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|1,0,0]=1 3 B9R1.6 C1=C(C(N)=O)C=CN=C1 AK-47864 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.6 C1=C(N=CC=N1)C(=O)C AK-16901 [0,0,0,0,0,0|0,0,0]=0 5 B9R1.6 C1=C(N=NC=C1)C(O)=O AK-28139 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.6 C1=CN=CN=C1C(=O)O AK-23926 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.6 C1=NC(=CC=C1)C(C)C AK-46532 [0,0,0,0,0,0|2,0,1]=3 8 B9R1.6 C1=NC=CN=C1C(N)=N AK-24427 [0,0,0,0,0,0|2,0,0]=2 9 B9R1.6 C1=NC=CN=C1C(O)=O AK-47505 [0,0,0,0,0,0|1,0,0]=1 10 B9R1.6 C1=NC=NC=C1C(=O)O AK-24470 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.6 CC(=O)C1=CC=CN=N1 AK-83539 [0,0,0,0,0,0|2,0,0]=2 12 B9R1.6 CC(=O)C1=CC=NN=C1 AK-30816 [0,0,0,0,0,0|2,0,0]=2 13 B9R1.6 CC(=O)C1=NC=CC=N1 AK-35526 [0,0,0,0,0,0|2,0,0]=2 14 B9R1.6 CC(C1=CN=CN=C1)=O AK-32388 [0,0,0,0,0,0|2,0,0]=2 15 B9R1.6 CC(C1=NC=NC=C1)=O AK-40767 [0,0,0,0,0,0|2,0,0]=2 16 B9R1.6 CC(N)C1=CC=CN=C1 AK-35649 [0,0,0,0,0,0|2,0,1]=3 17 B9R1.6 CC(N)C1=CN=CC=N1 AK-31016 [0,0,0,0,0,0|1,0,1]=2 18 B9R1.6 CC(N)C1=NC=CC=N1 AK162973 [0,0,0,0,0,0|3,0,1]=4 19 B9R1.6 CC(O)C1=NC=CC=C1 AK-53453 [0,0,0,0,0,0|1,0,2]=3 20 B9R1.6 CN(C)C1=NC=CC=C1 AK-78706 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.6 C[C@@H](N)C1=CC=CC=C1 AK668263 [0,0,0,0,0,0|3,0,1]=4 22 B9R1.6 C[C@@H](N)C1=CC=CN=C1 AK152012 [0,0,0,0,0,0|2,0,1]=3 23 B9R1.6 C[C@@H](N)C1=NC=CC=C1 AK122419 [0,0,0,0,0,0|2,0,1]=3 24 B9R1.6 C[C@@H](O)C1=CC=CC=C1 AK-79205 [0,0,0,0,0,0|2,0,2]=4 25 B9R1.6 C[C@@H](O)C1=NC=CC=C1 AK-79201 [0,0,0,0,0,0|1,0,2]=3 26 B9R1.6 C[C@H](N)C1=CC=CN=C1 AK151271 [0,0,0,0,0,0|2,0,1]=3 27 B9R1.6 N1=C(C=CC=C1)C(N)=S AK-65332 [0,0,0,0,0,0|2,1,0]=3 28 B9R1.6 N1=C(C=CC=C1)[C@@H](C)N AK-37082 [0,0,0,0,0,0|2,0,1]=3 29 B9R1.6 N1=C(N=CC=C1)C(=O)O AK-24353 [0,0,0,0,0,0|3,0,0]=3 30 B9R1.6 N1=NC=C(C=C1)C(=O)O AK-26044 [0,0,0,0,0,0|3,0,0]=3 31 B9R1.6 N=C(C1=NC=CC=N1)N AK164164 [0,0,0,0,0,0|4,0,0]=4 32 B9R1.6 N=C(N)C1=CC=CC=C1 AK-47930 [0,0,0,0,0,0|4,0,0]=4 33 B9R1.6 N=C(N)C1=CN=CC=C1 AK-76662 [0,0,0,0,0,0|3,0,0]=3 34 B9R1.6 N=C(N)C1=NC=CC=C1 AK-26055 