|2,0,0]=3 296 B10R1.61 FC1=C(C(=N)N)C=CC=C1 AK-16801-8 [0,1,0,0,0,0|2,0,0]=3 297 B10R1.61 FC1=C(C=CN=C1)C(C)=O AK-37142 [0,1,0,0,0,0|3,0,0]=4 298 B10R1.61 FC1=C(N=CC=C1)C(=O)O AK-28801 [0,1,0,0,0,0|3,0,0]=4 299 B10R1.61 FC1=NC=CC=C1[N+](=O)[O-] AK-33351 [0,1,0,0,0,0|2,0,0]=3 300 B10R1.61 N=C(N)C1=NC=CC=C1C AK130359 [0,1,0,0,0,0|3,0,0]=4 301 B10R1.61 NC(C1=CC=CC=C1Br)C AK-50562 [0,1,0,0,0,0|2,0,1]=4 302 B10R1.61 NC1=C(C(C)C)C=NC=C1 AK349169 [0,1,0,0,0,0|2,0,1]=4 303 B10R1.61 NC1=C(C=CN=N1)C(=O)O AK-24603 [0,1,0,0,0,0|2,0,0]=3 304 B10R1.61 NC1=C(C=NC=C1)C(=O)N AK-29493 [0,1,0,0,0,0|0,0,0]=1 305 B10R1.61 NC1=C(C=NC=C1)C(O)=O AK-27731 [0,1,0,0,0,0|1,0,0]=2 306 B10R1.61 N[C@@H](C1=CC=CC=C1F)C AK-42098 [0,1,0,0,0,0|2,0,1]=4 307 B10R1.61 O=C(C1=CN=CN=C1N)O AK-34045 [0,1,0,0,0,0|2,0,0]=3 308 B10R1.61 O=C(C1=CN=CN=C1O)N AK343645 [0,1,0,0,0,0|1,0,0]=2 309 B10R1.61 O=C(C1=CN=CNC1=O)O AK-39341 [0,1,0,0,0,0|2,0,0]=3 310 B10R1.61 O=C(C1=NC=CC=C1N)O AK-25432 [0,1,0,0,0,0|3,0,0]=4 311 B10R1.61 O=C(C1=NC=CN=C1Cl)N AK-80835 [0,1,0,0,0,0|1,0,0]=2 312 B10R1.61 O=C(C1=NC=CN=C1I)O AK-30598 [0,1,0,0,0,0|2,0,0]=3 313 B10R1.61 O=C(C1=NC=CN=C1O)N AK-39215 [0,1,0,0,0,0|1,0,0]=2 314 B10R1.61 O=C(C1=NC=CNC1=O)O AK-30536 [0,1,0,0,0,0|2,0,1]=4 315 B10R1.61 O=C(N)C1=CC=CC=C1Br AK-47071 [0,1,0,0,0,0|1,0,0]=2 316 B10R1.61 O=C(N)C1=CC=CC=C1Cl AK128986 [0,1,0,0,0,0|1,0,0]=2 317 B10R1.61 O=C(N)C1=CC=CC=C1F AK161780 [0,1,0,0,0,0|1,0,0]=2 318 B10R1.61 O=C(N)C1=CC=CC=C1I AK115884 [0,1,0,0,0,0|1,0,0]=2 319 B10R1.61 O=C(N)C1=CC=CC=C1N AK109256 [0,1,0,0,0,0|1,0,0]=2 320 B10R1.61 O=C(N)C1=CC=NC=C1C AK-29933 [0,1,0,0,0,0|2,0,0]=3 321 B10R1.61 O=C(N)C1=CC=NC=C1N AK-77290 [0,1,0,0,0,0|2,0,0]=3 322 B10R1.61 O=C(N)C1=NC=CC=C1C AK-48603 [0,1,0,0,0,0|2,0,0]=3 323 B10R1.61 O=C(N)C1=NC=CC=C1N AK-35369 [0,1,0,0,0,0|2,0,0]=3 324 B10R1.61 O=C(O)C1=C(N)N=CC=C1 AK-26982 [0,1,0,0,0,0|1,0,0]=2 325 B10R1.61 O=C(O)C1=C(S)N=CC=C1 AK-48961 [0,1,0,0,0,0|1,0,0]=2 326 B10R1.61 O=C(O)C1=CC=CC=C1Br AK-77301 [0,1,0,0,0,0|2,0,0]=3 327 B10R1.61 O=C(O)C1=CC=CC=C1C AK116916 [0,1,0,0,0,0|2,0,0]=3 328 B10R1.61 O=C(O)C1=CC=CC=C1Cl AK-44481 [0,1,0,0,0,0|2,0,0]=3 329 B10R1.61 O=C(O)C1=CC=CC=C1I AK-73132 [0,1,0,0,0,0|2,0,0]=3 330 B10R1.61 O=C(O)C1=CC=NC=C1C AK-30383 [0,1,0,0,0,0|3,0,0]=4 331 B10R1.61 O=C(O)C1=CC=NC=C1N AK-23678 [0,1,0,0,0,0|3,0,0]=4 332 B10R1.61 O=C(O)C1=CC=NC=C1O AK-23523 [0,1,0,0,0,0|3,0,0]=4 333 B10R1.61 O=C(O)C1=CN=CC=C1Br AK-25100 [0,1,0,0,0,0|1,0,0]=2 334 B10R1.61 O=C(O)C1=CN=CC=C1C AK-75600 [0,1,0,0,0,0|1,0,0]=2 335 B10R1.61 O=C(O)C1=NC=CC=C1I AK-29488 [0,1,0,0,0,0|3,0,0]=4 336 B10R1.61 O=C(O)C1=NC=CC=C1O AK-26380 [0,1,0,0,0,0|3,0,0]=4 337 B10R1.61 O=C1C(=CC=CN1)C(O)=O AK-47329 [0,1,0,0,0,0|1,0,1]=3 338 B10R1.61 O=C1C(=CNC=C1)C(=O)O AK-26174 [0,1,0,0,0,0|1,0,1]=3 339 B10R1.61 O=C1C(=CNC=C1)[N+](=O)[O-] AK-25459 [0,1,0,0,0,0|2,0,1]=4 340 B10R1.61 O=C1C(C(C)=O)=CC=CN1 AK-35911 [0,1,0,0,0,0|1,0,1]=3 341 B10R1.61 O=C1C(C(C)=O)=CNC=C1 AK501394 [0,1,0,0,0,0|1,0,1]=3 342 B10R1.61 O=[N+](C1=C(Br)C=CN=C1)[O-] AK-34243 [0,1,0,0,0,0|2,0,0]=3 343 B10R1.61 O=[N+](C1=C(C)C=CN=C1)[O-] AK-28081 [0,1,0,0,0,0|2,0,0]=3 344 B10R1.61 O=[N+](C1=C(N)C=CN=C1)[O-] AK-28863 [0,1,0,0,0,0|2,0,0]=3 345 B10R1.61 O=[N+](C1=CC=CN=C1C)[O-] AK-23642 [0,1,0,0,0,0|2,0,0]=3 346 B10R1.61 O=[N+](C1=CC=CN=C1Cl)[O-] AK-27005 [0,1,0,0,0,0|2,0,0]=3 347 B10R1.61 O=[N+](C1=NC=CN=C1Cl)[O-] AK-27354 [0,1,0,0,0,0|3,0,0]=4 348 B10R1.61 OB(C1=CC=CN=C1Br)O AK-27205 [0,1,0,0,0,0|2,0,1]=4 349 B10R1.61 OB(C1=CC=CN=C1F)O AK-27647 [0,1,0,0,0,0|2,0,1]=4 350 B10R1.61 OC(=O)C1=CC=CN=C1Br AK-25846 [0,1,0,0,0,0|1,0,0]=2 351 B10R1.61 OC(=O)C1=CC=NNC1=O AK-89567 [0,1,0,0,0,0|2,0,1]=4 352 B10R1.61 OC1=CC=CC=C1C(N)=O AK-81394 [0,1,0,0,0,0|1,0,0]=2 353 B10R1.61 OC1=CC=CC=C1C(O)=O AK397674 [0,1,0,0,0,0|2,0,0]=3 354 B10R1.61 SC1=NC=CC=C1[N+]([O-])=O AK-49743 [0,1,0,0,0,0|2,0,0]=3 355 B10R1.61 [O-]C1=CC=CC=C1[N+]([O-])=O AK135512 [0,1,0,0,0,0|3,0,0]=4 356 B10R1.113 BrC1=CC(=CN=C1)C(=C)C AK-40102 [0,1,0,0,0,0|2,0,0]=3 357 B10R1.113 BrC1=CC(=CN=C1)[N+](=O)[O-] AK-24340 [0,1,0,0,0,0|2,0,0]=3 358 B10R1.113 C(C)(=O)C1=CC(=CN=C1)Br AK-25899 [0,1,0,0,0,0|1,0,0]=2 359 B10R1.113 C(C)(=O)C1=CC(=NC=C1)C AK-26955 [0,1,0,0,0,0|3,0,0]=4 360 B10R1.113 C(C)(=O)C1=NC(=CC=C1)Br AK-30565 [0,1,0,0,0,0|3,0,0]=4 361 B10R1.113 C1=C(C(C)=O)C=C(C=C1)O AK-46681 [0,1,0,0,0,0|2,0,0]=3 362 B10R1.113 C1=C(C=C(C=N1)B(O)O)C AK-27227 [0,1,0,0,0,0|2,0,1]=4 363 B10R1.113 C1=C(C=C(N=C1)N)C(=O)O AK-25375 [0,1,0,0,0,0|3,0,0]=4 364 B10R1.113 C1=C(C=CC=C1Cl)C(O)=O AK-43975 [0,1,0,0,0,0|2,0,0]=3 365 B10R1.113 C1=C(C=CC=C1F)C(O)=O AK-53854 [0,1,0,0,0,0|2,0,0]=3 366 B10R1.113 C1=C(C=NC=C1Br)C(N)=O AK-34529 [0,1,0,0,0,0|0,0,0]=1 367 B10R1.113 C1=C(C=NC=C1C(O)=O)F AK-25931 [0,1,0,0,0,0|1,0,0]=2 368 B10R1.113 C1=C(C=NC=C1C)C(O)=O AK-23837 [0,1,0,0,0,0|1,0,0]=2 369 B10R1.113 C1=C(C=NC=C1Cl)C(O)=O AK-25160 [0,1,0,0,0,0|1,0,0]=2 370 B10R1.113 C1=CC=C(F)N=C1C(=O)O AK-30385 [0,1,0,0,0,0|3,0,0]=4 371 B10R1.113 C1=CC=C(N=C1C(O)=O)C AK-27736 [0,1,0,0,0,0|3,0,0]=4 372 B10R1.113 C1=NC=C(C=C1C(=O)N)N AK-26169 [0,1,0,0,0,0|0,0,0]=1 373 B10R1.113 C1=NC=C(Cl)N=C1C(=O)O AK-27777 [0,1,0,0,0,0|2,0,0]=3 374 B10R1.113 C1=NC=C(N=C1C(=O)O)C AK-26120 [0,1,0,0,0,0|2,0,0]=3 375 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 AK-34279 [0,1,0,0,0,0|3,0,0]=4 376 B10R1.113 CC(C1=CC(F)=CN=C1)=O AK101043 [0,1,0,0,0,0|1,0,0]=2 377 B10R1.113 CC(C1=CC(N)=NC=C1)=O AK134215 [0,1,0,0,0,0|3,0,0]=4 378 B10R1.113 CC(C1=CC=CC(Br)=C1)=O AK-44590 [0,1,0,0,0,0|2,0,0]=3 379 B10R1.113 CC(C1=CC=CC(C)=C1)=O AK143347 [0,1,0,0,0,0|2,0,0]=3 380 B10R1.113 CC(C1=NC(Cl)=CC=C1)=O AK-29671 [0,1,0,0,0,0|3,0,0]=4 381 B10R1.113 CC(C1=NC(F)=CC=C1)=O AK-74181 [0,1,0,0,0,0|3,0,0]=4 382 B10R1.113 CC(C1=NC=CC(C)=C1)=O AK-61872 [0,1,0,0,0,0|3,0,0]=4 383 B10R1.113 CC(C1=NC=CC(Cl)=C1)=O AK-30041 [0,1,0,0,0,0|3,0,0]=4 384 B10R1.113 CC(N)C1=CC=CC(C)=C1 AK-95787 [0,1,0,0,0,0|2,0,1]=4 385 B10R1.113 CC1=CC=CC(=C1)C(N)=N AK-45199 [0,1,0,0,0,0|2,0,0]=3 386 B10R1.113 CC1=CC=CC(C(C)=O)=N1 AK-30134 [0,1,0,0,0,0|3,0,0]=4 387 B10R1.113 CC1=CC=NC(=C1)C(=O)O AK-30381 [0,1,0,0,0,0|3,0,0]=4 388 B10R1.113 C[C@@H](C1=CC=CC(N)=C1)N AK326677 [0,1,0,0,0,0|2,0,1]=4 389 B10R1.113 C[C@@H](N)C1=CC(Cl)=CN=C1 AK668419 [0,1,0,0,0,0|1,0,1]=3 390 B10R1.113 C[C@@H](N)C1=CC=CC(Br)=C1 AK-33750 [0,1,0,0,0,0|2,0,1]=4 391 B10R1.113 C[C@@H](N)C1=CC=CC(Br)=C1 AK338979 [0,1,0,0,0,0|2,0,1]=4 392 B10R1.113 C[C@@H](N)C1=CC=CC(C)=C1 AK-45077 [0,1,0,0,0,0|2,0,1]=4 393 B10R1.113 C[C@@H](N)C1=CC=CC(C)=C1 AK133442 [0,1,0,0,0,0|2,0,1]=4 394 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 AK-29516 [0,1,0,0,0,0|2,0,1]=4 395 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 AK335908 [0,1,0,0,0,0|1,0,1]=3 396 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 AK-33217 [0,1,0,0,0,0|2,0,1]=4 397 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 AK338984 [0,1,0,0,0,0|2,0,1]=4 398 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 AK-35182 [0,1,0,0,0,0|2,0,1]=4 399 B10R1.113 ClC1=CC(=CN=C1)N(=O)=O AK-23519 [0,1,0,0,0,0|2,0,0]=3 400 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 AK-16801-7 [0,1,0,0,0,0|2,0,0]=3 401 B10R1.113 N=C(N)C1=NC=CC(C)=C1 AK130218 [0,1,0,0,0,0|3,0,0]=4 402 B10R1.113 NC(=O)C1=CN=CC(Cl)=N1 AK-39096 [0,1,0,0,0,0|1,0,0]=2 403 B10R1.113 NC1=CC(C(C)=O)=CC=C1 AK-83273 [0,1,0,0,0,0|2,0,0]=3 404 B10R1.113 NC1=CC=NC(=C1)C(=O)O AK-72771 [0,1,0,0,0,0|3,0,0]=4 405 B10R1.113 NC1=CN=CC(=C1)B(O)O AK-75513 [0,1,0,0,0,0|2,0,1]=4 406 B10R1.113 NC1=CN=CC(=C1)C(O)=O AK-34306 [0,1,0,0,0,0|1,0,0]=2 407 B10R1.113 NC1=CN=CC(=N1)C(=O)O AK-30537 [0,1,0,0,0,0|2,0,0]=3 408 B10R1.113 NC1=CN=CC(B(O)O)=C1 AK-32936 [0,1,0,0,0,0|2,0,1]=4 409 B10R1.113 N[C@@H](C1=CC=CC(F)=C1)C AK-45028 [0,1,0,0,0,0|2,0,1]=4 410 B10R1.113 N[C@H](C1=CC=CC(F)=C1)C AK-42995 [0,1,0,0,0,0|2,0,1]=4 411 B10R1.113 O=C(C1=CC=CC(Cl)=N1)O AK-26005 [0,1,0,0,0,0|3,0,0]=4 412 B10R1.113 O=C(C1=CC=CC(N1)=O)O AK-25557 [0,1,0,0,0,0|3,0,0]=4 413 B10R1.113 O=C(C1=NC(Br)=CN=C1)O AK158200 [0,1,0,0,0,0|2,0,0]=3 414 B10R1.113 O=C(C1=NC(Cl)=NC=C1)N AK107035 [0,1,0,0,0,0|3,0,0]=4 415 B10R1.113 O=C(C1=NC(N)=NC=C1)N AK145739 [0,1,0,0,0,0|3,0,0]=4 416 B10R1.113 O=C(C1=NC=CC(Br)=C1)O AK-23753 [0,1,0,0,0,0|3,0,0]=4 417 B10R1.113 O=C(C1=NN=CC(Cl)=C1)O AK398901 [0,1,0,0,0,0|2,0,0]=3 418 B10R1.113 O=C(C=1C=CNC(C1)=O)O AK-75663 [0,1,0,0,0,0|3,0,0]=4 419 B10R1.113 O=C(C=1C=CNC(C1)=S)O AK161760 [0,1,0,0,0,0|3,0,0]=4 420 B10R1.113 O=C(N)C1=CC=CC(Br)=C1 AK-61366 [0,1,0,0,0,0|1,0,0]=2 421 B10R1.113 O=C(N)C1=NC=CC(N)=C1 AK103735 [0,1,0,0,0,0|2,0,0]=3 422 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 AK-77039 [0,1,0,0,0,0|2,0,0]=3 423 B10R1.113 O=C(O)C1=CC=CC(C)=C1 AK116994 [0,1,0,0,0,0|2,0,0]=3 424 B10R1.113 O=C(O)C1=CC=CC(I)=C1 AK-40488 [0,1,0,0,0,0|2,0,0]=3 425 B10R1.113 O=C(O)C1=CC=CC(N)=C1 AK-41177 [0,1,0,0,0,0|2,0,0]=3 426 B10R1.113 O=C(O)C1=CC=CC(O)=C1 AK-50288 [0,1,0,0,0,0|2,0,0]=3 427 B10R1.113 O=C(O)C1=CC=NC(Br)=C1 AK-26241 [0,1,0,0,0,0|3,0,0]=4 428 B10R1.113 O=C(O)C1=CC=NC(C)=C1 AK-23516 [0,1,0,0,0,0|3,0,0]=4 429 B10R1.113 O=C(O)C1=CC=NC(O)=C1 AK-27187 [0,1,0,0,0,0|3,0,0]=4 430 B10R1.113 O=C(O)C1=CN=CC(Br)=C1 AK-25583 [0,1,0,0,0,0|1,0,0]=2 431 B10R1.113 O=C(O)C1=CN=CC(I)=C1 AK-28811 [0,1,0,0,0,0|1,0,0]=2 432 B10R1.113 O=C(O)C1=CN=CC(O)=C1 AK-25698 [0,1,0,0,0,0|1,0,0]=2 433 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 AK-23768 [0,1,0,0,0,0|3,0,0]=4 434 B10R1.113 O=C(O)C1=NC=CC(I)=C1 AK-30405 [0,1,0,0,0,0|3,0,0]=4 435 B10R1.113 O=C1NN=CC(=C1)C(=O)O AK-26372 [0,1,0,0,0,0|2,0,0]=3 436 B10R1.113 OB(C1=CC(F)=CN=C1)O AK-36635 [0,1,0,0,0,0|2,0,1]=4 437 B10R1.113 OB(O)C1=CC(Cl)=CN=C1 AK-26378 [0,1,0,0,0,0|2,0,1]=4 438 B10R1.113 OC(=O)C1=CC(Cl)=NC=C1 AK-26209 [0,1,0,0,0,0|3,0,0]=4 439 B10R1.113 OC(=O)C1=CC(F)=NC=C1 AK-25930 [0,1,0,0,0,0|3,0,0]=4 440 B10R1.113 OC(=O)C1=NC(Br)=CC=C1 AK-25597 [0,1,0,0,0,0|3,0,0]=4 441 B10R1.113 OC1=CC([N+]([O-])=O)=CN=C1 AK-28936 [0,1,0,0,0,0|2,0,0]=3 442 B10R1.113 OC1=CC=CC([C@H](N)C)=C1 AK-77840 [0,1,0,0,0,0|2,0,1]=4 443 B10R1.113 [N+](=O)([O-])C1=CN=CC(=C1)N AK-29617 [0,1,0,0,0,0|2,0,0]=3 444 B10R1.113 [O-][N+](=O)C1=CN=CC(F)=C1 AK100223 [0,1,0,0,0,0|2,0,0]=3 445 B10R2.320 C1=CC=CC2=C1CC2=O AK-72898 [0,0,0,1,0,0|2,0,0]=3 446 B8R1.7 C1=C(C(=O)O)[NH]C=N1 AK-25282 [0,0,0,0,1,0|2,0,0]=3 447 B8R1.7 C1=C([N+]([O-])=O)[NH]C=N1 AK-34599 [0,0,0,0,1,0|3,0,0]=4 448 B8R1.7 C1=C([N+]([O-])=O)[NH]N=C1 AK-27124 [0,0,0,0,1,0|3,0,0]=4 449 B8R1.7 C1=CC=N[N]1[N+](=O)[O-] AK-50064 [0,0,0,0,1,0|3,0,0]=4 450 B8R1.7 C1=COC=C1C(O)=O AK-32276 [0,0,0,0,1,0|2,0,0]=3 451 B8R1.7 C1=CSC(=N1)C(C)=O AK-46781 [0,0,0,0,1,0|2,0,0]=3 452 B8R1.7 C1=NC=C(S1)C(=O)O AK-27761 [0,0,0,0,1,0|2,0,0]=3 453 B8R1.7 C1=N[NH]C=C1C(O)=O AK-25877 [0,0,0,0,1,0|2,0,0]=3 454 B8R1.7 C1=N[NH]C=C1[N+]([O-])=O AK-23786 [0,0,0,0,1,0|3,0,0]=4 455 B8R1.7 CC(=O)C1=CC=CN1 AK-53458 [0,0,0,0,1,0|1,0,1]=3 456 B8R1.7 CC(=O)C1=CC=NO1 AK-68495 [0,0,0,0,1,0|2,0,0]=3 457 B8R1.7 CC(=O)C1=CSC=C1 AK-44537 [0,0,0,0,1,0|2,0,0]=3 458 B8R1.7 CC(N)C1=NC=CS1 AK-77903 [0,0,0,0,1,0|2,0,1]=4 459 B8R1.7 CC(N)C1=NC=CS1 AK-77904 [0,0,0,0,1,0|2,0,1]=4 460 B8R1.7 C[C@@H](N)C1=NC=CS1 AK153996 [0,0,0,0,1,0|2,0,1]=4 461 B8R1.7 C[C@H](N)C1=CC=CO1 AK544263 [0,0,0,0,1,0|2,0,1]=4 462 B8R1.7 C[C@H](N)C1=CC=CS1 AK486945 [0,0,0,0,1,0|2,0,1]=4 463 B8R1.7 C[C@H](N)C1=NC=CS1 AK153993 [0,0,0,0,1,0|2,0,1]=4 464 B8R1.7 N=C(C1=NC=CS1)N AK-78239 [0,0,0,0,1,0|2,0,0]=3 465 B8R1.7 N=C(N1N=CC=C1)N AK-27720 [0,0,0,0,1,0|2,0,0]=3 466 B8R1.7 N=C(N1N=CN=C1)N AK-88472 [0,0,0,0,1,0|3,0,0]=4 467 B8R1.7 NC(=O)C1=COC=N1 AK-99961 [0,0,0,0,1,0|1,0,0]=2 468 B8R1.7 NC(=O)C1=NC=NN1 AK-32575 [0,0,0,0,1,0|2,0,0]=3 469 B8R1.7 O1C=CC(=N1)C(=O)O AK-27692 [0,0,0,0,1,0|2,0,0]=3 470 B8R1.7 O1N=CC(=N1)C(=O)O AK-32069 [0,0,0,0,1,0|3,0,0]=4 471 B8R1.7 O=C(C1=CC=CN1)O AK-44225 [0,0,0,0,1,0|1,0,1]=3 472 B8R1.7 O=C(C1=CC=CO1)O AK-72863 [0,0,0,0,1,0|2,0,0]=3 473 B8R1.7 O=C(C1=CC=CS1)[O-] AK110095 [0,0,0,0,1,0|2,0,0]=3 474 B8R1.7 O=C(C1=CC=NO1)O AK-25596 [0,0,0,0,1,0|2,0,0]=3 475 B8R1.7 O=C(C1=CC=NS1)O AK-94814 [0,0,0,0,1,0|2,0,0]=3 476 B8R1.7 O=C(C1=CN=CO1)O AK-28732 [0,0,0,0,1,0|2,0,0]=3 477 B8R1.7 O=C(C1=CNC=C1)C AK-45953 [0,0,0,0,1,0|1,0,1]=3 478 B8R1.7 O=C(C1=CNC=N1)C