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.6 NC(=N)C1=CC=CC=C1 AK-48017 [0,0,0,0,0,0|4,0,0]=4 36 B9R1.6 NC(=O)C1=CN=CC=N1 AK-94813 [0,0,0,0,0,0|1,0,0]=1 37 B9R1.6 NC(C1=CC=CC=C1)=S AK-46849 [0,0,0,0,0,0|3,1,0]=4 38 B9R1.6 N[C@H](C1=NC=CC=C1)C AK-37110 [0,0,0,0,0,0|2,0,1]=3 39 B9R1.6 O=C(Cl)C1=NC=CC=C1 AK-49118 [0,0,0,0,0,0|2,0,0]=2 40 B9R1.6 O=C(N)C1=CC=CC=C1 AK-77684 [0,0,0,0,0,0|3,0,0]=3 41 B9R1.6 O=C(N)C1=CN=CC=C1 AK112769 [0,0,0,0,0,0|2,0,0]=2 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|2,0,0]=2 44 B9R1.6 O=C(O)C1=NC=CC=C1 AK-50286 [0,0,0,0,0,0|2,0,0]=2 45 B9R1.6 O=S(C1=CC=CC=C1)[O-] AK162411 [0,0,0,0,0,0|4,0,0]=4 46 B9R1.6 OB(C1=CC=CN=C1)O AK-26799 [0,0,0,0,0,0|3,0,1]=4 47 B9R1.6 OB(C1=NC=CC=C1)O AK-26642 [0,0,0,0,0,0|3,0,1]=4 48 B9R1.6 OC(=O)C1=CC=NC=C1 AK-49896 [0,0,0,0,0,0|4,0,0]=4 49 B8R1.2 BrCC1=CC=CN=C1 AK-44682 [1,0,0,0,0,0|2,0,1]=4 50 B8R1.2 BrCC1=NC=CC=C1 AK-78919 [1,0,0,0,0,0|2,0,1]=4 51 B8R1.2 BrCC1=NC=CN=C1 AK143784 [1,0,0,0,0,0|1,0,1]=3 52 B8R1.2 C#CC1=CC=CN=C1 AK-39524 [1,0,0,0,0,0|1,0,2]=4 53 B8R1.2 C#CC1=NC=CN=C1 AK185335 [1,0,0,0,0,0|0,0,2]=3 54 B8R1.2 C1=C(N=CC=C1)C#C AK-39840 [1,0,0,0,0,0|1,0,2]=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|0,0,2]=3 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 CNC1=NC=CC=N1 AK-27708 [1,0,0,0,0,0|3,0,0]=4 60 B8R1.2 COC1=CC=CN=C1 AK-76565 [1,0,0,0,0,0|2,0,0]=3 61 B8R1.2 COC1=CC=CN=N1 AK-28954 [1,0,0,0,0,0|3,0,0]=4 62 B8R1.2 COC1=CN=CN=C1 AK-31068 [1,0,0,0,0,0|3,0,0]=4 63 B8R1.2 CSC1=NC=CN=C1 AK-41535 [1,0,0,0,0,0|1,0,0]=2 64 B8R1.2 CSC1=NC=CN=N1 AK-48101 [1,0,0,0,0,0|2,0,0]=3 65 B8R1.2 N#CC1=CN=CC=C1 AK-76753 [1,0,0,0,0,0|2,0,1]=4 66 B8R1.2 N#CC1=NC=CC=C1 AK-76752 [1,0,0,0,0,0|2,0,1]=4 67 B8R1.2 N#CC1=NC=CN=C1 AK-47995 [1,0,0,0,0,0|1,0,1]=3 68 B8R1.2 N1=CN=C(C=C1)C=O AK-23925 [1,0,0,0,0,0|2,0,0]=3 69 B8R1.2 N1=CN=CC(=C1)C=O AK-25240 [1,0,0,0,0,0|2,0,0]=3 70 B8R1.2 NCC1=NC=CN=C1 AK-50813 [1,0,0,0,0,0|1,0,1]=3 71 B8R1.2 NNC1=CC=CN=C1 AK-40869 [1,0,0,0,0,0|3,0,0]=4 72 B8R1.2 NNC1=CC=CN=C1 AK-75799 [1,0,0,0,0,0|3,0,0]=4 73 B8R1.2 NNC1=NC=CC=C1 AK-26026 [1,0,0,0,0,0|3,0,0]=4 74 B8R1.2 NNC1=NC=CN=C1 