AK-45163 [0,0,0,0,1,0|2,0,0]=3 479 B8R1.7 O=C(C1=COC=N1)O AK-29026 [0,0,0,0,1,0|2,0,0]=3 480 B8R1.7 O=C(C1=CSC=C1)O AK-46373 [0,0,0,0,1,0|2,0,0]=3 481 B8R1.7 O=C(C1=CSC=N1)O AK-23931 [0,0,0,0,1,0|2,0,0]=3 482 B8R1.7 O=C(C1=CSN=C1)O AK-84534 [0,0,0,0,1,0|2,0,0]=3 483 B8R1.7 O=C(C1=NC=CN1)N AK139797 [0,0,0,0,1,0|1,0,0]=2 484 B8R1.7 O=C(C1=NC=CO1)[O-] AK-93393 [0,0,0,0,1,0|2,0,0]=3 485 B8R1.7 O=C(C1=NNC=C1)N AK-27992 [0,0,0,0,1,0|1,0,0]=2 486 B8R1.7 O=C(C1=NNC=C1)O AK-29904 [0,0,0,0,1,0|2,0,0]=3 487 B8R1.7 O=[N+](C1=CC=CN1)[O-] AK-77322 [0,0,0,0,1,0|2,0,1]=4 488 B8R1.7 O=[N+](C1=NC=CN1)[O-] AK-28550 [0,0,0,0,1,0|3,0,0]=4 489 B8R1.7 OC(=O)C1=CNC=C1 AK-26450 [0,0,0,0,1,0|1,0,1]=3 490 B8R1.7 OC(=O)C1=CNN=N1 AK-28855 [0,0,0,0,1,0|3,0,0]=4 491 B8R1.7 S1C=C(N=C1)C(C)=O AK-39395 [0,0,0,0,1,0|2,0,0]=3 492 B8R1.7 S1C=CN=C1C(=O)O AK-21895 [0,0,0,0,1,0|2,0,0]=3 493 B8R1.7 S=C(C1=CC=CS1)N AK-40144 [0,0,0,0,1,0|1,1,0]=3 494 B8R1.7 [N+](=O)([O-])C1=CON=C1 AK-24625 [0,0,0,0,1,0|3,0,0]=4 495 B8R1.7 [NH]1C=CN=C1C(=O)O AK-27693 [0,0,0,0,1,0|2,0,0]=3 496 B8R1.7 [O-]C(=O)C1=CC=CS1 AK111442 [0,0,0,0,1,0|2,0,0]=3 497 B8R1.7 [O-][N+](=O)C1=CNC=C1 AK-82340 [0,0,0,0,1,0|2,0,1]=4 498 B10R1.18 C1=C(C=CN=C1)CC(C)=O AK-47657 [0,0,0,0,0,1|3,0,0]=4 499 B10R1.18 C1=C(C=CN=C1)CC(O)=O AK-45111 [0,0,0,0,0,1|3,0,0]=4 500 B10R1.18 C1=NC=CC=C1CC(O)=O AK-26036 [0,0,0,0,0,1|1,0,0]=2 501 B10R1.18 CC(CC1=NC=CC=C1)=O AK-32596 [0,0,0,0,0,1|3,0,0]=4 502 B10R1.18 CC(OC1=CC=CN=C1)C AK167273 [0,0,0,0,0,1|2,0,1]=4 503 B10R1.18 C\C(C)=C/C1=CC=CC=C1 AK113914 [0,0,0,0,0,1|3,0,0]=4 504 B10R1.18 N1=CN=CC(=C1)CC(=O)O AK-32588 [0,0,0,0,0,1|2,0,0]=3 505 B10R1.18 N=C(N)CC1=CC=CC=C1 AK-77604 [0,0,0,0,0,1|2,0,0]=3 506 B10R1.18 NC(NC1=CC=CC=C1)=N AK117130 [0,0,0,0,0,1|2,0,0]=3 507 B10R1.18 O=C(N)CC1=CC=CC=C1 AK-45803 [0,0,0,0,0,1|1,0,0]=2 508 B10R1.18 O=C(N)CC1=CC=CN=C1 AK-81612 [0,0,0,0,0,1|0,0,0]=1 509 B10R1.18 O=C(N)CC1=NC=CC=N1 AK133068 [0,0,0,0,0,1|3,0,0]=4 510 B10R1.18 O=C(N)NC1=NC=CN=C1 AK321494 [0,0,0,0,0,1|1,0,0]=2 511 B10R1.18 O=C(O)CC1=CC=CN=C1 AK-26773 [0,0,0,0,0,1|1,0,0]=2 512 B10R1.18 OC(=N)NC1=CC=CC=C1 AK-65147 [0,0,0,0,0,1|1,0,2]=4 513 B10R1.18 OC(=O)CC1=CC=CC=N1 AK-45110 [0,0,0,0,0,1|3,0,0]=4 514 B10R1.18 S=C(Cl)OC1=CC=CC=C1 AK163079 [0,0,0,0,0,1|2,1,0]=4 515 B10R1.18 S=C(N)NC1=CC=CC=C1 AK305328 [0,0,0,0,0,1|1,1,0]=3 516 B10R1.18 S=C(N)NC1=NC=CC=C1 AK158972 [0,0,0,0,0,1|2,1,0]=4 517 B10R1.18 S=C(N)NC1=NC=CN=C1 AK323308 [0,0,0,0,0,1|1,1,0]=3 518 B7R0.4 C\C=C\C=C\C([O-])=O AK-47286 [1,0,1,0,0,0|1,0,1]=4 519 B7R1.3 BrC1=NC=CN=C1 AK-21911 [2,0,0,0,0,0|2,0,0]=4 520 B7R1.3 C1=C(C)C=NC=N1 AK-30562 [2,0,0,0,0,0|1,0,1]=4 521 B7R1.3 C1=C(C)C=NN=C1 AK-30760 [2,0,0,0,0,0|1,0,1]=4 522 B7R1.3 C1=C(C=NC=N1)N AK-23967 [2,0,0,0,0,0|1,0,0]=3 523 B7R1.3 C1=C(C=NN=C1)N AK-23741 [2,0,0,0,0,0|1,0,0]=3 524 B7R1.3 C1=CC=NN=C1N AK-21777 [2,0,0,0,0,0|1,0,0]=3 525 B7R1.3 C1=CC=NN=C1N AK-23968 [2,0,0,0,0,0|1,0,0]=3 526 B7R1.3 C1=NC=NC=C1Br AK-46790 [2,0,0,0,0,0|2,0,0]=4 527 B7R1.3 CC1=CN=CC=N1 AK-88672 [2,0,0,0,0,0|1,0,1]=4 528 B7R1.3 ClC1=CC=NN=C1 AK-76794 [2,0,0,0,0,0|2,0,0]=4 529 B7R1.3 ClC1=CN=CN=C1 AK-26627 [2,0,0,0,0,0|2,0,0]=4 530 B7R1.3 FC1=CN=CN=C1 AK-30119 [2,0,0,0,0,0|2,0,0]=4 531 B7R1.3 IC1=CC=CC=C1 AK-88660 [2,0,0,0,0,0|2,0,0]=4 532 B7R1.3 IC1=CC=CN=C1 AK-46371 [2,0,0,0,0,0|1,0,0]=3 533 B7R1.3 IC1=CN=CC=N1 AK-23638 [2,0,0,0,0,0|2,0,0]=4 534 B7R1.3 IC1=CN=CN=C1 AK-24277 [2,0,0,0,0,0|2,0,0]=4 535 B7R1.3 NC1=CC=NN=C1 AK170584 [2,0,0,0,0,0|1,0,0]=3 536 B7R1.3 NC1=NC=CN=C1 AK-24896 [2,0,0,0,0,0|1,0,0]=3 537 B7R1.3 NC1=NC=CN=N1 AK-39292 [2,0,0,0,0,0|2,0,0]=4 538 B7R1.3 O=C1C=CC=NN1 AK-29318 [2,0,0,0,0,0|1,0,0]=3 539 B7R1.3 O=C1C=COC=C1 AK110934 [2,0,0,0,0,0|2,0,0]=4 540 B7R1.3 O=C1NC=CN=C1 AK-24500 [2,0,0,0,0,0|1,0,0]=3 541 B7R1.3 OC1=CC=CN=C1 AK-44238 [2,0,0,0,0,0|0,0,1]=3 542 B7R1.3 OC1=CN=CN=C1 AK-28351 [2,0,0,0,0,0|1,0,1]=4 543 B7R1.3 OC1=CN=NC=C1 AK-28962 [2,0,0,0,0,0|1,0,1]=4 544 B7R1.3 [S-]C1=CC=CC=C1 AK316593 [2,0,0,0,0,0|1,1,0]=4 545 B9R1.1 BrC1=NC=C(C=C1)OC AK-25274 [1,1,0,0,0,0|2,0,0]=4 546 B9R1.1 BrCC1=CN=C(C=C1)Cl AK-28919 [1,1,0,0,0,0|1,0,1]=4 547 B9R1.1 C1=C(C=CC(=C1)CN)O AK-47356 [1,1,0,0,0,0|1,0,1]=4 548 B9R1.1 C1=C(C=CC(=C1)I)C=O AK-75599 [1,1,0,0,0,0|1,0,0]=3 549 B9R1.1 C1=C(C=NC(=C1)Br)C#N AK-25408 [1,1,0,0,0,0|0,0,2]=4 550 B9R1.1 C1=C(C=NC(=C1)Cl)C#N AK-25783 [1,1,0,0,0,0|0,0,2]=4 551 B9R1.1 C1=C(N=CC(=C1)C#N)C AK-25767 [1,1,0,0,0,0|0,0,2]=4 552 B9R1.1 C1=C(NN)C=CC(=C1)C AK-47398 [1,1,0,0,0,0|2,0,0]=4 553 B9R1.1 C1=CC(=NC=C1CO)Cl AK-28987 [1,1,0,0,0,0|0,0,2]=4 554 B9R1.1 C1=NC(=CC=C1C=O)Br AK-25442 [1,1,0,0,0,0|0,0,0]=2 555 B9R1.1 C1=NC(=CC=C1C=O)Cl AK-25624 [1,1,0,0,0,0|0,0,0]=2 556 B9R1.1 C1=NC(=NC=C1C=O)N AK-28546 [1,1,0,0,0,0|1,0,0]=3 557 B9R1.1 CC1=CC=C(C=O)C=C1 AK-65210 [1,1,0,0,0,0|1,0,0]=3 558 B9R1.1 CC1=CC=C(CO)C=N1 AK-78311 [1,1,0,0,0,0|0,0,2]=4 559 B9R1.1 CC1=CN=C(C=C1)C=O AK-35332 [1,1,0,0,0,0|2,0,0]=4 560 B9R1.1 CC1=NC=C(C=C1)C=O AK-26076 [1,1,0,0,0,0|0,0,0]=2 561 B9R1.1 CC1=NC=C(CBr)C=C1 AK139052 [1,1,0,0,0,0|1,0,1]=4 562 B9R1.1 CC1=NC=C(CCl)C=C1 AK123163 [1,1,0,0,0,0|1,0,1]=4 563 B9R1.1 CCC1=CN=C(Cl)C=C1 AK-48582 [1,1,0,0,0,0|1,0,1]=4 564 B9R1.1 COC1=CN=C(Cl)C=C1 AK-33219 [1,1,0,0,0,0|2,0,0]=4 565 B9R1.1 COC1=CN=C(F)C=C1 AK-61561 [1,1,0,0,0,0|2,0,0]=4 566 B9R1.1 CSC1=CN=C(N)C=C1 AK-40039 [1,1,0,0,0,0|2,0,0]=4 567 B9R1.1 ClC1=CN=C(C=C1)C=O AK-44636 [1,1,0,0,0,0|2,0,0]=4 568 B9R1.1 ClC1=NC=C(C=C1)C#C AK110072 [1,1,0,0,0,0|1,0,1]=4 569 B9R1.1 ClC1=NC=C(C=O)C=N1 AK-29616 [1,1,0,0,0,0|1,0,0]=3 570 B9R1.1 ClC1=NC=C(C=O)N=C1 AK-87373 [1,1,0,0,0,0|1,0,0]=3 571 B9R1.1 FC1=NC=C(C=C1)C=O AK-25098 [1,1,0,0,0,0|0,0,0]=2 572 B9R1.1 N#CC1=CC=C(F)N=C1 AK-26611 [1,1,0,0,0,0|0,0,2]=4 573 B9R1.1 N#CC1=CN=C(N)C=C1 AK-32349 [1,1,0,0,0,0|0,0,2]=4 574 B9R1.1 N#CC1=CN=C(O)C=C1 AK-68351 [1,1,0,0,0,0|0,0,2]=4 575 B9R1.1 N(N)C1=CC=C(N=N1)C AK-30657 [1,1,0,0,0,0|2,0,0]=4 576 B9R1.1 N(N)C1=CN=C(C=C1)C AK-49534 [1,1,0,0,0,0|1,0,0]=3 577 B9R1.1 NC1=CC=C(C=N1)CO AK-29786 [1,1,0,0,0,0|0,0,2]=4 578 B9R1.1 NC1=NC=C(C=C1)OC AK-27987 [1,1,0,0,0,0|2,0,0]=4 579 B9R1.1 NCC1=CC=C(Br)C=C1 AK-46356 [1,1,0,0,0,0|1,0,1]=4 580 B9R1.1 NCC1=CC=C(Br)C=C1 AK-49170 [1,1,0,0,0,0|1,0,1]=4 581 B9R1.1 NCC1=CC=C(Br)N=C1 AK-27657 [1,1,0,0,0,0|0,0,1]=3 582 B9R1.1 NCC1=CC=C(Cl)C=C1 AK-44456 [1,1,0,0,0,0|1,0,1]=4 583 B9R1.1 NCC1=CC=C(F)N=C1 AK-67908 [1,1,0,0,0,0|0,0,1]=3 584 B9R1.1 NCC1=CC=C(I)C=C1 AK-81624 [1,1,0,0,0,0|1,0,1]=4 585 B9R1.1 NCC1=NN=C(Cl)C=C1 AK-24540 [1,1,0,0,0,0|1,0,1]=4 586 B9R1.1 NNC1=CC=C(Br)C=C1 AK-26194 [1,1,0,0,0,0|2,0,0]=4 587 B9R1.1 NNC1=CC=C(Cl)C=C1 AK-41259 [1,1,0,0,0,0|2,0,0]=4 588 B9R1.1 NNC1=CC=C(Cl)C=C1 AK132992 [1,1,0,0,0,0|2,0,0]=4 589 B9R1.1 NNC1=CC=C(F)C=C1 AK-85652 [1,1,0,0,0,0|2,0,0]=4 590 B9R1.1 NNC1=CC=C(I)C=C1 AK-64633 [1,1,0,0,0,0|2,0,0]=4 591 B9R1.1 NNC1=NN=C(Br)C=C1 AK349746 [1,1,0,0,0,0|2,0,0]=4 592 B9R1.1 NNC1=NN=C(Cl)C=C1 AK-25495 [1,1,0,0,0,0|2,0,0]=4 593 B9R1.1 NNC1=NN=C(Cl)C=C1 AK136111 [1,1,0,0,0,0|2,0,0]=4 594 B9R1.1 O=CC1=CC=C(Br)C=C1 AK-80048 [1,1,0,0,0,0|1,0,0]=3 595 B9R1.1 O=CC1=CC=C(Cl)C=C1 AK-76679 [1,1,0,0,0,0|1,0,0]=3 596 B9R1.1 O=CC1=CC=C(F)C=C1 AK-84401 [1,1,0,0,0,0|1,0,0]=3 597 B9R1.1 O=CC1=CC=C(O)C=C1 AK-77323 [1,1,0,0,0,0|1,0,0]=3 598 B9R1.1 O=CC1=CN=C(C)N=C1 AK-36829 [1,1,0,0,0,0|1,0,0]=3 599 B9R1.1 O=CC1=CN=C(N)C=C1 AK114395 [1,1,0,0,0,0|0,0,0]=2 600 B9R1.1 O=CC1=CN=C(N)C=C1 AK125046 [1,1,0,0,0,0|0,0,0]=2 601 B9R1.1 O=CC1=CN=C(N)N=C1 AK118712 [1,1,0,0,0,0|1,0,0]=3 602 B9R1.1 O=CC1=CN=C(O)N=C1 AK199230 [1,1,0,0,0,0|1,0,0]=3 603 B9R1.1 O=CC1=NC=C(Br)C=C1 AK-27944 [1,1,0,0,0,0|2,0,0]=4 604 B9R1.1 O=CC1=NC=C(C)N=C1 AK-40389 [1,1,0,0,0,0|1,0,0]=3 605 B9R1.1 O=CC1=NC=C(F)C=C1 AK-34624 [1,1,0,0,0,0|2,0,0]=4 606 B9R1.1 O=CC1=NC=C(O)C=C1 AK-34625 [1,1,0,0,0,0|2,0,0]=4 607 B9R1.1 O=CC=1C=CC(NC1)=O AK-28718 [1,1,0,0,0,0|0,0,1]=3 608 B9R1.1 OC1=CC=C(C=C)C=C1 AK113778 [1,1,0,0,0,0|2,0,0]=4 609 B9R1.1 OC1=NN=C(CN)C=C1 AK601362 [1,1,0,0,0,0|1,0,1]=4 610 B9R1.1 OCC1=CC=C(Br)N=C1 AK-28751 [1,1,0,0,0,0|0,0,2]=4 611 B9R1.1 OCC1=CC=C(F)N=C1 AK-76831 [1,1,0,0,0,0|0,0,2]=4 612 B9R1.2 BrC1=CC(=CN=C1)CC AK-54800 [1,1,0,0,0,0|1,0,1]=4 613 B9R1.2 BrC1=CC(C=C)=CC=C1 AK-76367 [1,1,0,0,0,0|2,0,0]=4 614 B9R1.2 BrC1=CN=CC(=C1)CO AK-29246 [1,1,0,0,0,0|0,0,2]=4 615 B9R1.2 C1=C(C=CC=C1F)NN AK-47492 [1,1,0,0,0,0|2,0,0]=4 616 B9R1.2 C1=C(C=NC=C1Br)C#N AK-23819 [1,1,0,0,0,0|0,0,2]=4 617 B9R1.2 C1=C(NN)C=CC=C1Br AK-25693 [1,1,0,0,0,0|2,0,0]=4 618 B9R1.2 C1=C(NN)C=CC=C1C AK-47381 [1,1,0,0,0,0|2,0,0]=4 619 B9R1.2 C1=CC=C(Br)N=C1C=O AK-25797 [1,1,0,0,0,0|2,0,0]=4 620 B9R1.2 C1=NC(=CC(=C1)C=O)Cl AK-32653 [1,1,0,0,0,0|2,0,0]=4 621 B9R1.2 CC1=CC(=CN=C1)C=O AK-28384 [1,1,0,0,0,0|0,0,0]=2 622 B9R1.2 CC1=CC(=NC=C1)C=O AK-24250 [1,1,0,0,0,0|2,0,0]=4 623 B9R1.2 CC1=CN=CC(CBr)=C1 AK-56105 [1,1,0,0,0,0|1,0,1]=4 624 B9R1.2 COC1=CN=CC(=C1)O AK-28499 [1,1,0,0,0,0|2,0,0]=4 625 B9R1.2 COC1=CN=CC(Br)=C1 AK-26045 [1,1,0,0,0,0|2,0,0]=4 626 B9R1.2 ClC1=CN=CC(=C1)CO AK-23534 [1,1,0,0,0,0|0,0,2]=4 627 B9R1.2 ClC1=NC(C=O)=CN=C1 AK-64725 [1,1,0,0,0,0|1,0,0]=3 628 B9R1.2 ClCC1=CC(=CN=C1)C AK-33495 [1,1,0,0,0,0|1,0,1]=4 629 B9R1.2 ClCC1=CN=CC(Br)=C1 AK-88388 [1,1,0,0,0,0|1,0,1]=4 630 B9R1.2 FC1=CC(=CN=C1)C=O AK-30355 [1,1,0,0,0,0|0,0,0]=2 631 B9R1.2 FC1=CC(C=O)=NC=C1 AK-32767 [1,1,0,0,0,0|2,0,0]=4 632 B9R1.2 FC1=CN=CC(=C1)C#N AK-36132 [1,1,0,0,0,0|0,0,2]=4 633 B9R1.2 FC1=NC(=CC=C1)C=O AK-25580 [1,1,0,0,0,0|2,0,0]=4 634 B9R1.2 N#CC1=CN=CC(Cl)=C1 AK-35406 [1,1,0,0,0,0|0,0,2]=4 635 B9R1.2 N#CC1=CN=CC(O)=C1 AK-25450 [1,1,0,0,0,0|0,0,2]=4 636 B9R1.2 NC1=CC(=CN=C1)OC AK-27775 [1,1,0,0,0,0|2,0,0]=4 637 B9R1.2 NC1=CC=CC(CN)=C1 AK-76655 [1,1,0,0,0,0|1,0,1]=4 638 B9R1.2 NC1=CN=CC(=C1)C#N AK-30916 [1,1,0,0,0,0|0,0,2]=4 639 B9R1.2 NCC1=CC(F)=CC=C1 AK-80195 [1,1,0,0,0,0|1,0,1]=4 640 B9R1.2 NCC1=CC=CC(Br)=C1 AK-49144 [1,1,0,0,0,0|1,0,1]=4 641 B9R1.2 NCC1=CC=CC(C)=C1 AK-98167 [1,1,0,0,0,0|1,0,1]=4 642 B9R1.2 NCC1=CC=CC(Cl)=C1 AK-89641 [1,1,0,0,0,0|1,0,1]=4 643 B9R1.2 NCC1=CC=CC(I)=C1 AK-46127 [1,1,0,0,0,0|1,0,1]=4 644 B9R1.2 NCC1=NC(Cl)=CN=C1 AK130178 [1,1,0,0,0,0|1,0,1]=4 645 B9R1.2 NNC1=CC=CC(Cl)=C1 AK-46617 [1,1,0,0,0,0|2,0,0]=4 646 B9R1.2 O=CC1=CC=CC(Br)=C1 AK-77027 [1,1,0,0,0,0|1,0,0]=3 647 B9R1.2 O=CC1=CC=CC(Cl)=C1 AK-68812 [1,1,0,0,0,0|1,0,0]=3 648 B9R1.2 O=CC1=CC=CC(F)=C1 AK112743 [1,1,0,0,0,0|1,0,0]=3 649 B9R1.2 O=CC1=CC=CC(I)=C1 AK-50045 [1,1,0,0,0,0|1,0,0]=3 650 B9R1.2 O=CC1=CC=CC(N)=C1 AK121859 [1,1,0,0,0,0|1,0,0]=3 651 B9R1.2 O=CC1=CC=CC(O)=C1 AK-77369 [1,1,0,0,0,0|1,0,0]=3 652 B9R1.2 O=CC1=CC=NC(C)=C1 AK-30085 [1,1,0,0,0,0|2,0,0]=4 653 B9R1.2 O=CC1=CC=NC(Cl)=C1 AK165004 [1,1,0,0,0,0|2,0,0]=4 654 B9R1.2 O=CC1=CC=NC(F)=C1 AK-29829 [1,1,0,0,0,0|2,0,0]=4 655 B9R1.2 O=CC1=CC=NC(O)=C1 AK-24042 [1,1,0,0,0,0|2,0,0]=4 656 B9R1.2 O=CC1=CN=CC(Br)=C1 AK-25300 [1,1,0,0,0,0|0,0,0]=2 657 B9R1.2 O=CC1=CN=CC(O)=C1 AK139755 [1,1,0,0,0,0|0,0,0]=2 658 B9R1.2 O=CC1=NC(C)=CC=C1 AK-45099 [1,1,0,0,0,0|2,0,0]=4 659 B9R1.2 O=CC1=NC(Cl)=CC=C1 AK-29361 [1,1,0,0,0,0|2,0,0]=4 660 B9R1.2 O=CC1=NC=CC(Br)=C1 AK-29828 [1,1,0,0,0,0|2,0,0]=4 661 B9R1.2 OCC1=CC(C)=CN=C1 AK130310 [1,1,0,0,0,0|0,0,2]=4 662 B9R1.2 OCC1=CC(N)=CN=C1 AK135137 [1,1,0,0,0,0|0,0,2]=4 663 B9R1.8 C1=C(C=CC=C1)CON AK-49180 [1,1,0,0,0,0|1,0,1]=4 664 B9R1.8 C1=C(CNN)C=CC=C1 AK-72938 [1,1,0,0,0,0|1,0,1]=4 665 B9R1.8 CCNC1=CC=CN=C1 AK126739 [1,1,0,0,0,0|1,0,1]=4 666 B9R1.8 CNCC1=CC=CN=C1 AK-77094 [1,1,0,0,0,0|0,0,1]=3 667 B9R1.8 CNCC1=NC=CN=C1 AK-32984 [1,1,0,0,0,0|1,0,1]=4 668 B9R1.8 CNNC1=CC=CC=C1 AK119038 [1,1,0,0,0,0|2,0,0]=4 669 B9R1.8 N#CCC1=CC=CN=C1 AK-44402 [1,1,0,0,0,0|0,0,2]=4 670 B9R1.8 NCCC1=CC=CN=C1 AK-45879 [1,1,0,0,0,0|0,0,1]=3 671 B9R1.8 NNCC1=CC=CN=C1 AK-50063 [1,1,0,0,0,0|0,0,1]=3 672 B9R1.8 NOCC1=CC=CC=C1 AK-82317 [1,1,0,0,0,0|1,0,1]=4 673 B9R1.8 ONCC1=CC=CC=C1 AK-49662 [1,1,0,0,0,0|1,0,1]=4 674 B9R1.8 ONCC1=CC=CC=C1 AK110567 [1,1,0,0,0,0|1,0,1]=4 675 B9R1.15 BrC1=C(C=NC=C1)OC AK-46696 [1,1,0,0,0,0|2,0,0]=4 676 B9R1.15 BrC1=NC=CC=C1C=O AK-33078 [1,1,0,0,0,0|0,0,0]=2 677 B9R1.15 C1=C(C(=CC=C1)Br)CN AK-73129 [1,1,0,0,0,0|1,0,1]=4 678 B9R1.15 C1=C(C(=CC=N1)C)C#N AK-28504 [1,1,0,0,0,0|0,0,2]=4 679 B9R1.15 C1=C(C(=CN=C1)O)C=O AK-23522 [1,1,0,0,0,0|2,0,0]=4 680 B9R1.15 C1=C(C(=NC=C1)Cl)C#N AK-36024 [1,1,0,0,0,0|0,0,2]=4 681 B9R1.15 C1=CC=CC(=C1NN)Br AK-35375 [1,1,0,0,0,0|2,0,0]=4 682 B9R1.15 C1=CC=CC(=C1NN)C AK-46554 [1,1,0,0,0,0|2,0,0]=4 683 B9R1.15 C1=CC=CC(=C1NN)Cl AK-37033 [1,1,0,0,0,0|2,0,0]=4 684 B9R1.15 C1=CC=NC(=C1C#N)Br AK-23604 [1,1,0,0,0,0|0,0,2]=4 685 B9R1.15 C1=CC=NC(=C1C=O)Cl AK-25854 [1,1,0,0,0,0|0,0,0]=2 686 B9R1.15 C1=CC=NC(=C1C=O)F AK-29226 [1,1,0,0,0,0|0,0,0]=2 687 B9R1.15 C1=NC(=C(C=C1)CO)N AK-23581 [1,1,0,0,0,0|0,0,2]=4 688 B9R1.15 C1=NC(=C(N=C1)Cl)NN AK-24564 [1,1,0,0,0,0|2,0,0]=4 689 B9R1.15 C=CC1=CC=CC=C1Cl AK114259 [1,1,0,0,0,0|2,0,0]=4 690 B9R1.15 CC1=C(CBr)C=NC=C1 AK137963 [1,1,0,0,0,0|1,0,1]=4 691 B9R1.15 CC1=C(CCl)C=NC=C1 AK143692 [1,1,0,0,0,0|1,0,1]=4 692 B9R1.15 CC1=CC=NN=C1NN AK129520 [1,1,0,0,0,0|2,0,0]=4 693 B9R1.15 CC1=NC=CC=C1C#N AK-32548 [1,1,0,0,0,0|0,0,2]=4 694 B9R1.15 CCC1=C(Br)C=CN=C1 AK328293 [1,1,0,0,0,0|1,0,1]=4 695 B9R1.15 CNC1=CC=CN=C1Cl AK115045 [1,1,0,0,0,0|2,0,0]=4 696 B9R1.15 COC1=CC=CN=C1Br AK-29048 [1,1,0,0,0,0|2,0,0]=4 697 B9R1.15 COC1=CC=CN=C1F AK-63160 [1,1,0,0,0,0|2,0,0]=4 698 B9R1.15 ClC1=C(C=CN=C1)C=O AK-25096 [1,1,0,0,0,0|2,0,0]=4 699 B9R1.15 FC1=CC=CN=C1C=O AK-25751 [1,1,0,0,0,0|2,0,0]=4 700 B9R1.15 FC1=NC=CC=C1C#C AK128642 [1,1,0,0,0,0|1,0,1]=4 701 B9R1.15 FC1=NC=CC=C1CN AK-30140 [1,1,0,0,0,0|0,0,1]=3 702 B9R1.15 N#CC1=C(F)N=CC=C1 AK-37334 [1,1,0,0,0,0|0,0,2]=4 703 B9R1.15 N#CC1=CN=CC=C1Cl AK-26416 [1,1,0,0,0,0|0,0,2]=4 704 B9R1.15 NC1=C(C=O)C=CC=C1 AK-45623 [1,1,0,0,0,0|1,0,0]=3 705 B9R1.15 NC1=C(OC)C=NC=C1 AK-46304 [1,1,0,0,0,0|2,0,0]=4 706 B9R1.15 NC1=CC=CC=C1C=C AK100084 [1,1,0,0,0,0|2,0,0]=4 707 B9R1.15 NC1=NC=CC=C1C#C AK-81032 [1,1,0,0,0,0|1,0,1]=4 708 B9R1.15 NC1=NC=CC=C1OC AK-25256 [1,1,0,0,0,0|2,0,0]=4 709 B9R1.15 NC1=NC=CN=C1C=O AK-30729 [1,1,0,0,0,0|1,0,0]=3 710 B9R1.15 NCC1=CC=CC=C1C AK-89642 [1,1,0,0,0,0|1,0,1]=4 711 B9R1.15 NCC1=CC=CC=C1Cl AK-78184 [1,1,0,0,0,0|1,0,1]=4 712 B9R1.15 NCC1=CC=CC=C1F AK-88519 [1,1,0,0,0,0|1,0,1]=4 713 B9R1.15 NCC1=CC=CC=C1I AK-94126 [1,1,0,0,0,0|1,0,1]=4 714 B9R1.15 NCC1=NC=CN=C1Cl AK-42166 [1,1,0,0,0,0|1,0,1]=4 715 B9R1.15 NCC1=NC=CN=C1Cl AK-64298 [1,1,0,0,0,0|1,0,1]=4 716 B9R1.15 NNC1=CC=CC=C1Br AK-33609 [1,1,0,0,0,0|2,0,0]=4 717 B9R1.15 NNC1=CC=CC=C1F AK-78527 [1,1,0,0,0,0|2,0,0]=4 718 B9R1.15 NNC1=CC=CC=C1I AK198825 [1,1,0,0,0,0|2,0,0]=4 719 B9R1.15 O=C1C(CN)=CC=CN1 AK-76048 [1,1,0,0,0,0|0,0,2]=4 720 B9R1.15 O=CC1=C(C)N=CC=C1 AK-35801 [1,1,0,0,0,0|0,0,0]=2 721 B9R1.15 O=CC1=CC=CC=C1Br AK-50022 [1,1,0,0,0,0|1,0,0]=3 722 B9R1.15 O=CC1=CC=CC=C1F AK-88670 [1,1,0,0,0,0|1,0,0]=3 723 B9R1.15 O=CC1=CC=CC=C1I AK-94125 [1,1,0,0,0,0|1,0,0]=3 724 B9R1.15 O=CC1=CC=CC=C1N AK550048 [1,1,0,0,0,0|1,0,0]=3 725 B9R1.15 O=CC1=CC=CN=C1N AK-24791 [1,1,0,0,0,0|0,0,0]=2 726 B9R1.15 O=CC1=CC=CNC1=O AK-23653 [1,1,0,0,0,0|0,0,1]=3 727 B9R1.15 O=CC1=CC=NC=C1Br AK-32444 [1,1,0,0,0,0|2,0,0]=4 728 B9R1.15 O=CC1=CC=NC=C1Cl AK162974 [1,1,0,0,0,0|2,0,0]=4 729 B9R1.15 O=CC1=CC=NC=C1F AK-37427 [1,1,0,0,0,0|2,0,0]=4 730 B9R1.15 O=CC1=CN=CC=C1N AK-35124 [1,1,0,0,0,0|0,0,0]=2 731 B9R1.15 O=CC1=NC=CC=C1C AK-26127 [1,1,0,0,0,0|2,0,0]=4 732 B9R1.15 O=CC1=NC=CC=C1Cl AK-28957 [1,1,0,0,0,0|2,0,0]=4 733 B9R1.15 OC1=C(C=O)N=CC=C1 AK-47968 [1,1,0,0,0,0|2,0,0]=4 734 B9R1.15 OC1=CC=CC=C1CN AK-49022 [1,1,0,0,0,0|1,0,1]=4 735 B9R1.15 OC1=CC=CC=C1CN AK167666 [1,1,0,0,0,0|1,0,1]=4 736 B9R1.15 OC1=NC=CC=C1C#C AK-78040 [1,1,0,0,0,0|1,0,1]=4 737 B9R1.15 OCC1=C(Br)C=CN=C1 AK-86110 [1,1,0,0,0,0|0,0,2]=4 738 B9R1.15 OCC1=C(Cl)C=CN=C1 AK124400 [1,1,0,0,0,0|0,0,2]=4 739 B9R1.15 OCC1=C(N)C=CN=C1 AK-58822 [1,1,0,0,0,0|0,0,2]=4 740 B9R1.15 OCC1=CC=CN=C1Cl AK-23619 [1,1,0,0,0,0|0,0,2]=4 741 B9R1.15 OCC1=CC=CN=C1F AK-33110 [1,1,0,0,0,0|0,0,2]=4 742 B9R1.11 BrCC(=O)C1=CC=CS1 AK-53454 [0,1,0,0,1,0|2,0,0]=4 743 B9R1.11 BrCC(C1=NC=CS1)=O AK-45640 [0,1,0,0,1,0|2,0,0]=4 744 B9R1.11 C1=C(C(=O)OC)SC=N1 AK-29865 [0,1,0,0,1,0|2,0,0]=4 745 B9R1.11 CCC(C1=NC=CS1)=O AK113134 [0,1,0,0,1,0|2,0,0]=4 746 B9R1.11 COC(=O)C1=CNC=C1 AK-39320 [0,1,0,0,1,0|1,0,1]=4 747 B9R1.11 COC(=O)C1=COC=N1 AK100835 [0,1,0,0,1,0|2,0,0]=4 748 B9R1.11 COC(=O)C1=NC=CO1 AK109950 [0,1,0,0,1,0|2,0,0]=4 749 B9R1.11 O=C(C1=CC=CN1)OC AK-27729 [0,1,0,0,1,0|1,0,1]=4 750 B9R1.11 O=C(C1=CC=CS1)OC AK-48323 [0,1,0,0,1,0|2,0,0]=4 751 B9R1.11 O=C(C1=CN=CN1)OC AK-25496 [0,1,0,0,1,0|2,0,0]=4 752 B9R1.11 O=C(C1=CN=CN1)OC AK-40808 [0,1,0,0,1,0|2,0,0]=4 753 B9R1.11 O=C(C1=CNN=C1)OC AK-65272 [0,1,0,0,1,0|2,0,0]=4 754 B9R1.11 O=C(C1=CSC=C1)OC AK-48045 [0,1,0,0,1,0|2,0,0]=4 755 B9R1.11 O=C(C1=CSC=N1)OC AK-21853 [0,1,0,0,1,0|2,0,0]=4 756 B9R1.11 O=C(C1=NC=CN1)OC AK-59662 [0,1,0,0,1,0|2,0,0]=4 757 B9R1.11 O=C(C1=NC=CS1)OC AK-50497 [0,1,0,0,1,0|2,0,0]=4 758 B9R1.11 O=C(C1=NNC=C1)OC AK-31981 [0,1,0,0,1,0|2,0,0]=4 759 B9R1.19 C1=C([S](N)(=O)=O)SC=C1 AK-23658 [0,1,0,0,1,0|2,0,0]=4 760 B9R1.35 BrC1=CC(=CS1)C(=O)O AK-28622 [0,1,0,0,1,0|2,0,0]=4 761 B9R1.35 BrC1=CC(=CS1)C(C)=O AK-35777 [0,1,0,0,1,0|2,0,0]=4 762 B9R1.35 C1=C(C(=O)O)SC(=N1)N AK-24488 [0,1,0,0,1,0|2,0,0]=4 763 B9R1.35 C1=C(C)ON=C1C(N)=O AK-26695 [0,1,0,0,1,0|1,0,0]=3 764 B9R1.35 C1=C(C)[NH]N=C1C(O)=O AK-27812 [0,1,0,0,1,0|2,0,0]=4 765 B9R1.35 C1=C(N=C(S1)N)C(=O)C AK-54799 [0,1,0,0,1,0|2,0,0]=4 766 B9R1.35 C1=C(OC(=C1)Br)C(O)=O AK-35759 [0,1,0,0,1,0|2,0,0]=4 767 B9R1.35 C1=C(OC(=C1)C)C(O)=O AK-44799 [0,1,0,0,1,0|2,0,0]=4 768 B9R1.35 C1=C(ON=C1Br)C(=O)O AK-21783 [0,1,0,0,1,0|2,0,0]=4 769 B9R1.35 C1=C(SC(=C1)C(O)=O)Cl AK-29045 [0,1,0,0,1,0|2,0,0]=4 770 B9R1.35 C1=C(SC(=C1)C)C(=O)C AK-33183 [0,1,0,0,1,0|2,0,0]=4 771 B9R1.35 C1=C(SC(=C1)Cl)C(C)=O AK-47623 [0,1,0,0,1,0|2,0,0]=4 772 B9R1.35 C1=C(SC(=N1)C)C(=O)O AK-35030 [0,1,0,0,1,0|2,0,0]=4 773 B9R1.35 CC(=O)C1=CC=C(C)O1 AK-77189 [0,1,0,0,1,0|2,0,0]=4 774 B9R1.35 CC(=O)C1=NC(C)=CO1 AK-80747 [0,1,0,0,1,0|2,0,0]=4 775 B9R1.35 CC(=O)C1=NOC(C)=C1 AK-47045 [0,1,0,0,1,0|2,0,0]=4 776 B9R1.35 CC(C1=CC(Cl)=CS1)=O AK-77338 [0,1,0,0,1,0|2,0,0]=4 777 B9R1.35 CC1=CC=C(N1)C(O)=O AK100045 [0,1,0,0,1,0|1,0,1]=4 778 B9R1.35 CC1=CN=C(S1)C(=O)O AK-26650 [0,1,0,0,1,0|2,0,0]=4 779 B9R1.35 CN1C=C(C=N1)C(C)=O AK-34919 [0,1,0,0,1,0|2,0,0]=4 780 B9R1.35 CN1C=CC(=C1)C(O)=O AK-28665 [0,1,0,0,1,0|1,0,1]=4 781 B9R1.35 CN1C=CC(=N1)C(N)=O AK102817 [0,1,0,0,1,0|1,0,0]=3 782 B9R1.35 C[N]1C=C(N=C1)C(=O)N AK-47806 [0,1,0,0,1,0|1,0,0]=3 783 B9R1.35 ClC1=CC(=CS1)C(=O)O AK-29222 [0,1,0,0,1,0|2,0,0]=4 784 B9R1.35 O=C(C1=CC(Br)=CN1)N AK106602 [0,1,0,0,1,0|0,0,1]=3 785 B9R1.35 O=C(C1=CC(Br)=CO1)N AK120768 [0,1,0,0,1,0|1,0,0]=3 786 B9R1.35 O=C(C1=CC(Br)=CS1)N AK-90412 [0,1,0,0,1,0|1,0,0]=3 787 B9R1.35 O=C(C1=CC(Br)=CS1)O AK-24697 [0,1,0,0,1,0|2,0,0]=4 788 B9R1.35 O=C(C1=CC(C)=NO1)O AK-29291 [0,1,0,0,1,0|2,0,0]=4 789 B9R1.35 O=C(C1=CC(O)=NO1)N AK143689 [0,1,0,0,1,0|1,0,0]=3 790 B9R1.35 O=C(C1=CC(O)=NO1)O AK-58553 [0,1,0,0,1,0|2,0,0]=4 791 B9R1.35 O=C(C1=CC=C(Br)S1)O AK-26297 [0,1,0,0,1,0|2,0,0]=4 792 B9R1.35 O=C(C1=CC=C(C)S1)O AK-25546 [0,1,0,0,1,0|2,0,0]=4 793 B9R1.35 O=C(C1=CC=C(Cl)O1)O AK-94156 [0,1,0,0,1,0|2,0,0]=4 794 B9R1.35 O=C(C1=CC=C(F)S1)O AK-35162 [0,1,0,0,1,0|2,0,0]=4 795 B9R1.35 O=C(C1=CC=C(I)S1)O AK113691 [0,1,0,0,1,0|2,0,0]=4 796 B9R1.35 O=C(C1=CN(C)C=N1)O AK-30010 [0,1,0,0,1,0|2,0,0]=4 797 B9R1.35 O=C(C1=CN(C)N=C1)O AK-39751 [0,1,0,0,1,0|2,0,0]=4 798 B9R1.35 O=C(C1=CN=C(Br)S1)N AK-48537 [0,1,0,0,1,0|1,0,0]=3 799 B9R1.35 O=C(C1=CN=C(Br)S1)O AK-26941 [0,1,0,0,1,0|2,0,0]=4 800 B9R1.35 O=C(C1=CN=C(C)O1)O AK-43778 [0,1,0,0,1,0|2,0,0]=4 801 B9R1.35 O=C(C1=CNC(C)=C1)O AK-78330 [0,1,0,0,1,0|1,0,1]=4 802 B9R1.35 O=C(C1=CNC(C)=N1)O AK-78654 [0,1,0,0,1,0|2,0,0]=4 803 B9R1.35 O=C(C1=COC(Br)=N1)O AK-76031 [0,1,0,0,1,0|2,0,0]=4 804 B9R1.35 O=C(C1=COC(I)=N1)O AK-41227 [0,1,0,0,1,0|2,0,0]=4 805 B9R1.35 O=C(C1=CSC(Br)=C1)N AK138264 [0,1,0,0,1,0|1,0,0]=3 806 B9R1.35 O=C(C1=CSC(Br)=N1)O AK-23610 [0,1,0,0,1,0|2,0,0]=4 807 B9R1.35 O=C(C1=CSC(Cl)=N1)O AK-48303 [0,1,0,0,1,0|2,0,0]=4 808 B9R1.35 O=C(C1=CSC(N)=N1)N AK109042 [0,1,0,0,1,0|1,0,0]=3 809 B9R1.35 O=C(C1=NC(Br)=CS1)O AK-40795 [0,1,0,0,1,0|2,0,0]=4 810 B9R1.35 O=C(C1=NC(C)=CN1)O AK-29453 [0,1,0,0,1,0|2,0,0]=4 811 B9R1.35 O=C(C1=NC=C(Br)S1)O AK122038 [0,1,0,0,1,0|2,0,0]=4 812 B9R1.35 O=C(C1=NN(C)C=C1)O AK-79303 [0,1,0,0,1,0|2,0,0]=4 813 B9R1.35 O=C(C1=NNC(Br)=C1)O AK128451 [0,1,0,0,1,0|2,0,0]=4 814 B9R1.35 O=C(C1=NNC(Cl)=C1)O AK112708 [0,1,0,0,1,0|2,0,0]=4 815 B9R1.35 O=C(C1=NOC(C)=C1)O AK-25795 [0,1,0,0,1,0|2,0,0]=4 816 B9R1.35 O=C(Cl)C1=CC=C(Cl)S1 AK-48243 [0,1,0,0,1,0|2,0,0]=4 817 B9R1.35 O=C(O)C1=CC(Br)=CO1 AK-41331 [0,1,0,0,1,0|2,0,0]=4 818 B9R1.35 OC(=O)C1=CC(Br)=CN1 AK-27737 [0,1,0,0,1,0|1,0,1]=4 819 B9R1.35 OC(=O)C1=CC(Cl)=CS1 AK-89071 [0,1,0,0,1,0|2,0,0]=4 820 B9R1.35 OC(=O)C1=CC(F)=CS1 AK-29152 [0,1,0,0,1,0|2,0,0]=4 821 B9R1.35 OC(=O)C1=CC=C(Br)N1 AK100216 [0,1,0,0,1,0|1,0,1]=4 822 B9R1.35 OC(=O)C1=COC(Cl)=N1 AK-72648 [0,1,0,0,1,0|2,0,0]=4 823 B9R1.35 OC(=O)C1=NNC(O)=C1 AK-96196 [0,1,0,0,1,0|2,0,0]=4 824 B9R1.41 BrC1=C[NH]N=C1C(=O)N AK-39986 [0,1,0,0,1,0|1,0,0]=3 825 B9R1.41 C1=CC(=C(S1)N)C(=O)N AK-50549 [0,1,0,0,1,0|1,0,0]=3 826 B9R1.41 C1=NC(=C(C(O)=O)O1)C AK-25663 [0,1,0,0,1,0|2,0,0]=4 827 B9R1.41 C1=NC(=C([NH]1)C(=O)N)O AK-26137 [0,1,0,0,1,0|1,0,0]=3 828 B9R1.41 CC(C1=CC=CN1C)=O AK148515 [0,1,0,0,1,0|1,0,1]=4 829 B9R1.41 CC(C1=CN=CN1C)=O AK140652 [0,1,0,0,1,0|2,0,0]=4 830 B9R1.41 CC1=C(C=CN1)C(O)=O AK-77215 [0,1,0,0,1,0|1,0,1]=4 831 B9R1.41 CC1=C(OC=C1)C(O)=O AK-89342 [0,1,0,0,1,0|2,0,0]=4 832 B9R1.41 CC1=NOC=C1C(=O)O AK-33667 [0,1,0,0,1,0|2,0,0]=4 833 B9R1.41 CN1C=CN=C1C(C)=O AK-54843 [0,1,0,0,1,0|2,0,0]=4 834 B9R1.41 CN1N=CC=C1C(C)=O AK-40773 [0,1,0,0,1,0|2,0,0]=4 835 B9R1.41 ClC1=C(C=CS1)C(=O)O AK-29355 [0,1,0,0,1,0|2,0,0]=4 836 B9R1.41 FC1=C(SC=C1)C(=O)O AK-29153 [0,1,0,0,1,0|2,0,0]=4 837 B9R1.41 O=C(C1=C(Br)C=CS1)O AK-29480 [0,1,0,0,1,0|2,0,0]=4 838 B9R1.41 O=C(C1=C(Br)C=NN1)O AK-59621 [0,1,0,0,1,0|2,0,0]=4 839 B9R1.41 O=C(C1=C(Br)SC=C1)O AK-34310 [0,1,0,0,1,0|2,0,0]=4 840 B9R1.41 O=C(C1=C(Br)SC=N1)O AK-22047 [0,1,0,0,1,0|2,0,0]=4 841 B9R1.41 O=C(C1=C(C)C=CN1)O AK-36827 [0,1,0,0,1,0|1,0,1]=4 842 B9R1.41 O=C(C1=C(C)C=CS1)O AK-25644 [0,1,0,0,1,0|2,0,0]=4 843 B9R1.41 O=C(C1=C(C)C=NO1)O AK-25674 [0,1,0,0,1,0|2,0,0]=4 844 B9R1.41 O=C(C1=C(C)N=CS1)O AK-29930 [0,1,0,0,1,0|2,0,0]=4 845 B9R1.41 O=C(C1=C(C)OC=N1)O AK-24069 [0,1,0,0,1,0|2,0,0]=4 846 B9R1.41 O=C(C1=C(C)ON=C1)O AK-32464 [0,1,0,0,1,0|2,0,0]=4 847 B9R1.41 O=C(C1=C(C)SC=C1)O AK-33900 [0,1,0,0,1,0|2,0,0]=4 848 B9R1.41 O=C(C1=C(C)SC=N1)O AK-25323 [0,1,0,0,1,0|2,0,0]=4 849 B9R1.41 O=C(C1=C(Cl)C=NN1)O AK-75702 [0,1,0,0,1,0|2,0,0]=4 850 B9R1.41 O=C(C1=C(Cl)C=NS1)O AK314030 [0,1,0,0,1,0|2,0,0]=4 851 B9R1.41 O=C(C1=C(I)C=CS1)O AK167455 [0,1,0,0,1,0|2,0,0]=4 852 B9R1.41 O=C(C1=C(I)C=NN1)O AK-92905 [0,1,0,0,1,0|2,0,0]=4 853 B9R1.41 O=C(C1=C(N)NC=N1)N AK-34082 [0,1,0,0,1,0|1,0,0]=3 854 B9R1.41 O=C(C1=C(N)NC=N1)N AK-48933 [0,1,0,0,1,0|1,0,0]=3 855 B9R1.41 O=C(C1=C(N)SC=N1)N AK-88620 [0,1,0,0,1,0|1,0,0]=3 856 B9R1.41 O=C(C1=CC=CN1N)N AK-45334 [0,1,0,0,1,0|0,0,1]=3 857 B9R1.41 O=C(C1=CC=NN1C)O AK-33521 [0,1,0,0,1,0|2,0,0]=4 858 B9R1.41 O=C(C1=CN=CN1C)O AK-35106 [0,1,0,0,1,0|2,0,0]=4 859 B9R1.41 O=C(C1=CNN=C1C)O AK-39586 [0,1,0,0,1,0|2,0,0]=4 860 B9R1.41 O=C(C1=CNN=C1N)N AK-48317 [0,1,0,0,1,0|1,0,0]=3 861 B9R1.41 O=C(C1=CNN=C1N)O AK-46321 [0,1,0,0,1,0|2,0,0]=4 862 B9R1.41 O=C(C1=CSC=C1C)O AK-64461 [0,1,0,0,1,0|2,0,0]=4 863 B9R1.41 O=C(C1=NC=CN1C)O AK-28560 [0,1,0,0,1,0|2,0,0]=4 864 B9R1.41 O=C(C1=NNC=C1Br)O AK-46340 [0,1,0,0,1,0|2,0,0]=4 865 B9R1.41 O=C(C1=NOC=C1C)O AK101261 [0,1,0,0,1,0|2,0,0]=4 866 B9R1.41 OC(=O)C1=C(Br)C=CO1 AK110945 [0,1,0,0,1,0|2,0,0]=4 867 B9R1.41 OC(=O)C1=C(Cl)C=CS1 AK-48375 [0,1,0,0,1,0|2,0,0]=4 868 B9R1.41 OC(=O)C1=C(Cl)NN=C1 AK-99982 [0,1,0,0,1,0|2,0,0]=4 869 B11R1.20 C1=C(C=CC(=C1)F)CC(O)=O AK-49121 [0,1,0,0,0,1|2,0,0]=4 870 B11R1.20 C1=CC(=CC=C1CC(C)=O)F AK-50578 [0,1,0,0,0,1|2,0,0]=4 871 B11R1.20 C1=CC(=CC=C1N)CC(O)=O AK-47573 [0,1,0,0,0,1|2,0,0]=4 872 B11R1.20 CC(NC1=CC=C(C)C=C1)=O AK208638 [0,1,0,0,0,1|2,0,0]=4 873 B11R1.20 CC(NC1=CC=C(I)C=C1)=O AK115722 [0,1,0,0,0,1|2,0,0]=4 874 B11R1.20 CC(NC1=CC=C(O)N=C1)=O AK152813 [0,1,0,0,0,1|1,0,0]=3 875 B11R1.20 NC(=O)NC1=CC=C(Cl)C=C1 AK-59139 [0,1,0,0,0,1|1,0,0]=3 876 B11R1.20 O=C(N)CC1=CC=C(Cl)C=C1 AK201413 [0,1,0,0,0,1|1,0,0]=3 877 B11R1.20 O=C(N)CC1=NC=C(Br)C=C1 