AK-44383 [1,0,0,0,0,0|2,0,0]=3 75 B8R1.2 O=CC1=CC=NC=C1 AK-50192 [1,0,0,0,0,0|3,0,0]=4 76 B8R1.2 OCC1=CC=CN=C1 AK-46173 [1,0,0,0,0,0|1,0,2]=4 77 B8R1.2 OCC1=NC=CC=C1 AK-53905 [1,0,0,0,0,0|1,0,2]=4 78 B10R1.13 BrC1=CN=C(C=N1)C(=O)O AK-24192 [0,1,0,0,0,0|1,0,0]=2 79 B10R1.13 BrC1=CN=C(N=C1)C(=O)O AK-21808 [0,1,0,0,0,0|3,0,0]=4 80 B10R1.13 C(C)(=O)C1=CC=C(N=C1)Br AK-25404 [0,1,0,0,0,0|1,0,0]=2 81 B10R1.13 C1=C(C=CC(=N1)F)[N+]([O-])=O AK-25997 [0,1,0,0,0,0|3,0,0]=4 82 B10R1.13 C1=C(C=CC(=N1)[N+]([O-])=O)Cl AK-47611 [0,1,0,0,0,0|3,0,0]=4 83 B10R1.13 C1=C(C=NC(=C1)N)C(=O)O AK-25111 [0,1,0,0,0,0|2,0,0]=3 84 B10R1.13 C1=C(N=CC(=C1)C(C)=O)C AK-25853 [0,1,0,0,0,0|1,0,0]=2 85 B10R1.13 C1=C([N+](=O)[O-])N=CC(=C1)C AK-28721 [0,1,0,0,0,0|3,0,0]=4 86 B10R1.13 C1=CC(=CC=C1C(C)=O)F AK-41690 [0,1,0,0,0,0|2,0,0]=3 87 B10R1.13 C1=CC(=CC=C1C(N)=O)F AK-47676 [0,1,0,0,0,0|3,0,0]=4 88 B10R1.13 C1=CC(=CC=C1C(O)=O)Br AK-50463 [0,1,0,0,0,0|3,0,0]=4 89 B10R1.13 C1=CC(=CC=C1C(O)=O)F AK-73077 [0,1,0,0,0,0|3,0,0]=4 90 B10R1.13 C1=CC(=CN=C1C(O)=O)C AK-27814 [0,1,0,0,0,0|2,0,0]=3 91 B10R1.13 C1=CC(=CN=C1[N+](=O)[O-])Br AK-25916 [0,1,0,0,0,0|3,0,0]=4 92 B10R1.13 C1=CC(=NC=C1C(N)=O)C AK-48877 [0,1,0,0,0,0|2,0,0]=3 93 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])Br AK-35205 [0,1,0,0,0,0|3,0,0]=4 94 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])Cl AK-25992 [0,1,0,0,0,0|3,0,0]=4 95 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])N AK-30014 [0,1,0,0,0,0|3,0,0]=4 96 B10R1.13 C1=NC(=CC=C1C(=O)O)F AK-25936 [0,1,0,0,0,0|2,0,0]=3 97 B10R1.13 C1=NC(=CN=C1C(=O)N)Cl AK-28055 [0,1,0,0,0,0|1,0,0]=2 98 B10R1.13 C1=NC(=CN=C1C(=O)O)Cl AK-24710 [0,1,0,0,0,0|1,0,0]=2 99 B10R1.13 CC(=O)C1=CC=C(N)N=C1 AK-67650 [0,1,0,0,0,0|1,0,0]=2 100 B10R1.13 CC(C1=CC=C(Br)C=C1)=O AK124422 [0,1,0,0,0,0|2,0,0]=3 101 B10R1.13 CC(C1=CC=C(C)C=C1)=O AK-41305 [0,1,0,0,0,0|2,0,0]=3 102 B10R1.13 CC(C1=CC=C(F)N=C1)=O AK-29672 [0,1,0,0,0,0|1,0,0]=2 103 B10R1.13 CC(C1=CC=C(N)C=C1)=O AK110424 [0,1,0,0,0,0|2,0,0]=3 104 B10R1.13 CC(C1=CC=C(O)C=C1)=O AK-86441 [0,1,0,0,0,0|2,0,0]=3 105 B10R1.13 CC(C1=CC=C(O)N=C1)=O