AK141365 [0,1,0,0,0,1|2,0,0]=4 878 B11R1.20 O=C(O)CC1=CC=C(C)C=C1 AK-45538 [0,1,0,0,0,1|2,0,0]=4 879 B11R1.20 O=C(O)CC1=CC=C(Cl)N=C1 AK-48828 [0,1,0,0,0,1|1,0,0]=3 880 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 AK-45403 [0,1,0,0,0,1|2,0,0]=4 881 B11R1.20 O=C(O)CC1=CC=C(N)N=C1 AK112112 [0,1,0,0,0,1|1,0,0]=3 882 B11R1.20 OC(=O)CC1=CC=C(Br)C=C1 AK-45378 [0,1,0,0,0,1|2,0,0]=4 883 B11R1.20 OC(=O)CC1=CC=C(Cl)C=C1 AK-76702 [0,1,0,0,0,1|2,0,0]=4 884 B11R1.20 OC(=O)CC1=CC=C(O)C=C1 AK101098 [0,1,0,0,0,1|2,0,0]=4 885 B11R1.20 S=C(N)NC1=CC=C(C)C=C1 AK161770 [0,1,0,0,0,1|1,1,0]=4 886 B11R1.36 C1=C(C(C(O)=O)Br)C=CC=C1 AK-47433 [0,1,0,0,0,1|2,0,0]=4 887 B11R1.36 C1=C(C(C(O)=O)C)C=CC=C1 AK-50598 [0,1,0,0,0,1|2,0,0]=4 888 B11R1.36 C1=CC=CC=C1C(C(O)=O)O AK-54084 [0,1,0,0,0,1|2,0,0]=4 889 B11R1.36 CC(C(C1=CC=CC=C1)=O)=O AK116651 [0,1,0,0,0,1|2,0,0]=4 890 B11R1.36 C[C@@H](C1=CC=CC=C1)C(O)=O AK-42526 [0,1,0,0,0,1|2,0,0]=4 891 B11R1.36 C[C@H](C1=CC=CC=C1)C(O)=O AK-42515 [0,1,0,0,0,1|2,0,0]=4 892 B11R1.36 N[C@H](C(=O)N)C1=CC=CC=C1 AK-35984 [0,1,0,0,0,1|1,0,0]=3 893 B11R1.36 O=C(Cl)[C@H](N)C1=CC=CC=C1 AK-48226 [0,1,0,0,0,1|2,0,0]=4 894 B11R1.36 O=C(N)C(O)C1=CC=CC=C1 AK198609 [0,1,0,0,0,1|1,0,0]=3 895 B11R1.36 O=C(N)[C@H](N)C1=CC=CC=C1 AK-70916 [0,1,0,0,0,1|1,0,0]=3 896 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 AK107681 [0,1,0,0,0,1|2,0,0]=4 897 B11R1.36 O=C(O)C(N)C1=CC=CC=C1 AK-46549 [0,1,0,0,0,1|2,0,0]=4 898 B11R1.36 O=C(O)[C@@H](N)C1=CC=CC=C1 AK-48119 [0,1,0,0,0,1|2,0,0]=4 899 B11R1.36 O=C(O)[C@H](N)C1=CC=CC=C1 AK-44130 [0,1,0,0,0,1|2,0,0]=4 900 B11R1.36 O=C(O)[C@H](N)C1=CC=CC=C1 AK105883 [0,1,0,0,0,1|2,0,0]=4 901 B11R1.36 [C@@H](O)(C1=CC=CC=C1)C(=O)O AK-47567 [0,1,0,0,0,1|2,0,0]=4 902 B11R1.36 [C@H](C1=CC=CC=C1)(C(O)=O)O AK-42339 [0,1,0,0,0,1|2,0,0]=4 903 B11R1.40 C=CC(NC1=CC=CC=C1)=O AK122185 [0,1,0,0,0,1|2,0,0]=4 904 B11R1.40 NNC(=O)CC1=CC=CC=C1 AK-77117 [0,1,0,0,0,1|1,0,0]=3 905 B11R1.40 O=C(NC)CC1=CC=CN=C1 AK175433 [0,1,0,0,0,1|0,0,0]=2 906 B11R1.40 O=C(NC1=CC=CC=C1)CCl AK-95957 [0,1,0,0,0,1|2,0,0]=4 907 B11R1.40 O=C(NN)CC1=CC=NC=C1 AK110454 [0,1,0,0,0,1|2,0,0]=4 908 B11R1.40 O=C(OC)CC1=CC=CC=C1 AK163377 [0,1,0,0,0,1|2,0,0]=4 909 B11R1.40 O=C(OC)CC1=NC=CN=C1 AK-45166 [0,1,0,0,0,1|2,0,0]=4 910 B11R1.40 O=C(OC)OC1=CC=CC=C1 AK600729 [0,1,0,0,0,1|2,0,0]=4 911 B11R1.40 O=C(OC1=CC=CC=C1)CBr AK105971 [0,1,0,0,0,1|2,0,0]=4 912 B11R1.86 C1=C(CC(=O)C)C(=CC=C1)Br AK-47295 [0,1,0,0,0,1|2,0,0]=4 913 B11R1.86 C1=CC=CC(=C1CC(O)=O)C AK-45537 [0,1,0,0,0,1|2,0,0]=4 914 B11R1.86 C1=CC=CC(=C1CC(O)=O)O AK-47284 [0,1,0,0,0,1|2,0,0]=4 915 B11R1.86 CC(CC1=CC=CC=C1F)=O AK117069 [0,1,0,0,0,1|2,0,0]=4 916 B11R1.86 CC(NC1=CC=CC=C1N)=O AK112083 [0,1,0,0,0,1|2,0,0]=4 917 B11R1.86 CC(NC1=CC=CC=C1O)=O AK116958 [0,1,0,0,0,1|2,0,0]=4 918 B11R1.86 IC1=C(C=CC=C1)CC(=O)O AK-73107 [0,1,0,0,0,1|2,0,0]=4 919 B11R1.86 NC1=NC=CC=C1CC(O)=O AK-68736 [0,1,0,0,0,1|1,0,0]=3 920 B11R1.86 O=C(O)CC1=CC=CC=C1Br AK-45376 [0,1,0,0,0,1|2,0,0]=4 921 B11R1.86 O=C(O)CC1=CC=CC=C1F AK-29262 [0,1,0,0,0,1|2,0,0]=4 922 B11R1.86 O=C(O)CC1=CC=CN=C1Cl AK139178 [0,1,0,0,0,1|1,0,0]=3 923 B11R1.157 C1=C(C=CC=C1Cl)CC(O)=O AK-47464 [0,1,0,0,0,1|2,0,0]=4 924 B11R1.157 C1=C(C=CC=C1F)CC(O)=O AK-72993 [0,1,0,0,0,1|2,0,0]=4 925 B11R1.157 C1=C(C=CC=C1O)CC(O)=O AK-48396 [0,1,0,0,0,1|2,0,0]=4 926 B11R1.157 CC(=O)CC1=CC(F)=CC=C1 AK-60937 [0,1,0,0,0,1|2,0,0]=4 927 B11R1.157 CC(CC1=CC=CC(Br)=C1)=O AK-94137 [0,1,0,0,0,1|2,0,0]=4 928 B11R1.157 CC(NC1=CC=CC(N)=C1)=O AK-76549 [0,1,0,0,0,1|2,0,0]=4 929 B11R1.157 CC(NC1=CC=CC(O)=C1)=O AK-84439 [0,1,0,0,0,1|2,0,0]=4 930 B11R1.157 CC(OC1=CC=CC(Br)=C1)=O AK-80146 [0,1,0,0,0,1|2,0,0]=4 931 B11R1.157 CC(OC1=CC=CC(F)=C1)=O AK135677 [0,1,0,0,0,1|2,0,0]=4 932 B11R1.157 ClC1=CN=CC(=N1)CC(=O)O AK-26671 [0,1,0,0,0,1|2,0,0]=4 933 B11R1.157 O=C(N)CC1=CC=CC(Cl)=C1 AK-86174 [0,1,0,0,0,1|1,0,0]=3 934 B11R1.157 O=C(N)CC1=CC=CC(N)=C1 AK124849 [0,1,0,0,0,1|1,0,0]=3 935 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 AK113021 [0,1,0,0,0,1|1,0,0]=3 936 B11R1.157 O=C(O)CC1=CC=CC(Br)=C1 AK-42053 [0,1,0,0,0,1|2,0,0]=4 937 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 AK-61642 [0,1,0,0,0,1|2,0,0]=4 938 B11R1.509 O=S(CC1=CC=CC=C1)(N)=O AK-32283 [0,1,0,0,0,1|2,0,0]=4 939 B11R1.3 C(#C)C1=CC=C(C(=O)O)C=C1 AK-44236 [0,2,0,0,0,0|2,0,0]=4 940 B11R1.3 C1=C(C=CC(=C1)C=O)C(O)=O AK-45367 [0,2,0,0,0,0|2,0,0]=4 941 B11R1.3 C1=C(C=CC(=C1)CN)C(O)=O AK-35678 [0,2,0,0,0,0|2,0,0]=4 942 B11R1.3 C1=CC(=CC=C1C(O)=O)CO AK-25734 [0,2,0,0,0,0|2,0,0]=4 943 B11R1.3 C1=CC(=NC=C1C(=O)O)NN AK-33131 [0,2,0,0,0,0|1,0,0]=3 944 B11R1.3 CC(=O)C1=NC=C(N=C1)C#N AK-55120 [0,2,0,0,0,0|2,0,0]=4 945 B11R1.3 CC(C1=CC=C(CBr)C=C1)=O AK-35404 [0,2,0,0,0,0|2,0,0]=4 946 B11R1.3 CC(C1=CC=C(CN)C=C1)=O AK158889 [0,2,0,0,0,0|2,0,0]=4 947 B11R1.3 CC(C1=CC=C(NC)C=C1)=O AK145581 [0,2,0,0,0,0|2,0,0]=4 948 B11R1.3 CC(C1=CC=C(OC)N=C1)=O AK-76404 [0,2,0,0,0,0|1,0,0]=3 949 B11R1.3 CC(C1=CC=C(SC)C=C1)=O AK164075 [0,2,0,0,0,0|2,0,0]=4 950 B11R1.3 COC1=CN=C(C=N1)C(=O)O AK-25141 [0,2,0,0,0,0|2,0,0]=4 951 B11R1.3 N#CC1=CC=C(C(C)=O)C=C1 AK-44531 [0,2,0,0,0,0|2,0,0]=4 952 B11R1.3 N=C(N)C1=CC=C(C#N)C=C1 AK209127 [0,2,0,0,0,0|2,0,0]=4 953 B11R1.3 N=C(N)C1=CC=C(OC)C=C1 AK-98683 [0,2,0,0,0,0|2,0,0]=4 954 B11R1.3 N=C(N)C1=CN=C(OC)C=C1 AK-76650 [0,2,0,0,0,0|1,0,0]=3 955 B11R1.3 O=C(C1=CN=C(NC)N=C1)O AK115951 [0,2,0,0,0,0|2,0,0]=4 956 B11R1.3 O=C(C1=CN=C(OC)C=C1)O AK-30103 [0,2,0,0,0,0|1,0,0]=3 957 B11R1.3 O=C(C1=CN=C(SC)N=C1)O AK-26821 [0,2,0,0,0,0|2,0,0]=4 958 B11R1.3 O=C(C1=NC=C(C#N)N=C1)O AK137311 [0,2,0,0,0,0|2,0,0]=4 959 B11R1.3 O=C(N)C1=CC=C(CN)C=C1 AK155450 [0,2,0,0,0,0|1,0,0]=3 960 B11R1.3 O=C(N)C1=CC=C(OC)C=C1 AK114264 [0,2,0,0,0,0|1,0,0]=3 961 B11R1.3 O=C(O)C1=CC=C(C=C)C=C1 AK-45760 [0,2,0,0,0,0|2,0,0]=4 962 B11R1.3 O=C(O)C1=CC=C(CC)C=C1 AK114313 [0,2,0,0,0,0|2,0,0]=4 963 B11R1.3 O=C(O)C1=CC=C(NN)C=C1 AK-79152 [0,2,0,0,0,0|2,0,0]=4 964 B11R1.3 O=C(O)C1=CC=C(NN)C=C1 AK-88500 [0,2,0,0,0,0|2,0,0]=4 965 B11R1.3 O=C(O)C1=CC=C(OC)C=C1 AK-41188 [0,2,0,0,0,0|2,0,0]=4 966 B11R1.3 O=C(O)C1=CN=C(CO)C=C1 AK123526 [0,2,0,0,0,0|1,0,0]=3 967 B11R1.3 O=CC1=NC=C([N+]([O-])=O)C=C1 AK-46158 [0,2,0,0,0,0|2,0,0]=4 968 B11R1.3 OCC1=NC=C(C=C1)[N+]([O-])=O AK-76747 [0,2,0,0,0,0|2,0,0]=4 969 B11R1.3 S=C(C1=CC=C(OC)N=C1)N AK-45169 [0,2,0,0,0,0|0,1,0]=3 970 B11R1.3 [N+](=O)([O-])C1=CC=C(N=C1)C#N AK-28040 [0,2,0,0,0,0|2,0,0]=4 971 B11R1.19 ClC1=NC=C(C=C1)[S](=O)(=O)Cl AK-32252 [0,2,0,0,0,0|2,0,0]=4 972 B11R1.19 NS(=O)(=O)C1=CC=C(Br)C=C1 AK-26275 [0,2,0,0,0,0|2,0,0]=4 973 B11R1.19 NS(=O)(=O)C1=CC=C(Cl)N=C1 AK-35078 [0,2,0,0,0,0|1,0,0]=3 974 B11R1.19 O=S(C1=CC=C(Cl)C=C1)(N)=O AK151256 [0,2,0,0,0,0|2,0,0]=4 975 B11R1.19 O=S(C1=CC=C(N)N=C1)(O)=O AK-63658 [0,2,0,0,0,0|2,0,0]=4 976 B11R1.21 BrC1=C(C=C(C(=O)O)C=C1)O AK-39977 [0,2,0,0,0,0|2,0,0]=4 977 B11R1.21 BrC1=C(C=C(C=C1)C(C)=O)F AK-34604 [0,2,0,0,0,0|2,0,0]=4 978 B11R1.21 BrC1=C(C=CC(=C1)C(=O)O)Cl AK-30019 [0,2,0,0,0,0|2,0,0]=4 979 B11R1.21 BrC1=CC(=CN=C1O)[N+](=O)[O-] AK-27953 [0,2,0,0,0,0|2,0,0]=4 980 B11R1.21 BrC1=NC=C(C=C1Cl)[N+](=O)[O-] AK-29011 [0,2,0,0,0,0|2,0,0]=4 981 B11R1.21 C1=C(C(=CC=C1C(=O)C)F)C AK-48194 [0,2,0,0,0,0|2,0,0]=4 982 B11R1.21 C1=C(C(=CC=C1C(=O)O)C)N AK-34321 [0,2,0,0,0,0|2,0,0]=4 983 B11R1.21 C1=C(C(=CC=C1C(=O)O)N)C AK-34339 [0,2,0,0,0,0|2,0,0]=4 984 B11R1.21 C1=C(C(=CC=C1C(C)=O)F)Br AK-50601 [0,2,0,0,0,0|2,0,0]=4 985 B11R1.21 C1=C(C(=CC=C1C(O)=O)Cl)O AK-25796 [0,2,0,0,0,0|2,0,0]=4 986 B11R1.21 C1=C(C(=CC=C1C(O)=O)O)C AK-46719 [0,2,0,0,0,0|2,0,0]=4 987 B11R1.21 C1=C(C)C(=NC=C1[N+]([O-])=O)Br AK-25626 [0,2,0,0,0,0|2,0,0]=4 988 B11R1.21 C1=C(C=CC(=C1Br)C)C(O)=O AK-36339 [0,2,0,0,0,0|2,0,0]=4 989 B11R1.21 C1=C(C=CC(=C1C)Cl)C(O)=O AK-47580 [0,2,0,0,0,0|2,0,0]=4 990 B11R1.21 C1=C(C=CC(=C1Cl)Cl)C(O)=O AK-46631 [0,2,0,0,0,0|2,0,0]=4 991 B11R1.21 C1=C(C=CC(=C1F)C)C(O)=O AK-34796 [0,2,0,0,0,0|2,0,0]=4 992 B11R1.21 C1=C(C=CC(=C1F)F)C(O)=O AK-47373 [0,2,0,0,0,0|2,0,0]=4 993 B11R1.21 C1=C(C=CC(=C1F)O)C(C)=O AK-42173 [0,2,0,0,0,0|2,0,0]=4 994 B11R1.21 C1=C(C=CC(=C1O)O)C(O)=O AK-47644 [0,2,0,0,0,0|2,0,0]=4 995 B11R1.21 C1=C(C=NC(=C1C)Cl)[N+](=O)[O-] AK-26864 [0,2,0,0,0,0|2,0,0]=4 996 B11R1.21 C1=C(O)C(=CC=C1C(=O)O)N AK-34278 [0,2,0,0,0,0|2,0,0]=4 997 B11R1.21 C1=CC(=C(C=C1C(=O)O)I)F AK-35058 [0,2,0,0,0,0|2,0,0]=4 998 B11R1.21 C1=CC(=C(C=C1C(O)=O)F)N AK-35239 [0,2,0,0,0,0|2,0,0]=4 999 B11R1.21 C1=CC(=CC(=C1F)Cl)C(=O)C AK-49084 [0,2,0,0,0,0|2,0,0]=4 1000 B11R1.21 CC(C1=CC(C)=C(Cl)N=C1)=O AK139010 [0,2,0,0,0,0|1,0,0]=3 1001 B11R1.21 CC(C1=CC=C(Br)C(C)=C1)=O AK-65018 [0,2,0,0,0,0|2,0,0]=4 1002 B11R1.21 CC(C1=CC=C(Br)C(Cl)=C1)=O AK114290 [0,2,0,0,0,0|2,0,0]=4 1003 B11R1.21 CC(C1=CC=C(Cl)C(C)=C1)=O AK-51511 [0,2,0,0,0,0|2,0,0]=4 1004 B11R1.21 CC(C1=CC=C(Cl)C(Cl)=C1)=O AK-41915 [0,2,0,0,0,0|2,0,0]=4 1005 B11R1.21 CC(C1=CC=C(Cl)C(N)=C1)=O AK-45178 [0,2,0,0,0,0|2,0,0]=4 1006 B11R1.21 CC(C1=CC=C(F)C(F)=C1)=O AK-53703 [0,2,0,0,0,0|2,0,0]=4 1007 B11R1.21 CC(C1=CC=C(I)C(Br)=C1)=O AK482929 [0,2,0,0,0,0|2,0,0]=4 1008 B11R1.21 CC(C1=CC=C(N)C(F)=C1)=O AK-94340 [0,2,0,0,0,0|2,0,0]=4 1009 B11R1.21 CC(C1=CC=C(O)C(Br)=C1)=O AK201265 [0,2,0,0,0,0|2,0,0]=4 1010 B11R1.21 CC(C1=CC=C(O)C(C)=C1)=O AK-41189 [0,2,0,0,0,0|2,0,0]=4 1011 B11R1.21 CC(C1=CC=C(O)C(O)=C1)=O AK-42350 [0,2,0,0,0,0|2,0,0]=4 1012 B11R1.21 CC1=CC(=CN=C1N)[N+]([O-])=O AK-26897 [0,2,0,0,0,0|2,0,0]=4 1013 B11R1.21 CC1=CC(=CNC1=O)C(O)=O AK-78282 [0,2,0,0,0,0|1,0,1]=4 1014 B11R1.21 ClC1=NC=C(C=C1Cl)[N+](=O)[O-] AK-29010 [0,2,0,0,0,0|2,0,0]=4 1015 B11R1.21 FC1=C(C=CC(=C1)C(=O)O)I AK-36475 [0,2,0,0,0,0|2,0,0]=4 1016 B11R1.21 N=C(N)C1=CC=C(C)C(F)=C1 AK-63979 [0,2,0,0,0,0|2,0,0]=4 1017 B11R1.21 NC(=O)C1=CC(Br)=C(F)C=C1 AK-87520 [0,2,0,0,0,0|1,0,0]=3 1018 B11R1.21 NC1=C(I)C=CC(=C1)C(O)=O AK-82318 [0,2,0,0,0,0|2,0,0]=4 1019 B11R1.21 NC1=C(O)C=CC(=C1)C(O)=O AK-33476 [0,2,0,0,0,0|2,0,0]=4 1020 B11R1.21 NC1=CC(=CC=C1Cl)C(O)=O AK-73058 [0,2,0,0,0,0|2,0,0]=4 1021 B11R1.21 NC1=NC=C(C=C1Cl)[N+](=O)[O-] AK-21932 [0,2,0,0,0,0|2,0,0]=4 1022 B11R1.21 NC1=NC=C(C=C1I)[N+](=O)[O-] AK-24380 [0,2,0,0,0,0|2,0,0]=4 1023 B11R1.21 NC1=NC=C([N+]([O-])=O)C=C1Br AK-28838 [0,2,0,0,0,0|2,0,0]=4 1024 B11R1.21 O=C(C1=CC(Br)=C(Br)N=C1)O AK-29099 [0,2,0,0,0,0|1,0,0]=3 1025 B11R1.21 O=C(C1=CC(Cl)=C(Cl)N=C1)O AK-25953 [0,2,0,0,0,0|1,0,0]=3 1026 B11R1.21 O=C(C1=CN=C(C)C(C)S1)N AK486932 [0,2,0,0,0,0|1,0,1]=4 1027 B11R1.21 O=C(C1=NC(Cl)=C(Cl)N=C1)O AK133010 [0,2,0,0,0,0|2,0,0]=4 1028 B11R1.21 O=C(C=1C=CC(N(C1)C)=O)N AK145245 [0,2,0,0,0,0|0,0,1]=3 1029 B11R1.21 O=C(C=1C=CC(N(C1)C)=O)O AK-34900 [0,2,0,0,0,0|1,0,1]=4 1030 B11R1.21 O=C(N)C1=CC=C(N)C(O)=C1 AK437623 [0,2,0,0,0,0|1,0,0]=3 1031 B11R1.21 O=C(O)C1=CC=C(Br)C(Br)=C1 AK-64921 [0,2,0,0,0,0|2,0,0]=4 1032 B11R1.21 O=C(O)C1=CC=C(Br)C(C)=C1 AK-26325 [0,2,0,0,0,0|2,0,0]=4 1033 B11R1.21 O=C(O)C1=CC=C(Br)C(Cl)=C1 AK-86432 [0,2,0,0,0,0|2,0,0]=4 1034 B11R1.21 O=C(O)C1=CC=C(Br)C(F)=C1 AK-50383 [0,2,0,0,0,0|2,0,0]=4 1035 B11R1.21 O=C(O)C1=CC=C(Br)C(N)=C1 AK-34514 [0,2,0,0,0,0|2,0,0]=4 1036 B11R1.21 O=C(O)C1=CC=C(C)C(Cl)=C1 AK-73060 [0,2,0,0,0,0|2,0,0]=4 1037 B11R1.21 O=C(O)C1=CC=C(C)C(I)=C1 AK-51540 [0,2,0,0,0,0|2,0,0]=4 1038 B11R1.21 O=C(O)C1=CC=C(C)C(O)=C1 AK-61869 [0,2,0,0,0,0|2,0,0]=4 1039 B11R1.21 O=C(O)C1=CC=C(Cl)C(F)=C1 AK-35057 [0,2,0,0,0,0|2,0,0]=4 1040 B11R1.21 O=C(O)C1=CC=C(F)C(Br)=C1 AK-32644 [0,2,0,0,0,0|2,0,0]=4 1041 B11R1.21 O=C(O)C1=CC=C(F)C(C)=C1 AK-35056 [0,2,0,0,0,0|2,0,0]=4 1042 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=C1 AK-53849 [0,2,0,0,0,0|2,0,0]=4 1043 B11R1.21 O=C(O)C1=CC=C(F)C(N)=C1 AK-34274 [0,2,0,0,0,0|2,0,0]=4 1044 B11R1.21 O=C(O)C1=CC=C(F)C(O)=C1 AK-35418 [0,2,0,0,0,0|2,0,0]=4 1045 B11R1.21 O=C(O)C1=CC=C(I)C(Cl)=C1 AK174208 [0,2,0,0,0,0|2,0,0]=4 1046 B11R1.21 O=C(O)C1=CC=C(I)C(O)=C1 AK-44390 [0,2,0,0,0,0|2,0,0]=4 1047 B11R1.21 O=C(O)C1=CC=C(N)C(Br)=C1 AK-35930 [0,2,0,0,0,0|2,0,0]=4 1048 B11R1.21 O=C(O)C1=CC=C(N)C(Cl)=C1 AK-34340 [0,2,0,0,0,0|2,0,0]=4 1049 B11R1.21 O=C(O)C1=CC=C(N)C(N)=C1 AK-45165 [0,2,0,0,0,0|2,0,0]=4 1050 B11R1.21 O=C(O)C1=CC=C(O)C(F)=C1 AK-34797 [0,2,0,0,0,0|2,0,0]=4 1051 B11R1.21 O=C(O)C1=CN=C(Cl)C(Br)=C1 AK-23816 [0,2,0,0,0,0|1,0,0]=3 1052 B11R1.21 O=C(O)C1=CN=C(Cl)C(F)=C1 AK173995 [0,2,0,0,0,0|1,0,0]=3 1053 B11R1.21 O=C(O)C1=CN=C(Cl)C(I)=C1 AK324930 [0,2,0,0,0,0|1,0,0]=3 1054 B11R1.21 O=C(O)C1=CN=C(F)C(Br)=C1 AK-49660 [0,2,0,0,0,0|1,0,0]=3 1055 B11R1.21 O=C(O)C1=CN=C(N)C(Br)=C1 AK-25059 [0,2,0,0,0,0|1,0,0]=3 1056 B11R1.21 O=C(O)C1=CN=C(N)C(N)=C1 AK126240 [0,2,0,0,0,0|1,0,0]=3 1057 B11R1.21 O=[N+](C1=CN=C(Br)C(Br)=C1)[O-] AK-28840 [0,2,0,0,0,0|2,0,0]=4 1058 B11R1.21 O=[N+](C1=CN=C(C)C(Br)=C1)[O-] AK-44573 [0,2,0,0,0,0|2,0,0]=4 1059 B11R1.21 O=[N+](C1=CN=C(Cl)C(Br)=C1)[O-] AK-27952 [0,2,0,0,0,0|2,0,0]=4 1060 B11R1.21 O=[N+](C1=CN=C(F)C(C)=C1)[O-] AK-37343 [0,2,0,0,0,0|2,0,0]=4 1061 B11R1.21 O=[N+](C1=CN=C(F)C(F)=C1)[O-] AK-64796 [0,2,0,0,0,0|2,0,0]=4 1062 B11R1.21 OC(=O)C1=CC(Br)=C(I)C=C1 AK-80847 [0,2,0,0,0,0|2,0,0]=4 1063 B11R1.21 OC(=O)C1=CC(I)=C(Br)C=C1 AK-64714 [0,2,0,0,0,0|2,0,0]=4 1064 B11R1.21 OC(=O)C1=CC(I)=C(Cl)C=C1 AK-35135 [0,2,0,0,0,0|2,0,0]=4 1065 B11R1.21 OC1=CC([N+]([O-])=O)=CN=C1N AK-30819 [0,2,0,0,0,0|2,0,0]=4 1066 B11R1.21 OC1=NC=C([N+]([O-])=O)C=C1I AK-48074 [0,2,0,0,0,0|2,0,0]=4 1067 B11R1.21 [O-][N+](=O)C1=CN=C(Cl)C(F)=C1 AK-37301 [0,2,0,0,0,0|2,0,0]=4 1068 B11R1.22 BrC1=CN=C(C=N1)C(=O)OC AK-24801 [0,2,0,0,0,0|2,0,0]=4 1069 B11R1.22 C1=C(C=CC(=C1)Br)C(OC)=O AK-47340 [0,2,0,0,0,0|2,0,0]=4 1070 B11R1.22 C1=C(C=CC(=C1)C)C(CBr)=O AK-73063 [0,2,0,0,0,0|2,0,0]=4 1071 B11R1.22 C1=C(C=CC(=C1)Cl)C(CC)=O AK-47430 [0,2,0,0,0,0|2,0,0]=4 1072 B11R1.22 C1=C(C=CC(=C1)N)C(OC)=O AK-48394 [0,2,0,0,0,0|2,0,0]=4 1073 B11R1.22 C1=CC(=NC=C1C(OC)=O)Cl AK-32450 [0,2,0,0,0,0|1,0,0]=3 1074 B11R1.22 C1=NC(=CC=C1C(=O)OC)Br AK-27762 [0,2,0,0,0,0|1,0,0]=3 1075 B11R1.22 CCC(C1=CC=C(Br)C=C1)=O AK133038 [0,2,0,0,0,0|2,0,0]=4 1076 B11R1.22 CCC(C1=CC=C(F)C=C1)=O AK-77665 [0,2,0,0,0,0|2,0,0]=4 1077 B11R1.22 CCC(C1=CC=C(I)C=C1)=O AK149241 [0,2,0,0,0,0|2,0,0]=4 1078 B11R1.22 CCC(C1=CC=C(O)C=C1)=O AK-44068 [0,2,0,0,0,0|2,0,0]=4 1079 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 AK-42930 [0,2,0,0,0,0|1,0,0]=3 1080 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 AK-57163 [0,2,0,0,0,0|2,0,0]=4 1081 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 AK-25021 [0,2,0,0,0,0|2,0,0]=4 1082 B11R1.22 ClC1=CC=C(C(CN)=O)C=C1 AK-27718 [0,2,0,0,0,0|1,0,0]=3 1083 B11R1.22 ClC1=CC=C(C=C1)C(=O)C=O AK-10005 [0,2,0,0,0,0|2,0,0]=4 1084 B11R1.22 ClC1=CC=C(N=N1)C(=O)OC AK-24016 [0,2,0,0,0,0|2,0,0]=4 1085 B11R1.22 ClC1=CC=C([C@@H](N)CO)C=N1 AK684516 [0,2,0,0,0,0|0,0,2]=4 1086 B11R1.22 ClC1=CN=C(C=N1)C(=O)NN AK-28354 [0,2,0,0,0,0|1,0,0]=3 1087 B11R1.22 ClC1=CN=C(C=N1)C(=O)OC AK-23920 [0,2,0,0,0,0|2,0,0]=4 1088 B11R1.22 FC1=CC=C(C=N1)C(=O)OC AK-40001 [0,2,0,0,0,0|1,0,0]=3 1089 B11R1.22 IC1=CC=C(C(CBr)=O)C=C1 AK-25760 [0,2,0,0,0,0|2,0,0]=4 1090 B11R1.22 N1C=C(C(=O)NN)C=CC1=O AK-25381 [0,2,0,0,0,0|0,0,1]=3 1091 B11R1.22 NC1=NC=C(C=N1)C(=O)OC AK-21981 [0,2,0,0,0,0|2,0,0]=4 1092 B11R1.22 NCC(=O)C1=CC=C(C=C1)F AK-32227 [0,2,0,0,0,0|1,0,0]=3 1093 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 AK101127 [0,2,0,0,0,0|1,0,0]=3 1094 B11R1.22 NCC(C1=CC=C(Br)C=C1)=O AK-42272 [0,2,0,0,0,0|1,0,0]=3 1095 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 AK-76998 [0,2,0,0,0,0|1,0,0]=3 1096 B11R1.22 O=C(C1=CC=C(Br)C=C1)CCl AK-41703 [0,2,0,0,0,0|2,0,0]=4 1097 B11R1.22 O=C(C1=CC=C(F)C=C1)C=O AK-10004 [0,2,0,0,0,0|2,0,0]=4 1098 B11R1.22 O=C(C1=CN=C(Cl)N=C1)NC AK106982 [0,2,0,0,0,0|1,0,0]=3 1099 B11R1.22 O=C(C1=CNC(N=C1)=O)OC AK138906 [0,2,0,0,0,0|2,0,0]=4 1100 B11R1.22 O=C(C1=COC(C=C1)=O)OC AK-94193 [0,2,0,0,0,0|2,0,0]=4 1101 B11R1.22 O=C(C1=NC=C(N)N=C1)OC AK-59002 [0,2,0,0,0,0|2,0,0]=4 1102 B11R1.22 O=C(NC)C1=CC=C(Br)C=C1 AK-86242 [0,2,0,0,0,0|1,0,0]=3 1103 B11R1.22 O=C(NC)C1=CN=C(Cl)C=C1 AK-41767 [0,2,0,0,0,0|0,0,0]=2 1104 B11R1.22 O=C(NN)C1=NC=C(F)C=C1 AK-97226 [0,2,0,0,0,0|2,0,0]=4 1105 B11R1.22 O=C(OC)C1=CC=C(C)C=C1 AK110414 [0,2,0,0,0,0|2,0,0]=4 1106 B11R1.22 O=C(OC)C1=CC=C(F)C=C1 AK-45398 [0,2,0,0,0,0|2,0,0]=4 1107 B11R1.22 O=C(OC)C1=CC=C(I)C=C1 AK-45406 [0,2,0,0,0,0|2,0,0]=4 1108 B11R1.22 O=C(OC)C1=CC=C(O)C=C1 AK-54335 [0,2,0,0,0,0|2,0,0]=4 1109 B11R1.22 O=C(OC)C1=CN=C(C)C=C1 AK-28562 [0,2,0,0,0,0|1,0,0]=3 1110 B11R1.22 O=C(OC)C1=CN=C(N)C=C1 AK-25008 [0,2,0,0,0,0|1,0,0]=3 1111 B11R1.22 O=C(OC)C1=CN=C(O)C=C1 AK-26234 [0,2,0,0,0,0|1,0,0]=3 1112 B11R1.22 OC1=CC=C(C=C1)C(=O)CBr AK-34343 [0,2,0,0,0,0|2,0,0]=4 1113 B11R1.22 OC1=CN=C(C=N1)C(=O)OC AK-24812 [0,2,0,0,0,0|2,0,0]=4 1114 B11R1.166 BrC1=C(C(=O)O)C=CC(=C1)Cl AK-36919 [0,2,0,0,0,0|2,0,0]=4 1115 B11R1.166 BrC1=NC(=C(C=C1)[N+](=O)[O-])C AK-27983 [0,2,0,0,0,0|2,0,0]=4 1116 B11R1.166 BrC1=NC(=CC=C1[N+](=O)[O-])Br AK-26122 [0,2,0,0,0,0|2,0,0]=4 1117 B11R1.166 BrC1=NC(=CC=C1[N+](=O)[O-])Cl AK-30571 [0,2,0,0,0,0|2,0,0]=4 1118 B11R1.166 C1=C(C(=CC(=C1)Br)N)C(=O)O AK-34046 [0,2,0,0,0,0|2,0,0]=4 1119 B11R1.166 C1=C(C(=CC(=C1)Cl)I)C(O)=O AK-46379 [0,2,0,0,0,0|2,0,0]=4 1120 B11R1.166 C1=C(C(=CC(=C1)Cl)N)C(O)=O AK-36798 [0,2,0,0,0,0|2,0,0]=4 1121 B11R1.166 C1=C(C(=CC(=N1)Cl)C)[N+](=O)[O-] AK-25622 [0,2,0,0,0,0|2,0,0]=4 1122 B11R1.166 C1=C(C(=CC=C1C)C(=O)O)N AK-25621 [0,2,0,0,0,0|2,0,0]=4 1123 B11R1.166 C1=C(C(=CC=C1Cl)C(C)=O)Cl AK-47301 [0,2,0,0,0,0|2,0,0]=4 1124 B11R1.166 C1=C(C(=CC=C1N)C(=O)O)C AK-27038 [0,2,0,0,0,0|2,0,0]=4 1125 B11R1.166 C1=C(C(=NC(=C1)Cl)Cl)[N+](=O)[O-] AK-25472 [0,2,0,0,0,0|2,0,0]=4 1126 B11R1.166 C1=CC(=C(C=C1N)Cl)C(O)=O AK-29059 [0,2,0,0,0,0|2,0,0]=4 1127 B11R1.166 C1=CC(=CC(=C1C(C)=O)F)F AK-46615 [0,2,0,0,0,0|2,0,0]=4 1128 B11R1.166 C1=CC(=CC(=C1C(C)=O)F)O AK-49094 [0,2,0,0,0,0|2,0,0]=4 1129 B11R1.166 C1=CC(=CC(=C1C(O)=O)Br)Br AK-45532 [0,2,0,0,0,0|2,0,0]=4 1130 B11R1.166 C1=CC(=CC(=C1C(O)=O)C)Br AK-26260 [0,2,0,0,0,0|2,0,0]=4 1131 B11R1.166 C1=CC(=CC(=C1C(O)=O)C)C AK-47303 [0,2,0,0,0,0|2,0,0]=4 1132 B11R1.166 C1=CC(=CC(=C1C(O)=O)C)Cl AK-32606 [0,2,0,0,0,0|2,0,0]=4 1133 B11R1.166 C1=CC(=CC(=C1C(O)=O)Cl)Cl AK-46538 [0,2,0,0,0,0|2,0,0]=4 1134 B11R1.166 C1=CC(=CC(=C1C(O)=O)F)C AK-26324 [0,2,0,0,0,0|2,0,0]=4 1135 B11R1.166 C1=CC(=CC(=C1C(O)=O)F)F AK-49138 [0,2,0,0,0,0|2,0,0]=4 1136 B11R1.166 C1=CC(=CC(=C1C(O)=O)F)N AK-25984 [0,2,0,0,0,0|2,0,0]=4 1137 B11R1.166 C1=CC(=CC(=C1C(O)=O)O)C AK-73066 [0,2,0,0,0,0|2,0,0]=4 1138 B11R1.166 C1=CC(=CC(=C1C(O)=O)O)Cl AK-47585 [0,2,0,0,0,0|2,0,0]=4 1139 B11R1.166 C1=CC(=CC(=C1C(O)=O)O)F AK-29195 [0,2,0,0,0,0|2,0,0]=4 1140 B11R1.166 C1=CC(=NC(=C1[N+](=O)[O-])C)Cl AK-30535 [0,2,0,0,0,0|2,0,0]=4 1141 B11R1.166 C1=CC(=NC(=C1[N+]([O-])=O)Cl)C AK-24778 [0,2,0,0,0,0|2,0,0]=4 1142 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 AK-75553 [0,2,0,0,0,0|2,0,0]=4 1143 B11R1.166 CC(C1=CC=C(Br)C=C1Cl)=O AK-77175 [0,2,0,0,0,0|2,0,0]=4 1144 B11R1.166 CC(C1=CC=C(Br)C=C1F)=O AK-46535 [0,2,0,0,0,0|2,0,0]=4 1145 B11R1.166 CC(C1=CC=C(Br)C=C1N)=O AK-38008 [0,2,0,0,0,0|2,0,0]=4 1146 B11R1.166 CC(C1=CC=C(Br)C=C1O)=O AK-40002 [0,2,0,0,0,0|2,0,0]=4 1147 B11R1.166 CC(C1=CC=C(C)C=C1F)=O AK115609 [0,2,0,0,0,0|2,0,0]=4 1148 B11R1.166 CC(C1=CC=C(Cl)C=C1Br)=O AK-75637 [0,2,0,0,0,0|2,0,0]=4 1149 B11R1.166 CC(C1=CC=C(Cl)N=C1Cl)=O AK-49093 [0,2,0,0,0,0|1,0,0]=3 1150 B11R1.166 CC(C1=CC=C(F)C=C1Cl)=O AK-53695 [0,2,0,0,0,0|2,0,0]=4 1151 B11R1.166 CC(C1=CC=C(O)C=C1Br)=O AK-75734 [0,2,0,0,0,0|2,0,0]=4 1152 B11R1.166 CC(C1=CC=C(O)C=C1C)=O AK-50197 [0,2,0,0,0,0|2,0,0]=4 1153 B11R1.166 CC(C1=CC=C(O)C=C1Cl)=O AK-36102 [0,2,0,0,0,0|2,0,0]=4 1154 B11R1.166 CC(C1=CC=C(O)C=C1O)=O AK-50224 [0,2,0,0,0,0|2,0,0]=4 1155 B11R1.166 CC(C1=CN=C(Cl)N=C1Cl)=O AK126287 [0,2,0,0,0,0|2,0,0]=4 1156 B11R1.166 CC1=C(C=NC(Cl)=C1)C(O)=O AK-42673 [0,2,0,0,0,0|1,0,0]=3 1157 B11R1.166 CC1=CC=C(C(O)=N1)[N+]([O-])=O AK-30343 [0,2,0,0,0,0|2,0,0]=4 1158 B11R1.166 CC1=CC=C([N+]([O-])=O)C(N)=N1 AK-25607 [0,2,0,0,0,0|2,0,0]=4 1159 B11R1.166 CC1=NC(C)=C(C=N1)C(O)=O AK-36268 [0,2,0,0,0,0|2,0,0]=4 1160 B11R1.166 CC1=NC(F)=CC=C1[N+]([O-])=O AK-33848 [0,2,0,0,0,0|2,0,0]=4 1161 B11R1.166 CC1=NC(N)=CC=C1[N+]([O-])=O AK-25614 [0,2,0,0,0,0|2,0,0]=4 1162 B11R1.166 CC1=NC(O)=CC=C1[N+]([O-])=O AK-23864 [0,2,0,0,0,0|2,0,0]=4 1163 B11R1.166 ClC1=C(C(=O)O)C=CC(=N1)O AK-25883 [0,2,0,0,0,0|1,0,0]=3 1164 B11R1.166 ClC1=CC(=C(C=C1)C(C)=O)F AK-46375 [0,2,0,0,0,0|2,0,0]=4 1165 B11R1.166 ClC1=NC=C(C(=C1)Cl)[N+](=O)[O-] AK-24876 [0,2,0,0,0,0|2,0,0]=4 1166 B11R1.166 ClC1=NC=C(C(=N1)Cl)C(=O)Cl AK-23568 [0,2,0,0,0,0|2,0,0]=4 1167 B11R1.166 ClC1=NC=C(C(=N1)Cl)C(=O)O AK-24354 [0,2,0,0,0,0|2,0,0]=4 1168 B11R1.166 FC1=C(C(=O)O)C=CC(=C1)I AK-33039 [0,2,0,0,0,0|2,0,0]=4 1169 B11R1.166 FC1=NC(=C(C(=O)O)C=C1)C AK-30364 [0,2,0,0,0,0|1,0,0]=3 1170 B11R1.166 FC1=NC(=CC=C1[N+](=O)[O-])C AK-30295 [0,2,0,0,0,0|2,0,0]=4 1171 B11R1.166 NC(=O)C1=C(Cl)C=C(O)C=C1 AK108398 [0,2,0,0,0,0|1,0,0]=3 1172 B11R1.166 NC(=O)C1=C(N)C=C(F)C=C1 AK-77547 [0,2,0,0,0,0|1,0,0]=3 1173 B11R1.166 NC(=O)C1=CC=C(Cl)N=C1Cl AK-97072 [0,2,0,0,0,0|0,0,0]=2 1174 B11R1.166 NC(=O)C1=CC=C(Cl)N=C1N AK-64550 [0,2,0,0,0,0|0,0,0]=2 1175 B11R1.166 NC(=O)C1=NC=C(Cl)C=C1Cl AK100505 [0,2,0,0,0,0|2,0,0]=4 1176 B11R1.166 NC1=C(C(=O)O)C=CC(=N1)Cl AK-31140 [0,2,0,0,0,0|1,0,0]=3 1177 B11R1.166 NC1=CC(=C(C=C1)C(C)=O)O AK-34336 [0,2,0,0,0,0|2,0,0]=4 1178 B11R1.166 NC1=CC(=NC=C1[N+](=O)[O-])O AK-25230 [0,2,0,0,0,0|2,0,0]=4 1179 B11R1.166 NC1=CC(Br)=NC=C1[N+]([O-])=O AK-77023 [0,2,0,0,0,0|2,0,0]=4 1180 B11R1.166 NC1=CC(Cl)=NC=C1[N+]([O-])=O AK-24816 [0,2,0,0,0,0|2,0,0]=4 1181 B11R1.166 NC1=NC(Br)=CC=C1[N+]([O-])=O AK-51710 [0,2,0,0,0,0|2,0,0]=4 1182 B11R1.166 NC1=NC(Cl)=C([N+]([O-])=O)C=C1 AK-86662 [0,2,0,0,0,0|2,0,0]=4 1183 B11R1.166 NC1=NC(Cl)=CC=C1[N+]([O-])=O AK-25689 [0,2,0,0,0,0|2,0,0]=4 1184 B11R1.166 NC1=NC=C(C(Br)=C1)[N+]([O-])=O AK100167 [0,2,0,0,0,0|2,0,0]=4 1185 B11R1.166 NC1=NC=C(C(N)=C1)[N+]([O-])=O AK-55154 [0,2,0,0,0,0|2,0,0]=4 1186 B11R1.166 NC1=NC=C([N+]([O-])=O)C(Cl)=C1 AK-29057 [0,2,0,0,0,0|2,0,0]=4 1187 B11R1.166 O=C(C1=CN=C(Cl)N=C1Cl)N AK-51543 [0,2,0,0,0,0|1,0,0]=3 1188 B11R1.166 O=C(C1=CN=C(N)N=C1N)N AK484800 [0,2,0,0,0,0|1,0,0]=3 1189 B11R1.166 O=C(C1=NC=C(Cl)N=C1Cl)N AK123564 [0,2,0,0,0,0|1,0,0]=3 1190 B11R1.166 O=C(C=1C(O)=CC(NC1)=O)O AK-27721 [0,2,0,0,0,0|1,0,1]=4 1191 B11R1.166 O=C(N)C1=CC=C(C)C=C1N AK-49754 [0,2,0,0,0,0|1,0,0]=3 1192 B11R1.166 O=C(N)C1=CC=C(Cl)C=C1N AK-43520 [0,2,0,0,0,0|1,0,0]=3 1193 B11R1.166 O=C(N)C1=CC=C(F)C=C1F AK-86226 [0,2,0,0,0,0|1,0,0]=3 1194 B11R1.166 O=C(N)C1=CC=C(I)C=C1Br AK349625 [0,2,0,0,0,0|1,0,0]=3 1195 B11R1.166 O=C(N)C1=CN=C(Cl)C=C1Cl AK-29452 [0,2,0,0,0,0|0,0,0]=2 1196 B11R1.166 O=C(N)C1=NC=C(Br)C=C1N AK-48703 [0,2,0,0,0,0|2,0,0]=4 1197 B11R1.166 O=C(O)C1=C(C)N=C(Br)C=C1 AK144236 [0,2,0,0,0,0|1,0,0]=3 1198 B11R1.166 O=C(O)C1=C(C)N=C(Cl)C=C1 AK-58691 [0,2,0,0,0,0|1,0,0]=3 1199 B11R1.166 O=C(O)C1=C(Cl)N=C(C)C=C1 AK-84877 [0,2,0,0,0,0|1,0,0]=3 1200 B11R1.166 O=C(O)C1=C(Cl)N=C(Cl)C=C1 AK-25090 [0,2,0,0,0,0|1,0,0]=3 1201 B11R1.166 O=C(O)C1=C(F)N=C(Cl)C=C1 AK120480 [0,2,0,0,0,0|1,0,0]=3 1202 B11R1.166 O=C(O)C1=C(N)N=C(Br)C=C1 AK-77320 [0,2,0,0,0,0|1,0,0]=3 1203 B11R1.166 O=C(O)C1=C(O)N=C(Cl)C=C1 AK-68352 [0,2,0,0,0,0|1,0,0]=3 1204 B11R1.166 O=C(O)C1=CC=C(Br)C=C1Cl AK-40035 [0,2,0,0,0,0|2,0,0]=4 1205 B11R1.166 O=C(O)C1=CC=C(Br)C=C1F AK-45932 [0,2,0,0,0,0|2,0,0]=4 1206 B11R1.166 O=C(O)C1=CC=C(Br)C=C1I AK-73142 [0,2,0,0,0,0|2,0,0]=4 1207 B11R1.166 O=C(O)C1=CC=C(Br)C=C1O AK-44937 [0,2,0,0,0,0|2,0,0]=4 1208 B11R1.166 O=C(O)C1=CC=C(C)C=C1Br AK-36340 [0,2,0,0,0,0|2,0,0]=4 1209 B11R1.166 O=C(O)C1=CC=C(C)C=C1Cl AK-36338 [0,2,0,0,0,0|2,0,0]=4 1210 B11R1.166 O=C(O)C1=CC=C(C)C=C1I AK201253 [0,2,0,0,0,0|2,0,0]=4 1211 B11R1.166 O=C(O)C1=CC=C(F)C=C1Br AK-32641 [0,2,0,0,0,0|2,0,0]=4 1212 B11R1.166 O=C(O)C1=CC=C(F)C=C1C AK-34672 [0,2,0,0,0,0|2,0,0]=4 1213 B11R1.166 O=C(O)C1=CC=C(F)C=C1I AK-29400 [0,2,0,0,0,0|2,0,0]=4 1214 B11R1.166 O=C(O)C1=CC=C(F)C=C1N AK-25985 [0,2,0,0,0,0|2,0,0]=4 1215 B11R1.166 O=C(O)C1=CC=C(I)C=C1N AK-34047 [0,2,0,0,0,0|2,0,0]=4 1216 B11R1.166 O=C(O)C1=CC=C(N)C=C1O AK-46320 [0,2,0,0,0,0|2,0,0]=4 1217 B11R1.166 O=C(O)C1=CC=C(O)C=C1C AK-40693 [0,2,0,0,0,0|2,0,0]=4 1218 B11R1.166 O=C(O)C1=CC=C(O)C=C1F AK-35989 [0,2,0,0,0,0|2,0,0]=4 1219 B11R1.166 O=C(O)C1=CC=C(O)C=C1O AK-88714 [0,2,0,0,0,0|2,0,0]=4 1220 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Br AK-55073 [0,2,0,0,0,0|1,0,0]=3 1221 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Cl AK161047 [0,2,0,0,0,0|1,0,0]=3 1222 B11R1.166 O=C(O)C1=CN=C(C)C=C1C