AK-40333 [0,1,0,0,0,0|1,0,0]=2 106 B10R1.13 CC(C1=CN=C(Cl)N=C1)=O AK135579 [0,1,0,0,0,0|2,0,0]=3 107 B10R1.13 CC(C1=CN=C(N)C=C1)C AK-81363 [0,1,0,0,0,0|2,0,1]=4 108 B10R1.13 CC(C1=NC=C(Br)C=C1)=O AK-28454 [0,1,0,0,0,0|1,0,0]=2 109 B10R1.13 CC(C1=NC=C(Br)C=N1)=O AK129384 [0,1,0,0,0,0|2,0,0]=3 110 B10R1.13 CC(C1=NC=C(Cl)C=C1)=O AK-77099 [0,1,0,0,0,0|1,0,0]=2 111 B10R1.13 CC(C1=NC=C(Cl)N=C1)=O AK-42149 [0,1,0,0,0,0|0,0,0]=1 112 B10R1.13 CC(C1=NC=C(O)C=C1)=O AK116053 [0,1,0,0,0,0|1,0,0]=2 113 B10R1.13 CC(C1=NC=C(O)N=C1)=O AK134806 [0,1,0,0,0,0|0,0,0]=1 114 B10R1.13 CC(N)C1=CC=C(C)N=C1 AK684509 [0,1,0,0,0,0|2,0,1]=4 115 B10R1.13 CC(N)C1=NC=C(C)C=C1 AK158768 [0,1,0,0,0,0|2,0,1]=4 116 B10R1.13 CC(O)C1=CN=C(C)C=C1 AK-32149 [0,1,0,0,0,0|1,0,2]=4 117 B10R1.13 CC1=NC=C(C=N1)C(=O)O AK-25207 [0,1,0,0,0,0|3,0,0]=4 118 B10R1.13 CN(C)C1=NC=C(Br)C=C1 AK-25675 [0,1,0,0,0,0|3,0,0]=4 119 B10R1.13 CN(C)C1=NC=C(Br)N=C1 AK136914 [0,1,0,0,0,0|2,0,0]=3 120 B10R1.13 CN(C)C1=NC=C(I)C=C1 AK117849 [0,1,0,0,0,0|3,0,0]=4 121 B10R1.13 C[C@@H](N)C1=NC=C(F)C=C1 AK204056 [0,1,0,0,0,0|2,0,1]=4 122 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 AK173009 [0,1,0,0,0,0|2,0,1]=4 123 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 AK321169 [0,1,0,0,0,0|2,0,1]=4 124 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 AK668421 [0,1,0,0,0,0|2,0,1]=4 125 B10R1.13 ClC1=CC=C(C(C)=O)C=N1 AK-26129 [0,1,0,0,0,0|1,0,0]=2 126 B10R1.13 ClC1=CC=C(N=C1)C(=O)O AK-26702 [0,1,0,0,0,0|2,0,0]=3 127 B10R1.13 ClC1=CC=C(N=N1)C(=O)N AK-28115 [0,1,0,0,0,0|3,0,0]=4 128 B10R1.13 ClC1=CC=C(N=N1)C(=O)O AK-23862 [0,1,0,0,0,0|3,0,0]=4 129 B10R1.13 FC1=CC=C(N=C1)C(=O)O AK-28724 [0,1,0,0,0,0|2,0,0]=3 130 B10R1.13 N=C(N)C1=CN=C(Cl)C=C1 AK-67868 [0,1,0,0,0,0|3,0,0]=4 131 B10R1.13 N=C(N)C1=NC=C(F)C=C1 AK130362 [0,1,0,0,0,0|3,0,0]=4 132 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 AK-76760 [0,1,0,0,0,0|3,0,0]=4 133 B10R1.13 NC(=O)C1=NC=C(N)C=N1 AK-82639 [0,1,0,0,0,0|3,0,0]=4 134 B10R1.13 NC(=O)C1=NC=C(N)N=C1 AK102768 [0,1,0,0,0,0|1,0,0]=2 135 B10R1.13 NC1=CC=C(C(C)C)N=C1 AK-30855 [0,1,0,0,0,0|2,0,1]=4 136 B10R1.13 NC1=CN=C(C=C1)C(=O)O AK-25651 [0,1,0,0,0,0|2,0,0]=3 137 B10R1.13 NC1=CN=C(C=C1)[N+](=O)[O-] AK-23524 [0,1,0,0,0,0|3,0,0]=4 138 B10R1.13 NC1=CN=C(N=C1)C(O)=O AK-29407 [0,1,0,0,0,0|3,0,0]=4 139 B10R1.13 NC1=NC=C(N=C1)C(=O)O AK-24195 [0,1,0,0,0,0|1,0,0]=2 140 B10R1.13 O=C(C1=CC=C(Cl)N=C1)N AK-44668 [0,1,0,0,0,0|2,0,0]=3 141 B10R1.13 O=C(C1=CN=C(Cl)N=C1)O AK-25020 [0,1,0,0,0,0|3,0,0]=4 142 B10R1.13 O=C(C1=CN=C(N)N=C1)O AK-17303 [0,1,0,0,0,0|3,0,0]=4 143 B10R1.13 O=C(C1=CN=C(O)N=C1)O AK-55017 [0,1,0,0,0,0|3,0,0]=4 144 B10R1.13 O=C(C1=CNC(C=N1)=O)O AK-24756 [0,1,0,0,0,0|1,0,1]=3 145 B10R1.13 O=C(C1=NC=C(Br)C=C1)N AK-36812 [0,1,0,0,0,0|2,0,0]=3 146 B10R1.13 O=C(C1=NC=C(Br)C=C1)O AK-25747 [0,1,0,0,0,0|2,0,0]=3 147 B10R1.13 O=C(C1=NC=C(Br)C=N1)N AK-75832 [0,1,0,0,0,0|3,0,0]=4 148 B10R1.13 O=C(C1=NC=C(Br)N=C1)N AK156282 [0,1,0,0,0,0|1,0,0]=2 149 B10R1.13 O=C(C1=NC=C(C)C=N1)O AK-29650 [0,1,0,0,0,0|3,0,0]=4 150 B10R1.13 O=C(C1=NC=C(N)C=C1)N AK-40127 [0,1,0,0,0,0|2,0,0]=3 151 B10R1.13 O=C(C1=NC=C(O)C=N1)O AK-40704 [0,1,0,0,0,0|3,0,0]=4 152 B10R1.13 O=C(C1=NN=C(N)C=C1)O AK-26163 [0,1,0,0,0,0|3,0,0]=4 153 B10R1.13 O=C(C1=NN=C(O)C=C1)O AK-25880 [0,1,0,0,0,0|3,0,0]=4 154 B10R1.13 O=C(C1=NN=C(O)C=C1)O AK601861 [0,1,0,0,0,0|3,0,0]=4 155 B10R1.13 O=C(N)C1=CC=C(Cl)C=C1 AK113058 [0,1,0,0,0,0|3,0,0]=4 156 B10R1.13 O=C(N)C1=CC=C(N)C=C1 AK151254 [0,1,0,0,0,0|3,0,0]=4 157 B10R1.13 O=C(N)C1=CC=C(O)C=C1 AK151255 [0,1,0,0,0,0|3,0,0]=4 158 B10R1.13 O=C(N)C1=CN=C(Br)C=C1 AK-41744 [0,1,0,0,0,0|2,0,0]=3 159 B10R1.13 O=C(N)C1=CN=C(N)C=C1 AK161454 [0,1,0,0,0,0|2,0,0]=3 160 B10R1.13 O=C(N)C1=NC=C(Cl)C=C1 AK142780 [0,1,0,0,0,0|2,0,0]=3 161 B10R1.13 O=C(N)C1=NC=C(F)C=C1 AK110171 [0,1,0,0,0,0|2,0,0]=3 162 B10R1.13 O=C(O)C1=CC=C(C)C=C1 AK106262 [0,1,0,0,0,0|3,0,0]=4 163 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 AK-44086 [0,1,0,0,0,0|3,0,0]=4 164 B10R1.13 O=C(O)C1=CC=C(I)C=C1 AK-73094 [0,1,0,0,0,0|3,0,0]=4 165 B10R1.13 O=C(O)C1=CC=C(N)C=C1 AK-41178 [0,1,0,0,0,0|3,0,0]=4 166 B10R1.13 O=C(O)C1=CC=C(O)C=C1 AK106263 [0,1,0,0,0,0|3,0,0]=4 167 B10R1.13 O=C(O)C1=CN=C(C)C=C1 AK-29149 [0,1,0,0,0,0|2,0,0]=3 