AK-29000 [0,2,0,0,0,0|1,0,0]=3 1223 B11R1.166 O=C(O)C1=CN=C(C)C=C1Cl AK-28459 [0,2,0,0,0,0|1,0,0]=3 1224 B11R1.166 O=C(O)C1=CN=C(C)C=C1N AK-29804 [0,2,0,0,0,0|1,0,0]=3 1225 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1Br AK167576 [0,2,0,0,0,0|1,0,0]=3 1226 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1Cl AK-26772 [0,2,0,0,0,0|1,0,0]=3 1227 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1N AK121862 [0,2,0,0,0,0|1,0,0]=3 1228 B11R1.166 O=C(O)C1=CN=C(F)C=C1C AK123501 [0,2,0,0,0,0|1,0,0]=3 1229 B11R1.166 O=C(O)C1=CN=C(F)C=C1F AK-26362 [0,2,0,0,0,0|1,0,0]=3 1230 B11R1.166 O=C(O)C1=CN=C(N)C=C1C AK-68341 [0,2,0,0,0,0|1,0,0]=3 1231 B11R1.166 O=C(O)C1=CN=C(N)C=C1Cl AK153190 [0,2,0,0,0,0|1,0,0]=3 1232 B11R1.166 O=C(O)C1=CN=C(O)C=C1Cl AK-55097 [0,2,0,0,0,0|1,0,0]=3 1233 B11R1.166 O=C([O-])C1=CC=C(N)C=C1O AK154081 [0,2,0,0,0,0|2,0,0]=4 1234 B11R1.166 O=[N+](C1=CC=C(Br)N=C1Cl)[O-] AK143738 [0,2,0,0,0,0|2,0,0]=4 1235 B11R1.166 O=[N+](C1=CC=C(Cl)N=C1F)[O-] AK143222 [0,2,0,0,0,0|2,0,0]=4 1236 B11R1.166 O=[N+](C1=CC=C(F)N=C1F)[O-] AK-92130 [0,2,0,0,0,0|2,0,0]=4 1237 B11R1.166 O=[N+](C1=CN=C(Br)C=C1Br)[O-] AK-45531 [0,2,0,0,0,0|2,0,0]=4 1238 B11R1.166 O=[N+](C1=CN=C(Br)C=C1C)[O-] AK-27347 [0,2,0,0,0,0|2,0,0]=4 1239 B11R1.166 O=[N+](C1=CN=C(C)C=C1C)[O-] AK-86372 [0,2,0,0,0,0|2,0,0]=4 1240 B11R1.166 O=[N+](C1=CN=C(F)C=C1C)[O-] AK-30297 [0,2,0,0,0,0|2,0,0]=4 1241 B11R1.166 O=[N+](C1=CN=C(N)C=C1C)[O-] AK-25608 [0,2,0,0,0,0|2,0,0]=4 1242 B11R1.166 O=[N+](C1=CN=C(O)C=C1C)[O-] AK-28996 [0,2,0,0,0,0|2,0,0]=4 1243 B11R1.166 OC(=O)C1=C(Br)C=C(I)C=C1 AK-61744 [0,2,0,0,0,0|2,0,0]=4 1244 B11R1.166 OC(=O)C1=NC=C(Cl)N=C1Cl AK-51403 [0,2,0,0,0,0|2,0,0]=4 1245 B11R1.166 OC1=CC(=NC=C1C(=O)O)C AK-25007 [0,2,0,0,0,0|1,0,0]=3 1246 B11R1.166 [O-][N+](=O)C1=CN=C(F)C=C1F AK-54976 [0,2,0,0,0,0|2,0,0]=4 1247 B11R1.16 CCCC(C1=CC=CC=C1)=O AK164430 [0,2,0,0,0,0|2,0,0]=4 1248 B11R1.16 CCCC(C1=CC=CN=C1)=O AK123326 [0,2,0,0,0,0|1,0,0]=3 1249 B11R1.16 N#CCC(C1=CC=CC=C1)=O AK-43072 [0,2,0,0,0,0|1,0,1]=4 1250 B11R1.16 O=C(C1=NC=CN=C1)OCC AK-40036 [0,2,0,0,0,0|2,0,0]=4 1251 B11R1.16 O=C(OCC)C1=CN=CC=C1 AK-88428 [0,2,0,0,0,0|1,0,0]=3 1252 B11R1.16 O=C(OCCl)C1=CC=CC=C1 AK-86220 [0,2,0,0,0,0|2,0,0]=4 1253 B11R1.23 C1=C(C=CC=C1C(OC)=O)O AK-47384 [0,2,0,0,0,0|2,0,0]=4 1254 B11R1.23 C1=C(C=CC=C1F)C(CBr)=O AK-45729 [0,2,0,0,0,0|2,0,0]=4 1255 B11R1.23 C1=C(C=NC=C1C(OC)=O)Br AK-25229 [0,2,0,0,0,0|1,0,0]=3 1256 B11R1.23 C1=C(C=NC=C1C)C(OC)=O AK-39649 [0,2,0,0,0,0|1,0,0]=3 1257 B11R1.23 CC1=CC(C(CBr)=O)=CC=C1 AK-43564 [0,2,0,0,0,0|2,0,0]=4 1258 B11R1.23 CCC(=O)C1=CC=CC(Cl)=C1 AK101591 [0,2,0,0,0,0|2,0,0]=4 1259 B11R1.23 CCC(C1=CC=CC(F)=C1)=O AK548314 [0,2,0,0,0,0|2,0,0]=4 1260 B11R1.23 CCC(C1=CC=CC(O)=C1)=O AK-45536 [0,2,0,0,0,0|2,0,0]=4 1261 B11R1.23 ClC1=CC(=CN=N1)C(=O)OC AK-32830 [0,2,0,0,0,0|2,0,0]=4 1262 B11R1.23 ClC1=CC(C(CBr)=O)=CC=C1 AK-47073 [0,2,0,0,0,0|2,0,0]=4 1263 B11R1.23 ClC1=CC=NC(=C1)C(=O)NC AK-28999 [0,2,0,0,0,0|2,0,0]=4 1264 B11R1.23 ClC1=CN=CC(=N1)C(=O)OC AK-29037 [0,2,0,0,0,0|2,0,0]=4 1265 B11R1.23 FC1=CC=CC(=C1)C(=O)OC AK-47674 [0,2,0,0,0,0|2,0,0]=4 1266 B11R1.23 NC1=CC(=CN=C1)C(=O)OC AK-28608 [0,2,0,0,0,0|1,0,0]=3 1267 B11R1.23 NC1=CN=CC(=N1)C(=O)OC AK-28731 [0,2,0,0,0,0|2,0,0]=4 1268 B11R1.23 NNC(=O)C1=CC(Br)=CC=C1 AK-39193 [0,2,0,0,0,0|1,0,0]=3 1269 B11R1.23 NNC(=O)C1=CC(Cl)=CC=C1 AK-60929 [0,2,0,0,0,0|1,0,0]=3 1270 B11R1.23 O=C(C1=CC=CC(Cl)=C1)C=O AK-10035 [0,2,0,0,0,0|2,0,0]=4 1271 B11R1.23 O=C(C1=NC(Br)=CN=C1)OC AK-39151 [0,2,0,0,0,0|2,0,0]=4 1272 B11R1.23 O=C(C1=NC(C)=CN=C1)OC AK130648 [0,2,0,0,0,0|2,0,0]=4 1273 B11R1.23 O=C(NC)C1=CC=CC(N)=C1 AK-34399 [0,2,0,0,0,0|1,0,0]=3 1274 B11R1.23 O=C(NC)C1=NC=CC(Cl)=C1 AK-38402 [0,2,0,0,0,0|2,0,0]=4 1275 B11R1.23 O=C(NN)C1=NC(O)=CC=C1 AK467135 [0,2,0,0,0,0|2,0,0]=4 1276 B11R1.23 O=C(OC)C1=CC=CC(Br)=C1 AK-73031 [0,2,0,0,0,0|2,0,0]=4 1277 B11R1.23 O=C(OC)C1=CC=CC(Cl)=C1 AK117218 [0,2,0,0,0,0|2,0,0]=4 1278 B11R1.23 O=C(OC)C1=CC=CC(I)=C1 AK-81947 [0,2,0,0,0,0|2,0,0]=4 1279 B11R1.23 O=C(OC)C1=CC=CC(N)=C1 AK-43961 [0,2,0,0,0,0|2,0,0]=4 1280 B11R1.23 OC1=CC(=CN=C1)C(=O)OC AK-47062 [0,2,0,0,0,0|1,0,0]=3 1281 B11R1.222 BrC1=NC=CN=C1C(=O)OC AK-30735 [0,2,0,0,0,0|2,0,0]=4 1282 B11R1.222 C1=C(C(=O)OC)C(=NC=C1)F AK-25162 [0,2,0,0,0,0|1,0,0]=3 1283 B11R1.222 C1=CC=CC(=C1C(OC)=O)Br AK-72980 [0,2,0,0,0,0|2,0,0]=4 1284 B11R1.222 C1=CC=NC(=C1C(OC)=O)Cl AK-44999 [0,2,0,0,0,0|1,0,0]=3 1285 B11R1.222 C1=CC=NC(=C1C(OC)=O)N AK-27747 [0,2,0,0,0,0|1,0,0]=3 1286 B11R1.222 C1=CN=C(C(=N1)C(OC)=O)N AK-29912 [0,2,0,0,0,0|2,0,0]=4 1287 B11R1.222 CC1=C(C(=O)OC)C=CC=N1 AK-27990 [0,2,0,0,0,0|1,0,0]=3 1288 B11R1.222 CCC(C1=CC=CC=C1Cl)=O AK-86142 [0,2,0,0,0,0|2,0,0]=4 1289 B11R1.222 COC(=O)C1=C(C)N=CC=N1 AK-97091 [0,2,0,0,0,0|2,0,0]=4 1290 B11R1.222 COC(=O)C1=C(N)C=CC=C1 AK-41339 [0,2,0,0,0,0|2,0,0]=4 1291 B11R1.222 COC(=O)C1=CN=CN=C1O AK-26014 [0,2,0,0,0,0|2,0,0]=4 1292 B11R1.222 ClC1=NC=CN=C1C(=O)OC AK-39173 [0,2,0,0,0,0|2,0,0]=4 1293 B11R1.222 FC1=CC=CC=C1C(CF)=O AK198962 [0,2,0,0,0,0|2,0,0]=4 1294 B11R1.222 NC1=NC=NC=C1C(=O)OC AK-30806 [0,2,0,0,0,0|2,0,0]=4 1295 B11R1.222 NCC(=O)C1=C(C=CC=C1)F AK-70904 [0,2,0,0,0,0|1,0,0]=3 1296 B11R1.222 O=C(C#N)C1=CC=CC=C1F AK154692 [0,2,0,0,0,0|1,0,1]=4 1297 B11R1.222 O=C(C1=CC=CNC1=O)OC AK-28355 [0,2,0,0,0,0|1,0,1]=4 1298 B11R1.222 O=C(C1=NC=CN=C1I)OC AK-30597 [0,2,0,0,0,0|2,0,0]=4 1299 B11R1.222 O=C(C1=NC=CN=C1N)NN AK-30747 [0,2,0,0,0,0|1,0,0]=3 1300 B11R1.222 O=C(NC)C1=CC=CC=C1N AK-26614 [0,2,0,0,0,0|1,0,0]=3 1301 B11R1.222 O=C(NN)C1=CC=CC=C1O AK167835 [0,2,0,0,0,0|1,0,0]=3 1302 B11R1.222 O=C(OC)C1=C(O)N=CC=C1 AK-54451 [0,2,0,0,0,0|1,0,0]=3 1303 B11R1.222 O=C(OC)C1=CC=CC=C1C AK174020 [0,2,0,0,0,0|2,0,0]=4 1304 B11R1.222 O=C(OC)C1=CC=CC=C1Cl AK161838 [0,2,0,0,0,0|2,0,0]=4 1305 B11R1.222 O=C(OC)C1=CC=CC=C1I AK-76653 [0,2,0,0,0,0|2,0,0]=4 1306 B11R1.222 O=C(OC)C1=CC=CC=C1S AK554462 [0,2,0,0,0,0|2,0,0]=4 1307 B11R1.222 O=C(OC)C1=CN=CC=C1C AK-39773 [0,2,0,0,0,0|1,0,0]=3 1308 B11R1.222 O=C(OC)C1=CN=CC=C1N AK-25475 [0,2,0,0,0,0|1,0,0]=3 1309 B11R1.222 OC1=CC=CC=C1C(NO)=O AK-48843 [0,2,0,0,0,0|1,0,0]=3 1310 B11R1.222 OC1=NC=CN=C1C(=O)OC AK-39232 [0,2,0,0,0,0|2,0,0]=4 1311 B11R1.87 NS(=O)(=O)C1=C(Cl)C=CN=C1 AK-29171 [0,2,0,0,0,0|1,0,0]=3 1312 B11R1.87 NS(=O)(=O)C1=C(F)C=CC=C1 AK-87258 [0,2,0,0,0,0|2,0,0]=4 1313 B11R1.87 O=S(C1=C(C)C=CN=C1)(O)=O AK-46481 [0,2,0,0,0,0|2,0,0]=4 1314 B11R1.155 NC1=CC=CC(=C1)S(N)(=O)=O AK-76708 [0,2,0,0,0,0|2,0,0]=4 1315 B11R1.155 NS(=O)(=O)C1=CC(F)=CC=C1 AK-87259 [0,2,0,0,0,0|2,0,0]=4 1316 B11R1.155 O=S(C1=CC(C)=CN=C1)(O)=O AK-29286 [0,2,0,0,0,0|2,0,0]=4 1317 B11R1.155 O=S(C1=CC=CC(Br)=C1)(N)=O AK-51262 [0,2,0,0,0,0|2,0,0]=4 1318 B11R1.155 O=S(C1=CC=CC(C)=C1)(N)=O AK-59822 [0,2,0,0,0,0|2,0,0]=4 1319 B11R1.53 C1=CC=CC(=C1C#N)C(C)=O AK-50565 [0,2,0,0,0,0|2,0,0]=4 1320 B11R1.53 C1=CC=CC(=C1C=O)C(O)=O AK-46701 [0,2,0,0,0,0|2,0,0]=4 1321 B11R1.53 C1=CC=CC(=C1CCl)C(O)=O AK-44122 [0,2,0,0,0,0|2,0,0]=4 1322 B11R1.53 CC(C1=CC=CC=C1NC)=O AK135397 [0,2,0,0,0,0|2,0,0]=4 1323 B11R1.53 CCC1=C(N=CC=N1)C(C)=O AK-89658 [0,2,0,0,0,0|2,0,0]=4 1324 B11R1.53 CCC1=NC=CC=C1C(O)=O AK111206 [0,2,0,0,0,0|1,0,0]=3 1325 B11R1.53 CNC1=C(C=NC=C1)[N+](=O)[O-] AK-24832 [0,2,0,0,0,0|2,0,0]=4 1326 B11R1.53 COC1=C(C=NC=C1)[N+](=O)[O-] AK-25761 [0,2,0,0,0,0|2,0,0]=4 1327 B11R1.53 COC1=C(N=CC=N1)C(O)=O AK102764 [0,2,0,0,0,0|2,0,0]=4 1328 B11R1.53 COC1=NC=CC=C1C(C)=O AK110016 [0,2,0,0,0,0|1,0,0]=3 1329 B11R1.53 N=C(N)C1=CC=CC=C1OC AK156708 [0,2,0,0,0,0|2,0,0]=4 1330 B11R1.53 O=C(O)C1=C(OC)N=CC=C1 AK-45121 [0,2,0,0,0,0|1,0,0]=3 1331 B11R1.53 O=C(O)C1=CC=CC=C1C#C AK129466 [0,2,0,0,0,0|2,0,0]=4 1332 B11R1.53 O=C(O)C1=CC=CC=C1CC AK-77452 [0,2,0,0,0,0|2,0,0]=4 1333 B11R1.53 O=C(O)C1=CC=CC=C1CO AK-35845 [0,2,0,0,0,0|2,0,0]=4 1334 B11R1.53 O=C(O)C1=CC=CC=C1OC AK-77451 [0,2,0,0,0,0|2,0,0]=4 1335 B11R1.53 O=C(O)C1=CN=CC=C1CC AK452545 [0,2,0,0,0,0|1,0,0]=3 1336 B11R1.53 O=CC1=CC=NC=C1[N+]([O-])=O AK-28813 [0,2,0,0,0,0|2,0,0]=4 1337 B11R1.53 O=[N+](C1=C(NN)C=CN=C1)[O-] AK-34734 [0,2,0,0,0,0|2,0,0]=4 1338 B11R1.53 O=[N+](C1=CC=CN=C1OC)[O-] AK-29926 [0,2,0,0,0,0|2,0,0]=4 1339 B11R1.156 BrC1=C(C(=O)O)C(=CC=C1)C AK-29573 [0,2,0,0,0,0|2,0,0]=4 1340 B11R1.156 BrC1=NC=CC(=C1[N+](=O)[O-])N AK-47677 [0,2,0,0,0,0|2,0,0]=4 1341 B11R1.156 C1=C(C(=C(C=C1)Cl)C(O)=O)C AK-24771 [0,2,0,0,0,0|2,0,0]=4 1342 B11R1.156 C1=C(C(=C(C=C1)Cl)C(O)=O)F AK-27185 [0,2,0,0,0,0|2,0,0]=4 1343 B11R1.156 C1=C(C(=C(C=C1)Cl)C(O)=O)O AK-39316 [0,2,0,0,0,0|2,0,0]=4 1344 B11R1.156 C1=CC(=C(C(=O)O)C(=C1)C)O AK-35673 [0,2,0,0,0,0|2,0,0]=4 1345 B11R1.156 C1=CN=C(C(=C1C)[N+](=O)[O-])Cl AK-29030 [0,2,0,0,0,0|2,0,0]=4 1346 B11R1.156 C1=CN=C(C(=C1Cl)C(=O)O)Cl AK-25677 [0,2,0,0,0,0|1,0,0]=3 1347 B11R1.156 CC(=O)C1=C(C)C=CC=C1C AK110169 [0,2,0,0,0,0|2,0,0]=4 1348 B11R1.156 CC(=O)C1=C(N)C=CC=C1Br AK-99977 [0,2,0,0,0,0|2,0,0]=4 1349 B11R1.156 CC(C1=C(C)C=CC=C1O)=O AK-64408 [0,2,0,0,0,0|2,0,0]=4 1350 B11R1.156 CC(C1=C(Cl)C=CC=C1Cl)=O AK-51041 [0,2,0,0,0,0|2,0,0]=4 1351 B11R1.156 CC(C1=C(Cl)N=CN=C1Cl)=O AK125982 [0,2,0,0,0,0|2,0,0]=4 1352 B11R1.156 CC(C1=C(F)C=CC=C1Br)=O AK-31670 [0,2,0,0,0,0|2,0,0]=4 1353 B11R1.156 CC(C1=C(F)C=CC=C1Cl)=O AK-77336 [0,2,0,0,0,0|2,0,0]=4 1354 B11R1.156 CC(C1=C(F)C=CC=C1F)=O AK-33179 [0,2,0,0,0,0|2,0,0]=4 1355 B11R1.156 CC(C1=C(F)C=CC=C1N)=O AK145194 [0,2,0,0,0,0|2,0,0]=4 1356 B11R1.156 CC(C1=C(O)C=CC=C1Br)=O AK-31671 [0,2,0,0,0,0|2,0,0]=4 1357 B11R1.156 CC(C1=C(O)C=CC=C1Cl)=O AK-29397 [0,2,0,0,0,0|2,0,0]=4 1358 B11R1.156 CC(C1=C(O)C=CC=C1F)=O AK-86499 [0,2,0,0,0,0|2,0,0]=4 1359 B11R1.156 CC(C1=C(O)C=CC=C1O)=O AK-47368 [0,2,0,0,0,0|2,0,0]=4 1360 B11R1.156 CC1=C([N+]([O-])=O)C(F)=NC=C1 AK-33912 [0,2,0,0,0,0|2,0,0]=4 1361 B11R1.156 CC1=NC=NC(=C1C(=O)O)C AK-24036 [0,2,0,0,0,0|2,0,0]=4 1362 B11R1.156 ClC1=NC=CC(=C1[N+](=O)[O-])Cl AK-30538 [0,2,0,0,0,0|2,0,0]=4 1363 B11R1.156 ClC1=NC=NC(=C1C(=O)O)Cl AK-28552 [0,2,0,0,0,0|2,0,0]=4 1364 B11R1.156 FC1=C(C(=O)O)C(=CC=C1)C AK-23633 [0,2,0,0,0,0|2,0,0]=4 1365 B11R1.156 FC1=C(C(=O)O)C(=CC=N1)I AK-30567 [0,2,0,0,0,0|1,0,0]=3 1366 B11R1.156 NC1=C(C(=NC=C1)C)[N+](=O)[O-] AK-47324 [0,2,0,0,0,0|2,0,0]=4 1367 B11R1.156 NC1=C(C(=O)O)C(=CC=C1)Br AK-30472 [0,2,0,0,0,0|2,0,0]=4 1368 B11R1.156 NC1=C(C(O)=O)C(Cl)=CC=C1 AK-34098 [0,2,0,0,0,0|2,0,0]=4 1369 B11R1.156 NC1=C([N+]([O-])=O)C(Cl)=NC=C1 AK-24815 [0,2,0,0,0,0|2,0,0]=4 1370 B11R1.156 NC1=NC=CC(=C1[N+](=O)[O-])Cl AK-28057 [0,2,0,0,0,0|2,0,0]=4 1371 B11R1.156 NC1=NC=CC(Cl)=C1C(O)=O AK-54996 [0,2,0,0,0,0|1,0,0]=3 1372 B11R1.156 NC1=NC=CC(N)=C1[N+]([O-])=O AK201686 [0,2,0,0,0,0|2,0,0]=4 1373 B11R1.156 O=C(N)C1=C(C)C=CC=C1F AK145173 [0,2,0,0,0,0|1,0,0]=3 1374 B11R1.156 O=C(N)C1=C(F)C=CC=C1F AK-72781 [0,2,0,0,0,0|1,0,0]=3 1375 B11R1.156 O=C(N)C1=C(F)C=NC=C1Br AK132934 [0,2,0,0,0,0|2,0,0]=4 1376 B11R1.156 O=C(O)C1=C(C)C=CC=C1C AK-26211 [0,2,0,0,0,0|2,0,0]=4 1377 B11R1.156 O=C(O)C1=C(C)C=CC=C1N AK-35168 [0,2,0,0,0,0|2,0,0]=4 1378 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1Br AK-26454 [0,2,0,0,0,0|2,0,0]=4 1379 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1Cl AK-57133 [0,2,0,0,0,0|2,0,0]=4 1380 B11R1.156 O=C(O)C1=C(Cl)N=CC=C1F AK130207 [0,2,0,0,0,0|1,0,0]=3 1381 B11R1.156 O=C(O)C1=C(F)C=CC=C1Br AK-25617 [0,2,0,0,0,0|2,0,0]=4 1382 B11R1.156 O=C(O)C1=C(F)C=CC=C1F AK-25893 [0,2,0,0,0,0|2,0,0]=4 1383 B11R1.156 O=C(O)C1=C(F)C=CC=C1N AK-35156 [0,2,0,0,0,0|2,0,0]=4 1384 B11R1.156 O=C(O)C1=C(I)C=CC=C1Cl AK128439 [0,2,0,0,0,0|2,0,0]=4 1385 B11R1.156 O=C(O)C1=C(I)C=CC=C1F AK-73092 [0,2,0,0,0,0|2,0,0]=4 1386 B11R1.156 O=C(O)C1=C(I)C=CC=C1N AK-79473 [0,2,0,0,0,0|2,0,0]=4 1387 B11R1.156 O=C(O)C1=C(O)C=CC=C1F AK-36077 [0,2,0,0,0,0|2,0,0]=4 1388 B11R1.156 O=C(O)C1=C(O)C=CC=C1N AK-76027 [0,2,0,0,0,0|2,0,0]=4 1389 B11R1.156 O=C(O)C1=C(O)N=CC=C1F AK280470 [0,2,0,0,0,0|1,0,0]=3 1390 B11R1.156 O=C([O-])C1=C(Cl)C=CC=C1Cl AK202901 [0,2,0,0,0,0|2,0,0]=4 1391 B11R1.156 O=C([O-])C1=C(F)C=CC=C1F AK112379 [0,2,0,0,0,0|2,0,0]=4 1392 B11R1.156 O=[N+](C1=C(Br)C=CN=C1N)[O-] AK-64360 [0,2,0,0,0,0|2,0,0]=4 1393 B11R1.156 O=[N+](C1=C(C)C=CN=C1Br)[O-] AK-29031 [0,2,0,0,0,0|2,0,0]=4 1394 B11R1.156 O=[N+](C1=C(C)C=CN=C1N)[O-] AK-30098 [0,2,0,0,0,0|2,0,0]=4 1395 B11R1.156 OC(=O)C1=C(Br)C=CC=C1Br AK-86840 [0,2,0,0,0,0|2,0,0]=4 