168 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 AK-26081 [0,1,0,0,0,0|2,0,0]=3 169 B10R1.13 O=C(O)C1=CNC(C=C1)=O AK-26034 [0,1,0,0,0,0|2,0,1]=4 170 B10R1.13 O=C(O)C1=NC=C(O)C=C1 AK-24769 [0,1,0,0,0,0|2,0,0]=3 171 B10R1.13 O=C([O-])C1=CC=C(N)C=C1 AK116649 [0,1,0,0,0,0|3,0,0]=4 172 B10R1.13 O=C([O-])C1=CC=C(O)C=C1 AK306852 [0,1,0,0,0,0|3,0,0]=4 173 B10R1.13 O=C1C=CC(C(O)=O)=CO1 AK-46024 [0,1,0,0,0,0|3,0,0]=4 174 B10R1.13 O=[N+](C1=CN=C(C)C=C1)[O-] AK-28977 [0,1,0,0,0,0|3,0,0]=4 175 B10R1.13 O=[N+](C1=NC=C(F)C=C1)[O-] AK-36376 [0,1,0,0,0,0|3,0,0]=4 176 B10R1.13 OC(=O)C1=CC=C(Br)N=C1 AK-26208 [0,1,0,0,0,0|2,0,0]=3 177 B10R1.13 OC(=O)C1=NC=C(Cl)C=N1 AK-64297 [0,1,0,0,0,0|3,0,0]=4 178 B10R1.13 OC(=O)C1=NC=C(I)C=C1 AK-29144 [0,1,0,0,0,0|2,0,0]=3 179 B10R1.13 OC1=CC=C(C(C)=C)C=C1 AK117164 [0,1,0,0,0,0|3,0,0]=4 180 B10R1.13 OC1=CN=C(C=C1)[N+](=O)[O-] AK-23835 [0,1,0,0,0,0|3,0,0]=4 181 B10R1.15 C1=C(C(OC)=O)C=CN=C1 AK-46755 [0,1,0,0,0,0|3,0,0]=4 182 B10R1.15 C1=C(C(OC)=O)N=CC=C1 AK-46574 [0,1,0,0,0,0|1,0,0]=2 183 B10R1.15 C1=CC=NC=C1C(OC)=O AK-47410 [0,1,0,0,0,0|1,0,0]=2 184 B10R1.15 C1=NC=CN=C1C(OC)=O AK-47365 [0,1,0,0,0,0|0,0,0]=1 185 B10R1.15 CC[C@@H](C1=NC=CC=C1)N AK544238 [0,1,0,0,0,0|2,0,1]=4 186 B10R1.15 CC[C@H](C1=NC=CC=C1)N AK668420 [0,1,0,0,0,0|2,0,1]=4 187 B10R1.15 N1=NC=C(C=C1)C(=O)OC AK-48857 [0,1,0,0,0,0|2,0,0]=3 188 B10R1.15 NCC(C1=CC=CC=C1)=O AK-26107 [0,1,0,0,0,0|2,0,0]=3 189 B10R1.15 NCC(O)C1=NC=CC=C1 AK157200 [0,1,0,0,0,0|1,0,2]=4 190 B10R1.15 NC[C@@H](O)C1=CC=CN=C1 AK-96401 [0,1,0,0,0,0|1,0,2]=4 191 B10R1.15 NNC(C1=CC=CN=C1)=O AK-44810 [0,1,0,0,0,0|2,0,0]=3 192 B10R1.15 O=C(C1=NC=CC=C1)CBr AK-44981 [0,1,0,0,0,0|1,0,0]=2 193 B10R1.15 O=C(C1=NC=CC=N1)OC AK-24352 [0,1,0,0,0,0|2,0,0]=3 194 B10R1.15 O=C(C1=NC=NC=C1)NN AK-68698 [0,1,0,0,0,0|3,0,0]=4 195 B10R1.15 O=C(C1=NN=CC=C1)OC AK-68100 [0,1,0,0,0,0|2,0,0]=3 196 B10R1.15 O=C(NC)C1=CC=CC=C1 AK323662 [0,1,0,0,0,0|2,0,0]=3 197 B10R1.15 O=C(NN)C1=NC=CC=C1 AK117449 [0,1,0,0,0,0|2,0,0]=3 198 B10R1.15 O=C(NN)C1=NC=CN=C1 AK-48495 [0,1,0,0,0,0|1,0,0]=2 199 B10R1.15 O=CN(C)C1=CC=CC=C1 AK-48601 [0,1,0,0,0,0|3,0,0]=4 200 B10R1.15 O=S(C1=CC=CC=C1)OC AK109245 [0,1,0,0,0,0|3,0,0]=4 201 B10R1.15 OCC(=O)C1=CC=CC=C1 AK-94786 [0,1,0,0,0,0|2,0,0]=3 202 B10R1.28 CC(C)(O)C1=NC=CC=C1 AK111321 [0,1,0,0,0,0|1,0,2]=4 203 B10R1.28 CC(N)(C1=CC=CN=C1)C AK-86166 [0,1,0,0,0,0|2,0,1]=4 204 B10R1.28 CC(N)(C1=NC=CC=C1)C AK-64527 [0,1,0,0,0,0|2,0,1]=4 205 B10R1.28 C[Si](C)(C)C1=CC=CC=N1 AK-47822 [0,1,0,0,0,0|2,1,0]=4 206 B10R1.28 N1=CC(=CC=C1)[S](=O)(=O)Cl AK-27033 [0,1,0,0,0,0|3,0,0]=4 207 B10R1.28 N1=CC(=CC=C1)[S](=O)(=O)Cl AK-27053 [0,1,0,0,0,0|3,0,0]=4 208 B10R1.28 O=S(C1=CC=CN=C1)(O)=O AK-47361 [0,1,0,0,0,0|3,0,0]=4 209 B10R1.28 O=S(C1=NC=CC=C1)(N)=O AK-67939 [0,1,0,0,0,0|3,0,0]=4 210 B10R1.61 BrC1=CC=CN=C1C(=O)O AK-25745 [0,1,0,0,0,0|2,0,0]=3 211 B10R1.61 BrC1=CN=CN=C1C(=O)O AK-23815 [0,1,0,0,0,0|3,0,0]=4 212 B10R1.61 BrC1=NC=CN=C1C(=O)O AK-30736 [0,1,0,0,0,0|1,0,0]=2 213 B10R1.61 C1=C(C(=NC=C1)Cl)C(N)=O AK-39181 [0,1,0,0,0,0|2,0,0]=3 214 B10R1.61 C1=C(C(=NC=C1)Cl)C(O)=O AK-27015 [0,1,0,0,0,0|2,0,0]=3 215 B10R1.61 C1=C(C(=NC=C1)F)C(O)=O AK-25163 [0,1,0,0,0,0|2,0,0]=3 216 B10R1.61 C1=C(C(=NC=C1)N)[N+](=O)[O-] AK-25955 [0,1,0,0,0,0|3,0,0]=4 217 B10R1.61 C1=CC=CC(=C1C(C)=O)Br AK-48030 [0,1,0,0,0,0|2,0,0]=3 218 B10R1.61 C1=CC=CC(=C1C(C)=O)N AK-27106 [0,1,0,0,0,0|2,0,0]=3 219 B10R1.61 C1=CC=CC(=C1C(O)=O)F AK-40433 [0,1,0,0,0,0|3,0,0]=4 220 B10R1.61 C1=CC=CC(=C1O)C(=O)C AK-44482 [0,1,0,0,0,0|2,0,0]=3 221 B10R1.61 C1=CC=NC(=C1C)C(O)=O AK-26613 [0,1,0,0,0,0|2,0,0]=3 222 B10R1.61 C1=CC=NC(=C1N)[N+](=O)[O-] AK-25367 [0,1,0,0,0,0|3,0,0]=4 223 B10R1.61 C1=CC=NC(=C1[N+]([O-])=O)Br AK-33945 [0,1,0,0,0,0|3,0,0]=4 224 B10R1.61 C1=CN=C(C(=C1)C(=O)N)F AK-25200 [0,1,0,0,0,0|2,0,0]=3 225 B10R1.61 C1=CN=C(C(=C1)Cl)[N+]([O-])=O AK-26621 [0,1,0,0,0,0|3,0,0]=4 226 B10R1.61 C1=CN=C(C(=N1)C(O)=O)N AK-16902 [0,1,0,0,0,0|1,0,0]=2 227 B10R1.61 C1=NC=CC(=C1C(O)=O)C AK-34679 [0,1,0,0,0,0|2,0,0]=3 228 B10R1.61 C1=NC=CC(=C1[N+]([O-])=O)Cl AK-25355 [0,1,0,0,0,0|3,0,0]=4 229 B10R1.61 CC(=O)C1=C(Br)C=NC=N1 AK-31153 [0,1,0,0,0,0|2,0,0]=3 230 B10R1.61 CC(=O)C1=C(C)N=CC=N1 AK-89662 [0,1,0,0,0,0|0,0,0]=1 231 B10R1.61 