1396 B11R1.156 OC1=C([N+]([O-])=O)C(Cl)=NC=C1 AK-26205 [0,2,0,0,0,0|2,0,0]=4 1397 B11R1.156 OC1=NC=CC(=C1[N+](=O)[O-])O AK-26415 [0,2,0,0,0,0|2,0,0]=4 1398 B11R1.159 BrC1=C(C(=O)O)C=CC=C1C AK-28470 [0,2,0,0,0,0|2,0,0]=4 1399 B11R1.159 BrC1=C(C(=O)O)C=CC=C1F AK-25368 [0,2,0,0,0,0|2,0,0]=4 1400 B11R1.159 BrC1=CC=CC(=C1Cl)C(=O)O AK-41763 [0,2,0,0,0,0|2,0,0]=4 1401 B11R1.159 BrC1=CC=CC(=C1F)C(C)=O AK-33547 [0,2,0,0,0,0|2,0,0]=4 1402 B11R1.159 BrC1=CC=CC(=C1O)C(=O)O AK-24666 [0,2,0,0,0,0|2,0,0]=4 1403 B11R1.159 C1=C(C(=C(C=C1)C)N)C(O)=O AK-35167 [0,2,0,0,0,0|2,0,0]=4 1404 B11R1.159 C1=C(C(=C(C=C1)F)C)C(O)=O AK-26272 [0,2,0,0,0,0|2,0,0]=4 1405 B11R1.159 C1=C(C(=C(C=C1)O)N)C(O)=O AK-35611 [0,2,0,0,0,0|2,0,0]=4 1406 B11R1.159 C1=CC=C(C(=C1C(O)=O)C)C AK-26167 [0,2,0,0,0,0|2,0,0]=4 1407 B11R1.159 C1=CC=C(C(=C1C(O)=O)C)Cl AK-29499 [0,2,0,0,0,0|2,0,0]=4 1408 B11R1.159 C1=CC=C(C(=C1C(O)=O)N)F AK-29556 [0,2,0,0,0,0|2,0,0]=4 1409 B11R1.159 C1=CC=C(C(=C1C(O)=O)O)F AK-34755 [0,2,0,0,0,0|2,0,0]=4 1410 B11R1.159 CC(C1=CC=CC(Br)=C1O)=O AK-33819 [0,2,0,0,0,0|2,0,0]=4 1411 B11R1.159 CC(C1=CC=CC(C)=C1F)=O AK327202 [0,2,0,0,0,0|2,0,0]=4 1412 B11R1.159 CC(C1=CC=CC(Cl)=C1Cl)=O AK-75733 [0,2,0,0,0,0|2,0,0]=4 1413 B11R1.159 CC(C1=CC=CC(Cl)=C1O)=O AK-34682 [0,2,0,0,0,0|2,0,0]=4 1414 B11R1.159 CC(C1=CC=CC(F)=C1Br)=O AK145989 [0,2,0,0,0,0|2,0,0]=4 1415 B11R1.159 CC(C1=CC=CC(F)=C1Cl)=O AK-94336 [0,2,0,0,0,0|2,0,0]=4 1416 B11R1.159 CC(C1=CC=CC(N)=C1O)=O AK-26283 [0,2,0,0,0,0|2,0,0]=4 1417 B11R1.159 CC(C1=CC=CC(O)=C1N)=O AK-80116 [0,2,0,0,0,0|2,0,0]=4 1418 B11R1.159 CC(C1=CC=CC(O)=C1O)=O AK-33157 [0,2,0,0,0,0|2,0,0]=4 1419 B11R1.159 CC1=C(O)C=CC=C1C(O)=O AK-45470 [0,2,0,0,0,0|2,0,0]=4 1420 B11R1.159 CC1=CC=CC(C(O)=O)=C1I AK-61437 [0,2,0,0,0,0|2,0,0]=4 1421 B11R1.159 ClC1=C(C(=CN=C1)[N+](=O)[O-])N AK-31979 [0,2,0,0,0,0|2,0,0]=4 1422 B11R1.159 FC1=C(C(=O)O)C=CC=C1I AK-35201 [0,2,0,0,0,0|2,0,0]=4 1423 B11R1.159 FC1=CC=CC(=C1I)C(=O)O AK-34964 [0,2,0,0,0,0|2,0,0]=4 1424 B11R1.159 NC(=O)C1=C(N)C(Br)=CC=C1 AK109579 [0,2,0,0,0,0|1,0,0]=3 1425 B11R1.159 NC1=C(Br)C=NC=C1[N+]([O-])=O AK-30790 [0,2,0,0,0,0|2,0,0]=4 1426 B11R1.159 NC1=C(Cl)C=CC=C1C(O)=O AK-31072 [0,2,0,0,0,0|2,0,0]=4 1427 B11R1.159 NC1=CC=CC(=C1Cl)C(=O)O AK-32822 [0,2,0,0,0,0|2,0,0]=4 1428 B11R1.159 O=C(N)C1=CC=CC(C)=C1N AK113423 [0,2,0,0,0,0|1,0,0]=3 1429 B11R1.159 O=C(N)C1=CC=CC(Cl)=C1F AK305347 [0,2,0,0,0,0|1,0,0]=3 1430 B11R1.159 O=C(N)C1=CC=CC(N)=C1N AK-32166 [0,2,0,0,0,0|1,0,0]=3 1431 B11R1.159 O=C(O)C1=CC=CC(Br)=C1C AK-27090 [0,2,0,0,0,0|2,0,0]=4 1432 B11R1.159 O=C(O)C1=CC=CC(Br)=C1F AK-23680 [0,2,0,0,0,0|2,0,0]=4 1433 B11R1.159 O=C(O)C1=CC=CC(Br)=C1I AK-73145 [0,2,0,0,0,0|2,0,0]=4 1434 B11R1.159 O=C(O)C1=CC=CC(Br)=C1N AK-28094 [0,2,0,0,0,0|2,0,0]=4 1435 B11R1.159 O=C(O)C1=CC=CC(C)=C1F AK-34640 [0,2,0,0,0,0|2,0,0]=4 1436 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1Cl AK-48292 [0,2,0,0,0,0|2,0,0]=4 1437 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1F AK-29899 [0,2,0,0,0,0|2,0,0]=4 1438 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1I AK-68531 [0,2,0,0,0,0|2,0,0]=4 1439 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1O AK-75898 [0,2,0,0,0,0|2,0,0]=4 1440 B11R1.159 O=C(O)C1=CC=CC(F)=C1Cl AK-32695 [0,2,0,0,0,0|2,0,0]=4 1441 B11R1.159 O=C(O)C1=CC=CC(F)=C1F AK-48902 [0,2,0,0,0,0|2,0,0]=4 1442 B11R1.159 O=C(O)C1=CC=CC(I)=C1N AK-64570 [0,2,0,0,0,0|2,0,0]=4 1443 B11R1.159 O=C(O)C1=CC=CC(N)=C1C AK-45495 [0,2,0,0,0,0|2,0,0]=4 1444 B11R1.159 O=C(O)C1=CC=CC(N)=C1F AK-36851 [0,2,0,0,0,0|2,0,0]=4 1445 B11R1.159 O=C(O)C1=CC=CC(O)=C1O AK-24541 [0,2,0,0,0,0|2,0,0]=4 1446 B11R1.159 O=C(O)C1=CN=CC(Br)=C1Br AK127033 [0,2,0,0,0,0|1,0,0]=3 1447 B11R1.159 O=C(O)C1=CN=CC(Br)=C1Cl AK144516 [0,2,0,0,0,0|1,0,0]=3 1448 B11R1.159 O=C(O)C1=CN=CC(Br)=C1N AK112514 [0,2,0,0,0,0|1,0,0]=3 1449 B11R1.159 O=C(O)C1=CN=CC(Br)=C1O AK-84818 [0,2,0,0,0,0|1,0,0]=3 1450 B11R1.159 O=[N+](C1=C(N)C(C)=CN=C1)[O-] AK-28917 [0,2,0,0,0,0|2,0,0]=4 1451 B11R1.159 O=[N+](C1=CN=CC(Br)=C1C)[O-] AK-41808 [0,2,0,0,0,0|2,0,0]=4 1452 B11R1.159 O=[N+](C1=CN=CC(Br)=C1Cl)[O-] AK-29140 [0,2,0,0,0,0|2,0,0]=4 1453 B11R1.159 O=[N+](C1=CN=CC(Cl)=C1Br)[O-] AK135368 [0,2,0,0,0,0|2,0,0]=4 1454 B11R1.159 O=[N+](C1=CN=CC(Cl)=C1Cl)[O-] AK-93464 [0,2,0,0,0,0|2,0,0]=4 1455 B11R1.159 OC(=O)C1=C(Br)C(Cl)=CC=C1 AK-35679 [0,2,0,0,0,0|2,0,0]=4 1456 B11R1.159 OC(=O)C1=C(Br)C(I)=CC=C1 AK-28155 [0,2,0,0,0,0|2,0,0]=4 1457 B11R1.159 OC1=C(Br)C=NC=C1[N+]([O-])=O AK-41379 [0,2,0,0,0,0|2,0,0]=4 1458 B11R1.159 OC1=C(Cl)C=NC=C1[N+]([O-])=O AK-54492 [0,2,0,0,0,0|2,0,0]=4 1459 B11R1.167 BrC1=C(C(=O)O)C=C(C=N1)Br AK-34554 [0,2,0,0,0,0|1,0,0]=3 1460 B11R1.167 BrC1=CC(=C(N=C1)Cl)C(=O)O AK-23807 [0,2,0,0,0,0|1,0,0]=3 1461 B11R1.167 BrC1=CC(=C(N=C1)F)C(=O)O AK-26870 [0,2,0,0,0,0|1,0,0]=3 1462 B11R1.167 BrC1=CN=C(C(=C1)[N+](=O)[O-])C AK-36835 [0,2,0,0,0,0|2,0,0]=4 1463 B11R1.167 BrC1=NC=C(C=C1[N+](=O)[O-])C AK-34244 [0,2,0,0,0,0|2,0,0]=4 1464 B11R1.167 BrC1=NC=C(C=C1[N+](=O)[O-])F AK-35993 [0,2,0,0,0,0|2,0,0]=4 1465 B11R1.167 BrC1=NC=C(N=C1C(=O)O)Br AK-31824 [0,2,0,0,0,0|2,0,0]=4 1466 B11R1.167 C1=C(Br)C=CC(=C1C(=O)C)O AK-47862 [0,2,0,0,0,0|2,0,0]=4 1467 B11R1.167 C1=C(Br)C=CC(=C1C(O)=O)Br AK-26176 [0,2,0,0,0,0|2,0,0]=4 1468 B11R1.167 C1=C(Br)C=NC(=C1[N+](=O)[O-])Cl AK-26248 [0,2,0,0,0,0|2,0,0]=4 1469 B11R1.167 C1=C(C(=CC=C1Br)C)C(O)=O AK-26338 [0,2,0,0,0,0|2,0,0]=4 1470 B11R1.167 C1=C(C(=CC=C1C)Br)C(O)=O AK-30136 [0,2,0,0,0,0|2,0,0]=4 1471 B11R1.167 C1=C(C(=CC=C1C)F)C(O)=O AK-34671 [0,2,0,0,0,0|2,0,0]=4 1472 B11R1.167 C1=C(C(=CC=C1Cl)Br)C(O)=O AK-28994 [0,2,0,0,0,0|2,0,0]=4 1473 B11R1.167 C1=C(C(=CC=C1Cl)C)C(O)=O AK-32605 [0,2,0,0,0,0|2,0,0]=4 1474 B11R1.167 C1=C(C(=CC=C1F)N)C(O)=O AK-35193 [0,2,0,0,0,0|2,0,0]=4 1475 B11R1.167 C1=C(C(=CC=C1O)C)C(=O)O AK-40532 [0,2,0,0,0,0|2,0,0]=4 1476 B11R1.167 C1=C(C(=NC=C1Br)N)C(=O)O AK-23512 [0,2,0,0,0,0|1,0,0]=3 1477 B11R1.167 C1=C(C)C=CC(=C1C(O)=O)C AK-48911 [0,2,0,0,0,0|2,0,0]=4 1478 B11R1.167 C1=C(C)C=CC(=C1C(O)=O)N AK-34555 [0,2,0,0,0,0|2,0,0]=4 1479 B11R1.167 C1=C(Cl)C=CC(=C1C(C)=O)Cl AK-73074 [0,2,0,0,0,0|2,0,0]=4 1480 B11R1.167 C1=C(Cl)C=CC(=C1C(N)=O)O AK-44071 [0,2,0,0,0,0|1,0,0]=3 1481 B11R1.167 C1=C(Cl)C=CC(=C1C(O)=O)Cl AK-47665 [0,2,0,0,0,0|2,0,0]=4 1482 B11R1.167 C1=C(Cl)C=CC(=C1C(O)=O)N AK-26989 [0,2,0,0,0,0|2,0,0]=4 1483 B11R1.167 C1=C(I)C=CC(=C1C(O)=O)N AK-35517 [0,2,0,0,0,0|2,0,0]=4 1484 B11R1.167 C1=C(N)C=CC(=C1C(O)=O)Cl AK-36786 [0,2,0,0,0,0|2,0,0]=4 1485 B11R1.167 C1=C(N)C=CC(=C1C(O)=O)O AK-72925 [0,2,0,0,0,0|2,0,0]=4 1486 B11R1.167 C1=C([N+]([O-])=O)C(=NC=C1Br)Br AK-25466 [0,2,0,0,0,0|2,0,0]=4 1487 B11R1.167 CC(=O)C1=C(F)C=CC(N)=C1 AK-68014 [0,2,0,0,0,0|2,0,0]=4 1488 B11R1.167 CC(=O)C1=C(N)C=CC(Cl)=C1 AK-28102 [0,2,0,0,0,0|2,0,0]=4 1489 B11R1.167 CC(=O)C1=C(N)C=CC(F)=C1 AK109676 [0,2,0,0,0,0|2,0,0]=4 1490 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 AK-30761 [0,2,0,0,0,0|2,0,0]=4 1491 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 AK-30762 [0,2,0,0,0,0|2,0,0]=4 1492 B11R1.167 CC(C1=C(C=CC(=C1)F)Cl)=O AK-48949 [0,2,0,0,0,0|2,0,0]=4 1493 B11R1.167 CC(C1=CC(Br)=CC=C1C)=O AK147547 [0,2,0,0,0,0|2,0,0]=4 1494 B11R1.167 CC(C1=CC(Br)=CC=C1Cl)=O AK109534 [0,2,0,0,0,0|2,0,0]=4 1495 B11R1.167 CC(C1=CC(Br)=CC=C1F)=O AK-28059 [0,2,0,0,0,0|2,0,0]=4 1496 B11R1.167 CC(C1=CC(Br)=CC=C1N)=O AK-28616 [0,2,0,0,0,0|2,0,0]=4 1497 B11R1.167 CC(C1=CC(Br)=CN=C1F)=O AK-30697 [0,2,0,0,0,0|1,0,0]=3 1498 B11R1.167 CC(C1=CC(Cl)=CC=C1Br)=O AK-51654 [0,2,0,0,0,0|2,0,0]=4 1499 B11R1.167 CC(C1=CC(Cl)=CC=C1F)=O AK-76691 [0,2,0,0,0,0|2,0,0]=4 1500 B11R1.167 CC(C1=CC(F)=CC=C1Br)=O AK-45663 [0,2,0,0,0,0|2,0,0]=4 1501 B11R1.167 CC(C1=CC(F)=CC=C1I)=O AK136027 [0,2,0,0,0,0|2,0,0]=4 1502 B11R1.167 CC(C1=CC(F)=CC=C1O)=O AK-45396 [0,2,0,0,0,0|2,0,0]=4 1503 B11R1.167 CC(C1=CC(N)=CC=C1O)=O AK116395 [0,2,0,0,0,0|2,0,0]=4 1504 B11R1.167 CC(C1=CC(O)=CC=C1O)=O AK-51301 [0,2,0,0,0,0|2,0,0]=4 1505 B11R1.167 CC1=CN=C(O)C(=C1)[N+]([O-])=O AK-36279 [0,2,0,0,0,0|2,0,0]=4 1506 B11R1.167 CC1=NC(C(O)=O)=C(C)N=C1 AK-80652 [0,2,0,0,0,0|2,0,0]=4 1507 B11R1.167 ClC1=C(C(=O)O)C=C(C=N1)Cl AK-27047 [0,2,0,0,0,0|1,0,0]=3 1508 B11R1.167 ClC1=C(C=C(N=N1)Cl)C(=O)O AK-35400 [0,2,0,0,0,0|2,0,0]=4 1509 B11R1.167 ClC1=NC=C(C=C1C(=O)O)C AK-39746 [0,2,0,0,0,0|1,0,0]=3 1510 B11R1.167 ClC1=NC=C(C=C1[N+](=O)[O-])Cl AK-23573 [0,2,0,0,0,0|2,0,0]=4 1511 B11R1.167 ClC1=NC=C(C=C1[N+](=O)[O-])F AK-30247 [0,2,0,0,0,0|2,0,0]=4 1512 B11R1.167 FC1=CC(=C(C=C1)I)C(=O)O AK-26068 [0,2,0,0,0,0|2,0,0]=4 1513 B11R1.167 IC1=CC(=C(C=C1)C)C(=O)O AK-23836 [0,2,0,0,0,0|2,0,0]=4 1514 B11R1.167 NC(=O)C1=C(I)C=CC(Br)=C1 AK103162 [0,2,0,0,0,0|1,0,0]=3 1515 B11R1.167 NC(=O)C1=C(N)C=CC(F)=C1 AK-35926 [0,2,0,0,0,0|1,0,0]=3 1516 B11R1.167 NC(=O)C1=C(N)N=CC(Br)=N1 AK-39093 [0,2,0,0,0,0|1,0,0]=3 1517 B11R1.167 NC(=O)C1=C(O)N=CC(Br)=N1 AK-76974 [0,2,0,0,0,0|1,0,0]=3 1518 B11R1.167 NC1=CC(=C(C=C1)Br)C(=O)O AK-34512 [0,2,0,0,0,0|2,0,0]=4 1519 B11R1.167 NC1=CC(=C(C=C1)C)C(=O)O AK-24895 [0,2,0,0,0,0|2,0,0]=4 1520 B11R1.167 NC1=CC=C(O)C=C1C(O)=O AK-45120 [0,2,0,0,0,0|2,0,0]=4 1521 B11R1.167 NC1=NC=C(C)C=C1[N+]([O-])=O AK-36310 [0,2,0,0,0,0|2,0,0]=4 1522 B11R1.167 NC1=NC=C(C=C1C(=O)O)Cl AK-50594 [0,2,0,0,0,0|1,0,0]=3 1523 B11R1.167 NC1=NC=C(C=C1[N+](=O)[O-])F AK-28979 [0,2,0,0,0,0|2,0,0]=4 1524 B11R1.167 NC1=NC=C(Cl)C=C1[N+]([O-])=O AK-26093 [0,2,0,0,0,0|2,0,0]=4 1525 B11R1.167 NC1=NC=C(I)C=C1[N+]([O-])=O AK-34371 [0,2,0,0,0,0|2,0,0]=4 1526 B11R1.167 NC1=NC=C(N=C1C(=O)O)Br AK-21914 [0,2,0,0,0,0|2,0,0]=4 1527 B11R1.167 NC1=NC=C(N=C1C(=O)O)Cl AK-30466 [0,2,0,0,0,0|2,0,0]=4 1528 B11R1.167 O=C(C1=CC(Br)=CNC1=O)O AK-27746 [0,2,0,0,0,0|1,0,1]=4 1529 B11R1.167 O=C(C1=CC(Cl)=CN=C1C)O AK-41038 [0,2,0,0,0,0|1,0,0]=3 1530 B11R1.167 O=C(C1=CC(Cl)=NN=C1O)O AK-48296 [0,2,0,0,0,0|2,0,0]=4 1531 B11R1.167 O=C(C1=NC(Br)=CN=C1O)O AK-93166 [0,2,0,0,0,0|2,0,0]=4 1532 B11R1.167 O=C(C1=NC(Cl)=CN=C1Br)O AK-31823 [0,2,0,0,0,0|2,0,0]=4 1533 B11R1.167 O=C(C1=NC(Cl)=CN=C1Cl)N AK134683 [0,2,0,0,0,0|1,0,0]=3 1534 B11R1.167 O=C(C1=NC(Cl)=CN=C1Cl)O AK128606 [0,2,0,0,0,0|2,0,0]=4 1535 B11R1.167 O=C(C1=NC(Cl)=CN=C1O)N AK-76972 [0,2,0,0,0,0|1,0,0]=3 1536 B11R1.167 O=C(N)C1=CC(Br)=CC=C1N AK-63650 [0,2,0,0,0,0|1,0,0]=3 1537 B11R1.167 O=C(N)C1=CC(Br)=CC=C1O AK-25187 [0,2,0,0,0,0|1,0,0]=3 1538 B11R1.167 O=C(N)C1=CC(C)=CC=C1N AK-41693 [0,2,0,0,0,0|1,0,0]=3 1539 B11R1.167 O=C(N)C1=CC(Cl)=CC=C1Cl AK-88605 [0,2,0,0,0,0|1,0,0]=3 1540 B11R1.167 O=C(N)C1=CC(F)=CC=C1F AK162940 [0,2,0,0,0,0|1,0,0]=3 1541 B11R1.167 O=C(N)C1=CC(N)=CC=C1F AK125480 [0,2,0,0,0,0|1,0,0]=3 1542 B11R1.167 O=C(O)C1=C(Br)N=CC(Cl)=C1 AK-36007 [0,2,0,0,0,0|1,0,0]=3 1543 B11R1.167 O=C(O)C1=C(Cl)N=CC(F)=C1 AK-25888 [0,2,0,0,0,0|1,0,0]=3 1544 B11R1.167 O=C(O)C1=C(Cl)N=CC(O)=C1 AK112903 [0,2,0,0,0,0|1,0,0]=3 1545 B11R1.167 O=C(O)C1=C(F)N=CC(C)=C1 AK-61406 [0,2,0,0,0,0|1,0,0]=3 1546 B11R1.167 O=C(O)C1=C(N)N=CC(C)=C1 AK-29345 [0,2,0,0,0,0|1,0,0]=3 1547 B11R1.167 O=C(O)C1=C(N)N=CC(I)=C1 AK-68339 [0,2,0,0,0,0|1,0,0]=3 1548 B11R1.167 O=C(O)C1=CC(Br)=CC=C1Cl AK-28993 [0,2,0,0,0,0|2,0,0]=4 1549 B11R1.167 O=C(O)C1=CC(Br)=CC=C1F AK-33317 [0,2,0,0,0,0|2,0,0]=4 1550 B11R1.167 O=C(O)C1=CC(Br)=CC=C1I AK-25605 [0,2,0,0,0,0|2,0,0]=4 1551 B11R1.167 O=C(O)C1=CC(Br)=CC=C1N AK-25578 [0,2,0,0,0,0|2,0,0]=4 1552 B11R1.167 O=C(O)C1=CC(Br)=CC=C1O AK-44136 [0,2,0,0,0,0|2,0,0]=4 1553 B11R1.167 O=C(O)C1=CC(Br)=CC=C1S AK116283 [0,2,0,0,0,0|2,0,0]=4 1554 B11R1.167 O=C(O)C1=CC(C)=CC=C1Cl AK-35943 [0,2,0,0,0,0|2,0,0]=4 1555 B11R1.167 O=C(O)C1=CC(C)=CC=C1I AK-35485 [0,2,0,0,0,0|2,0,0]=4 1556 B11R1.167 O=C(O)C1=CC(Cl)=CC=C1F AK-30325 [0,2,0,0,0,0|2,0,0]=4 1557 B11R1.167 O=C(O)C1=CC(F)=CC=C1Br AK-35001 [0,2,0,0,0,0|2,0,0]=4 1558 B11R1.167 O=C(O)C1=CC(F)=CC=C1C AK-34724 [0,2,0,0,0,0|2,0,0]=4 1559 B11R1.167 O=C(O)C1=CC(F)=CC=C1F AK-29107 [0,2,0,0,0,0|2,0,0]=4 1560 B11R1.167 O=C(O)C1=CC(F)=CC=C1O AK-49710 [0,2,0,0,0,0|2,0,0]=4 1561 B11R1.167 O=C(O)C1=CC(I)=CC=C1Br AK-40149 [0,2,0,0,0,0|2,0,0]=4 1562 B11R1.167 O=C(O)C1=CC(I)=CC=C1Cl AK-33887 [0,2,0,0,0,0|2,0,0]=4 1563 B11R1.167 O=C(O)C1=CC(I)=CC=C1F AK-28758 [0,2,0,0,0,0|2,0,0]=4 1564 B11R1.167 O=C(O)C1=CC(N)=CC=C1F AK-35670 [0,2,0,0,0,0|2,0,0]=4 1565 B11R1.167 O=C(O)C1=CC(O)=CC=C1Br AK-77223 [0,2,0,0,0,0|2,0,0]=4 1566 B11R1.167 O=C(O)C1=CC(O)=CC=C1Cl AK-35680 [0,2,0,0,0,0|2,0,0]=4 1567 B11R1.167 O=C(O)C1=CC(O)=CC=C1F AK-35417 [0,2,0,0,0,0|2,0,0]=4 1568 B11R1.167 O=C([O-])C1=CC(N)=CC=C1O AK-88387 [0,2,0,0,0,0|2,0,0]=4 1569 B11R1.167 O=[N+](C1=CC(Br)=CN=C1F)[O-] AK-39504 [0,2,0,0,0,0|2,0,0]=4 1570 B11R1.167 O=[N+](C1=CC(C)=CN=C1Cl)[O-] AK-28495 [0,2,0,0,0,0|2,0,0]=4 1571 B11R1.167 O=[N+](C1=CC(Cl)=CN=C1Br)[O-] AK-36304 [0,2,0,0,0,0|2,0,0]=4 1572 B11R1.167 O=[N+](C1=CC(F)=CN=C1F)[O-] AK158211 [0,2,0,0,0,0|2,0,0]=4 1573 B11R1.167 OC(=O)C1=C(O)C=CC(O)=C1 AK-49825 [0,2,0,0,0,0|2,0,0]=4 1574 B11R1.167 OC1=CC=C(C)C=C1C(O)=O AK-48577 [0,2,0,0,0,0|2,0,0]=4 1575 B11R1.167 OC1=NC=C(I)C=C1[N+]([O-])=O AK135406 [0,2,0,0,0,0|2,0,0]=4 1576 B11R1.167 [O-][N+](=O)C1=CC(Cl)=CN=C1F AK-30042 [0,2,0,0,0,0|2,0,0]=4 1577 B11R1.167 [O-][N+](=O)C1=CC(I)=CN=C1Cl AK-79586 [0,2,0,0,0,0|2,0,0]=4 1578 B11R1.74 BrC1=CC(=CC(=C1)C(=O)O)C AK-35753 [0,2,0,0,0,0|2,0,0]=4 1579 B11R1.74 C1=C(C=C(C=C1C(O)=O)C)C AK-45888 [0,2,0,0,0,0|2,0,0]=4 1580 B11R1.74 C1=C(C=C(C=C1C(O)=O)Cl)Cl AK-47334 [0,2,0,0,0,0|2,0,0]=4 1581 B11R1.74 C1=C(C=C(C=C1C(O)=O)F)C AK-35437 [0,2,0,0,0,0|2,0,0]=4 1582 B11R1.74 C1=C(C=C(C=C1C(O)=O)F)F AK-29265 [0,2,0,0,0,0|2,0,0]=4 1583 B11R1.74 CC(=O)C1=CC(Br)=CC(Cl)=C1 AK-88050 [0,2,0,0,0,0|2,0,0]=4 1584 B11R1.74 CC(=O)C1=CC(C)=CC(C)=C1 AK-43858 [0,2,0,0,0,0|2,0,0]=4 1585 B11R1.74 CC(C1=CC(Br)=CC(Br)=C1)=O AK-87691 [0,2,0,0,0,0|2,0,0]=4 1586 B11R1.74 CC(C1=CC(C)=CC(Br)=C1)=O AK143673 [0,2,0,0,0,0|2,0,0]=4 1587 B11R1.74 CC(C1=CC(Cl)=CC(Cl)=C1)=O AK-86403 [0,2,0,0,0,0|2,0,0]=4 1588 B11R1.74 CC(C1=CC(F)=CC(F)=C1)=O AK-44507 [0,2,0,0,0,0|2,0,0]=4 1589 B11R1.74 CC(C1=CC(O)=CC(O)=C1)=O AK-45934 [0,2,0,0,0,0|2,0,0]=4 1590 B11R1.74 CC1=CC(=CC(N)=C1)C(O)=O AK-34242 [0,2,0,0,0,0|2,0,0]=4 1591 B11R1.74 NC1=CC(=CC(=C1)C(=O)O)F AK-37396 [0,2,0,0,0,0|2,0,0]=4 1592 B11R1.74 NC1=CC(Cl)=CC(=C1)C(O)=O AK-45965 [0,2,0,0,0,0|2,0,0]=4 1593 B11R1.74 NC1=CC(O)=CC(=C1)C(O)=O AK-59360 [0,2,0,0,0,0|2,0,0]=4 1594 B11R1.74 O=C(O)C1=CC(Br)=CC(Br)=C1 AK-73084 [0,2,0,0,0,0|2,0,0]=4 1595 B11R1.74 O=C(O)C1=CC(Br)=CC(N)=C1 AK-61316 [0,2,0,0,0,0|2,0,0]=4 1596 B11R1.74 O=C(O)C1=CC(C)=CC(Cl)=C1 AK-75961 [0,2,0,0,0,0|2,0,0]=4 1597 B11R1.74 O=C(O)C1=CC(C)=CC(O)=C1 AK-47209 [0,2,0,0,0,0|2,0,0]=4 1598 B11R1.74 O=C(O)C1=CC(Cl)=CC(Br)=C1 AK-76578 [0,2,0,0,0,0|2,0,0]=4 1599 B11R1.74 O=C(O)C1=CC(I)=CC(Br)=C1 AK-33873 [0,2,0,0,0,0|2,0,0]=4 1600 B11R1.74 O=C(O)C1=CC(N)=CC(N)=C1 AK-41179 [0,2,0,0,0,0|2,0,0]=4 1601 B11R1.74 O=C(O)C1=CC(O)=CC(Cl)=C1 AK107678 [0,2,0,0,0,0|2,0,0]=4 1602 B11R1.74 O=C(O)C1=CC(O)=CC(F)=C1 AK-67889 [0,2,0,0,0,0|2,0,0]=4 1603 B11R1.74 O=C(O)C1=CC(O)=CC(N)=C1 AK-36312 [0,2,0,0,0,0|2,0,0]=4 1604 B11R1.74 O=C(O)C1=CC(O)=CC(O)=C1 AK-44160 [0,2,0,0,0,0|2,0,0]=4 1605 B11R1.74 OC(=O)C1=CC(Cl)=CC(I)=C1 AK-34536 [0,2,0,0,0,0|2,0,0]=4 1606 B11R1.74 OC(=O)C1=CC(I)=CC(F)=C1 AK-36219 [0,2,0,0,0,0|2,0,0]=4 1607 B11R1.74 OC(=O)C1=CC(I)=CC(I)=C1 AK-79041 [0,2,0,0,0,0|2,0,0]=4 1608 B11R1.266 C1=C(C(=O)O)C=CC=C1CCl AK-34651 [0,2,0,0,0,0|2,0,0]=4 1609 B11R1.266 C1=C(C=CC=C1C(O)=O)C=O AK-45897 [0,2,0,0,0,0|2,0,0]=4 1610 B11R1.266 CC(C1=CC=CC(CCl)=C1)=O AK-86175 [0,2,0,0,0,0|2,0,0]=4 1611 B11R1.266 COC1=CC(=CN=C1)C(=O)O AK-40655 [0,2,0,0,0,0|1,0,0]=3 1612 B11R1.266 COC1=CC=CC(=C1)C(=N)N AK-16801-12 [0,2,0,0,0,0|2,0,0]=4 1613 B11R1.266 COC1=NC(=CN=C1)C(O)=O AK-66990 [0,2,0,0,0,0|2,0,0]=4 1614 B11R1.266 NCC1=CC=CC(=C1)C(=O)O AK-36663 [0,2,0,0,0,0|2,0,0]=4 1615 B11R1.266 O=C(C1=NC(NC)=CN=C1)O AK-35586 [0,2,0,0,0,0|2,0,0]=4 1616 B11R1.266 O=C(N)C1=CC=CC(C=O)=C1 AK-65110 [0,2,0,0,0,0|1,0,0]=3 1617 B11R1.266 O=C(N)C1=CC=CC(CBr)=C1 AK100650 [0,2,0,0,0,0|1,0,0]=3 1618 B11R1.266 O=C(N)C1=NC(C#N)=CC=C1 AK150478 [0,2,0,0,0,0|2,0,0]=4 1619 B11R1.266 O=C(O)C1=CC=CC(C#N)=C1 AK-68392 [0,2,0,0,0,0|2,0,0]=4 1620 B11R1.266 O=C(O)C1=CC=CC(CBr)=C1 AK-35991 [0,2,0,0,0,0|2,0,0]=4 1621 B11R1.266 O=C(O)C1=CC=CC(NC)=C1 AK164024 [0,2,0,0,0,0|2,0,0]=4 1622 B11R1.266 O=C(O)C1=CC=CC(OC)=C1 AK159192 [0,2,0,0,0,0|2,0,0]=4 1623 B11R1.266 OCC1=CC=CC(=C1)C(O)=O AK-34506 [0,2,0,0,0,0|2,0,0]=4 1624 B9R1.69 O=C1C(N)=CC=C(Br)N1 AK-33149 [0,0,1,1,0,0|2,0,0]=4 1625 B9R1.69 O=C1NC(=NC=C1F)Cl AK-25146 [0,0,1,1,0,0|2,0,0]=4 1626 B9R1.69 O=C1NC(N)=NC=C1Br AK-24660 [0,0,1,1,0,0|2,0,0]=4 1627 B9R1.69 O=C1NC(N)=NC=C1N AK149186 [0,0,1,1,0,0|2,0,0]=4 1628 B11R2.10 BrC1=CC2=C(N1)N=CC=C2 AK-42548 [0,0,0,1,0,1|1,0,0]=3 1629 B11R2.10 BrC1=CC2=CC=CN=C2S1 AK138413 [0,0,0,1,0,1|1,1,0]=4 1630 B11R2.10 BrC1=NC2=C(N1)C=CC=C2 AK-35600 [0,0,0,1,0,1|2,0,0]=4 1631 B11R2.10 BrC1=NC2=CC=CN=C2S1 AK-27149 [0,0,0,1,0,1|1,1,0]=4 1632 B11R2.10 C1=C([NH]C2=CC=CC=C12)C AK-44448 [0,0,0,1,0,1|2,0,0]=4 1633 B11R2.10 C1=C2NC(=O)NC2=CC=C1 AK-45018 [0,0,0,1,0,1|1,0,0]=3 1634 B11R2.10 C1=CC=CC2=C1NC(S2)=O AK-49174 [0,0,0,1,0,1|1,0,0]=3 1635 B11R2.10 C1=CC=NC2=C1OC(N2)=O AK-28047 [0,0,0,1,0,1|0,0,0]=2 1636 B11R2.10 CC1=CC2=CC=CN=C2N1 AK-25051 [0,0,0,1,0,1|1,0,0]=3 1637 B11R2.10 CC1=NC2=CC=CC=C2N1 AK-44028 [0,0,0,1,0,1|2,0,0]=4 1638 B11R2.10 CC1=NC2=NC=CC=C2N1 AK-39947 [0,0,0,1,0,1|1,0,1]=4 1639 B11R2.10 CC1=NC2=NC=CC=C2O1 AK-30675 [0,0,0,1,0,1|1,0,1]=4 1640 B11R2.10 ClC1=NC2=C(S1)C=CC=N2 AK-31093 [0,0,0,1,0,1|1,0,1]=4 1641 B11R2.10 ClC1=NC2=C(S1)C=CN=C2 AK-31092 [0,0,0,1,0,1|1,1,0]=4 1642 B11R2.10 ClC1=NC2=C(S1)N=CC=C2 AK-81049 [0,0,0,1,0,1|1,1,0]=4 1643 B11R2.10 ClC1=NC2=CC=CC=C2N1 AK-26782 [0,0,0,1,0,1|2,0,0]=4 1644 B11R2.10 ClC1=NC2=NC=CC=C2O1 AK170313 [0,0,0,1,0,1|1,0,1]=4 1645 B11R2.10 ClC=1NC2=C(C1)C=CC=C2 AK-48803 [0,0,0,1,0,1|2,0,0]=4 1646 B11R2.10 IC1=CC2=C(N1)C=CC=C2 AK110346 [0,0,0,1,0,1|2,0,0]=4 1647 B11R2.10 IC1=CC2=CC=CN=C2N1 AK-76575 [0,0,0,1,0,1|1,0,0]=3 1648 B11R2.10 N1C2=CC=CN=C2NC1=O AK-24800 [0,0,0,1,0,1|0,0,0]=2 1649 B11R2.10 N1C2=NC=CC=C2CC1=O AK-23546 [0,0,0,1,0,1|0,0,0]=2 1650 B11R2.10 NC1=CC2=C(S1)C=CC=C2 AK-51344 [0,0,0,1,0,1|1,1,0]=4 1651 B11R2.10 NC1=NC2=C(O1)C=CN=C2 AK-80598 [0,0,0,1,0,1|0,0,1]=3 1652 B11R2.10 NC1=NC2=CC=CC=C2N1 AK-54965 [0,0,0,1,0,1|2,0,0]=4 1653 B11R2.10 NC1=NC2=CC=CC=C2O1 AK-35247 [0,0,0,1,0,1|1,0,1]=4 1654 B11R2.10 NC1=NC2=CC=CC=C2S1 AK-41354 [0,0,0,1,0,1|1,1,0]=4 1655 B11R2.10 NC1=NN2C(C=NC=C2)=N1 AK341375 [0,0,0,1,0,1|2,0,0]=4 1656 B11R2.10 O=C1CC2=NC=CC=C2N1 AK-39930 [0,0,0,1,0,1|1,0,0]=3 1657 B11R2.10 O=C1NC2=C(C1)C=CN=C2 AK-90208 [0,0,0,1,0,1|1,0,0]=3 1658 B11R2.10 O=C1NC2=C(C=CC=C2)C1 AK-49964 [0,0,0,1,0,1|1,0,0]=3 1659 B11R2.10 O=C1NC2=C(N1)C=NC=C2 AK161520 [0,0,0,1,0,1|0,0,0]=2 1660 B11R2.10 O=C1NN2C=CC=CC2=C1 AK-89755 [0,0,0,1,0,1|2,0,0]=4 1661 B11R2.10 O=C1OC2=CC=CC=C2C1 AK-77806 [0,0,0,1,0,1|2,0,0]=4 1662 B11R2.10 O=C1SC2=CC=CN=C2N1 AK438250 [0,0,0,1,0,1|0,0,0]=2 1663 B11R2.10 OC1=CC2=C(N1)N=CC=C2 AK103904 [0,0,0,1,0,1|0,0,1]=3 1664 B11R2.10 S=C1NC2=NC=CC=C2N1 AK-77047 [0,0,0,1,0,1|0,1,0]=3 1665 B11R2.10 S=C1OC2=CC=CN=C2N1 AK-32376 [0,0,0,1,0,1|0,1,0]=3 1666 B11R2.10 S=C1SC2=CC=CC=C2N1 AK-47877 [0,0,0,1,0,1|1,1,0]=4 1667 B11R2.10 SC1=NC2=NC=CC=C2O1 AK-49565 [0,0,0,1,0,1|0,1,1]=4 1668 B11R2.1 BrC1=CNC2=C1C=NC=C2 AK115942 [0,1,0,1,0,0|1,0,0]=3 1669 B11R2.1 BrC1=CNC2=NC=NC=C21 AK-24558 [0,1,0,1,0,0|2,0,0]=4 1670 B11R2.1 BrC1=CSC2=C1C=NC=C2 AK-79310 [0,1,0,1,0,0|1,1,0]=4 1671 B11R2.1 BrC1=CSC2=NC=CC=C21 AK-30778 [0,1,0,1,0,0|1,1,0]=4 1672 B11R2.1 BrC1=C[NH]C2=NC=CC=C12 AK-24119 [0,1,0,1,0,0|1,0,0]=3 1673 B11R2.1 BrC1=C[NH]C2=NC=CN=C12 AK-23683 [0,1,0,1,0,0|2,0,0]=4 1674 B11R2.1 BrC1=NNC2=C1C=CC=C2 AK-23691 [0,1,0,1,0,0|2,0,0]=4 1675 B11R2.1 BrC1=NNC2=C1C=CC=N2 AK-39344 [0,1,0,1,0,0|1,0,0]=3 1676 B11R2.1 BrC1=N[NH]C2=NC=NC=C12 AK-31684 [0,1,0,1,0,0|2,0,0]=4 1677 B11R2.1 C1=C(C2=CC=CC=C2[NH]1)C AK-68243 [0,1,0,1,0,0|2,0,0]=4 1678 B11R2.1 C1=CC=CC2=C([NH]N=C12)Cl AK-25715 [0,1,0,1,0,0|2,0,0]=4 1679 B11R2.1 C1=CC=CC2=C1C(=NS2)N AK-26866 [0,1,0,1,0,0|1,1,0]=4 1680 B11R2.1 C1=CC=CC2=C1C(=N[NH]2)N AK-26928 [0,1,0,1,0,0|2,0,0]=4 1681 B11R2.1 C1=CC=CC2=C1C(CC2)=O AK-44115 [0,1,0,1,0,0|2,0,0]=4 1682 B11R2.1 C1=CC=CC2=C1C(CO2)=O AK-45365 [0,1,0,1,0,0|2,0,0]=4 1683 B11R2.1 C1=NC2=N[NH]C(=C2N=C1)N AK-24164 [0,1,0,1,0,0|2,0,0]=4 1684 B11R2.1 CC1=C2C=CC=NC2=N[NH]1 AK-28223 [0,1,0,1,0,0|1,0,0]=3 1685 B11R2.1 CC1=CNC2=C1C=CC=N2 AK-49155 [0,1,0,1,0,0|1,0,0]=3 1686 B11R2.1 CC1=N[NH]C2=CC=CC=C12 AK-24403 [0,1,0,1,0,0|2,0,0]=4 1687 B11R2.1 ClC1=CNC2=C1C=CC=N2 AK-25034 [0,1,0,1,0,0|1,0,0]=3 1688 B11R2.1 IC1=CNC2=C1C=NC=C2 AK-68321 [0,1,0,1,0,0|1,0,0]=3 1689 B11R2.1 IC1=CNC2=NC=NC=C21 AK-77977 [0,1,0,1,0,0|2,0,0]=4 1690 B11R2.1 IC1=NNC2=C1C=CC=C2 AK-24807 [0,1,0,1,0,0|2,0,0]=4 1691 B11R2.1 IC1=NNC2=NC=CC=C21 AK-37628 [0,1,0,1,0,0|1,0,0]=3 1692 B11R2.1 NC1=NCC2=C1C=CC=C2 AK166973 [0,1,0,1,0,0|2,0,0]=4 1693 B11R2.1 NC1=NNC2=C1C=CC=N2 AK-28220 [0,1,0,1,0,0|1,0,0]=3 1694 B11R2.1 NC1=NOC2=NC=CN=C21 AK-24600 [0,1,0,1,0,0|1,0,1]=4 1695 B11R2.1 NC1=NSC2=NC=CC=C21 AK-30764 [0,1,0,1,0,0|0,1,0]=3 1696 B11R2.1 O1C2=C(C(=N1)N)C=CC=C2 AK-23544 [0,1,0,1,0,0|1,0,1]=4 1697 B11R2.1 O=C1C2=CC=CC=C2SC1 AK-29817 [0,1,0,1,0,0|2,0,0]=4 1698 B11R2.1 O=C1NCC2=C1C=CC=C2 AK-68456 [0,1,0,1,0,0|1,0,0]=3 1699 B11R2.1 O=C1NCC2=C1C=CC=N2 AK103949 [0,1,0,1,0,0|0,0,0]=2 1700 B11R2.1 O=C1NCC2=C1C=CN=C2 AK173131 [0,1,0,1,0,0|2,0,0]=4 1701 B11R2.1 O=C1NNC2=C1C=CC=N2 AK-30879 [0,1,0,1,0,0|0,0,0]=2 1702 B11R2.1 O=C1NNC2=C1C=CN=C2 AK100133 [0,1,0,1,0,0|2,0,0]=4 1703 B11R2.1 O=C1OCC2=C1C=CC=C2 AK-78719 [0,1,0,1,0,0|2,0,0]=4 1704 B11R2.1 O=C1OCC2=NC=CC=C12 AK-45766 [0,1,0,1,0,0|1,0,0]=3 1705 B11R2.1 OC1=NNC2=C1C=CC=C2 AK136349 [0,1,0,1,0,0|1,0,1]=4 1706 B11R2.1 S1C=C(C2=C1C=CC=C2)N AK-28603 [0,1,0,1,0,0|1,1,0]=4 1707 B11R2.40 NC1(C2=CC=CN=C2)CC1 AK-68608 [0,1,0,1,0,0|1,0,1]=4 1708 B11R2.239 C1NCC1C2=CC=CN=C2 AK103500 [0,1,0,1,0,0|1,0,1]=4 1709 B7R1.1 C1=C(N=CS1)C=O AK-23930 [1,0,0,0,1,0|1,0,0]=3 1710 B7R1.1 C1=C(SC=C1)C=O AK-26482 [1,0,0,0,1,0|1,0,0]=3 1711 B7R1.1 C1=C([NH]C=N1)C=O AK-41612 [1,0,0,0,1,0|1,0,0]=3 1712 B7R1.1 C1=CN=C(C=O)[NH]1 AK-49186 [1,0,0,0,1,0|1,0,0]=3 1713 B7R1.1 C1=CSC(=N1)C=O AK-46309 [1,0,0,0,1,0|1,0,0]=3 1714 B7R1.1 C=CC1=NC=CS1 AK251551 [1,0,0,0,1,0|2,0,0]=4 1715 B7R1.1 NCC1=CC=CN1 AK-39872 [1,0,0,0,1,0|0,0,2]=4 1716 B7R1.1 NCC1=CC=CS1 AK-46394 [1,0,0,0,1,0|1,0,1]=4 1717 B7R1.1 NCC1=CN=CO1 AK-25086 [1,0,0,0,1,0|1,0,1]=4 1718 B7R1.1 NCC1=CN=CS1 AK-24530 [1,0,0,0,1,0|1,0,1]=4 1719 B7R1.1 NCC1=CNC=C1 AK-67638 [1,0,0,0,1,0|0,0,2]=4 1720 B7R1.1 NCC1=CNC=N1 AK-33143 [1,0,0,0,1,0|1,0,1]=4 1721 B7R1.1 NCC1=CSC=C1 AK-28306 [1,0,0,0,1,0|1,0,1]=4 1722 B7R1.1 NCC1=CSC=C1 AK-48092 [1,0,0,0,1,0|1,0,1]=4 1723 B7R1.1 NCC1=NC=CO1 AK-48266 [1,0,0,0,1,0|1,0,1]=4 1724 B7R1.1 NCC1=NC=CS1 AK-26128 [1,0,0,0,1,0|1,0,1]=4 1725 B7R1.1 NCC1=NC=CS1 AK-95677 [1,0,0,0,1,0|1,0,1]=4 1726 B7R1.1 NCC1=NNC=C1 AK-25875 [1,0,0,0,1,0|1,0,1]=4 1727 B7R1.1 NNC1=NC=CS1 AK162847 [1,0,0,0,1,0|2,0,0]=4 1728 B7R1.1 O=CC1=CC=CN1 AK-25235 [1,0,0,0,1,0|0,0,1]=3 1729 B7R1.1 O=CC1=CN=CS1 AK-39378 [1,0,0,0,1,0|1,0,0]=3 1730 B7R1.1 O=CC1=CNC=C1 AK-36182 [1,0,0,0,1,0|0,0,1]=3 1731 B7R1.1 O=CC1=CNN=C1 AK-25836 [1,0,0,0,1,0|1,0,0]=3 1732 B7R1.1 O=CC1=CNN=C1 AK158761 [1,0,0,0,1,0|1,0,0]=3 1733 B7R1.1 O=CC1=CSC=C1 AK-42964 [1,0,0,0,1,0|1,0,0]=3 1734 B7R1.1 [NH]1C=CC(=N1)C=O AK-25900 [1,0,0,0,1,0|1,0,0]=3 1735 B11R1.91 CC(NCC1=CN=CN=C1)=O AK147247 [0,0,0,0,0,2|2,0,0]=4 1736 B11R1.91 CC(\C=C\C1=CC=CC=C1)=O AK107621 [0,0,0,0,0,2|2,0,0]=4 1737 B11R1.91 N=C(N)SCC1=CC=CC=C1 AK307386 [0,0,0,0,0,2|2,0,0]=4 1738 B11R1.91 NC(OCC1=CC=CC=C1)=O AK-77001 [0,0,0,0,0,2|1,0,0]=3 1739 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 AK109324 [0,0,0,0,0,2|2,0,0]=4 1740 B11R1.91 O=C(N)CCC1=CC=CC=C1 AK392491 [0,0,0,0,0,2|1,0,0]=3 1741 B11R1.91 O=C(N)\C=C\C1=CC=CC=C1 AK112937 [0,0,0,0,0,2|1,0,0]=3 1742 B11R1.91 O=C(O)C#CC1=CC=CC=C1 AK-86834 [0,0,0,0,0,2|2,0,0]=4 1743 B11R1.91 O=C(O)CCC1=CC=CC=C1 AK-94756 [0,0,0,0,0,2|2,0,0]=4 1744 B11R1.91 O=C(O)CNC1=CC=CN=C1 AK449228 [0,0,0,0,0,2|1,0,0]=3 1745 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 AK114507 [0,0,0,0,0,2|2,0,0]=4 1746 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 AK-32864 [0,0,0,0,0,2|1,0,0]=3 1747 B11R1.91 O=C([O-])COC1=CC=CC=C1 AK-96067 [0,0,0,0,0,2|2,0,0]=4 1748 B11R1.91 OC(=O)COC1=CC=CC=C1 AK-76874 [0,0,0,0,0,2|2,0,0]=4 1749 B11R1.91 [O-]C(=O)C=CC1=CC=CC=C1 AK104134 [0,0,0,0,0,2|2,0,0]=4