CC(=O)C1=C(I)C=CC=C1 AK-84650 [0,1,0,0,0,0|2,0,0]=3 232 B10R1.61 CC(=O)C1=CC=CN=C1F AK-36408 [0,1,0,0,0,0|1,0,0]=2 233 B10R1.61 CC(=O)C1=CC=CN=C1N AK-61895 [0,1,0,0,0,0|1,0,0]=2 234 B10R1.61 CC(=O)C1=NC=CC=C1F AK-36671 [0,1,0,0,0,0|1,0,0]=2 235 B10R1.61 CC(C1=C(O)C=NC=C1)=O AK-68365 [0,1,0,0,0,0|3,0,0]=4 236 B10R1.61 CC(C1=CC=CC=C1C)=O AK-76969 [0,1,0,0,0,0|2,0,0]=3 237 B10R1.61 CC(C1=CC=CC=C1F)=O AK-44672 [0,1,0,0,0,0|2,0,0]=3 238 B10R1.61 CC(C1=CC=CN=C1C)=O AK-60286 [0,1,0,0,0,0|1,0,0]=2 239 B10R1.61 CC(C1=NC=CC=C1Br)=O AK-91392 [0,1,0,0,0,0|1,0,0]=2 240 B10R1.61 CC(C1=NC=CC=C1Cl)=O AK128527 [0,1,0,0,0,0|1,0,0]=2 241 B10R1.61 CC(C1=NC=CC=C1O)=O AK-57786 [0,1,0,0,0,0|1,0,0]=2 242 B10R1.61 CC(N)C1=NC=CC=C1C AK670791 [0,1,0,0,0,0|2,0,1]=4 243 B10R1.61 CC(O)C1=CC=CN=C1Cl AK118779 [0,1,0,0,0,0|1,0,2]=4 244 B10R1.61 CC1=C(C(=O)N)C=CC=N1 AK-39636 [0,1,0,0,0,0|2,0,0]=3 245 B10R1.61 CC1=C(C(=O)O)C=CC=N1 AK-25768 [0,1,0,0,0,0|2,0,0]=3 246 B10R1.61 CC1=C(C=NC=C1)[N+]([O-])=O AK104739 [0,1,0,0,0,0|3,0,0]=4 247 B10R1.61 CC1=C(C=NC=N1)C(O)=O AK-32530 [0,1,0,0,0,0|3,0,0]=4 248 B10R1.61 CC1=NC=CC=C1N(=O)=O AK-26710 [0,1,0,0,0,0|3,0,0]=4 249 B10R1.61 CC1=NC=CN=C1C(=O)O AK-25946 [0,1,0,0,0,0|1,0,0]=2 250 B10R1.61 CN(C)C1=NC=CN=C1Cl AK124994 [0,1,0,0,0,0|2,0,0]=3 251 B10R1.61 ClC1=CC=CN=C1C(=O)O AK-23699 [0,1,0,0,0,0|2,0,0]=3 252 B10R1.61 ClC1=CC=NC=C1C(=O)O AK-25252 [0,1,0,0,0,0|2,0,0]=3 253 B10R1.61 ClC1=NC=CN=C1C(=O)O AK-24100 [0,1,0,0,0,0|1,0,0]=2 254 B10R1.61 FC1=C(C=CN=C1)C(C)=O AK-37142 [0,1,0,0,0,0|3,0,0]=4 255 B10R1.61 FC1=C(N=CC=C1)C(=O)O AK-28801 [0,1,0,0,0,0|2,0,0]=3 256 B10R1.61 FC1=CC=CN=C1[N+](=O)[O-] AK-23503 [0,1,0,0,0,0|3,0,0]=4 257 B10R1.61 FC1=NC=CC=C1[N+](=O)[O-] AK-33351 [0,1,0,0,0,0|3,0,0]=4 258 B10R1.61 N=C(N)C1=NC=CC=C1C AK130359 [0,1,0,0,0,0|3,0,0]=4 259 B10R1.61 NC1=C(C(C)C)C=NC=C1 AK349169 [0,1,0,0,0,0|2,0,1]=4 260 B10R1.61 NC1=C(C=CN=N1)C(=O)O AK-24603 [0,1,0,0,0,0|3,0,0]=4 261 B10R1.61 NC1=C(C=NC=C1)C(=O)N AK-29493 [0,1,0,0,0,0|2,0,0]=3 262 B10R1.61 NC1=C(C=NC=C1)C(O)=O AK-27731 [0,1,0,0,0,0|2,0,0]=3 263 B10R1.61 NC1=NC=CN=C1N(C)C AK-23941 [0,1,0,0,0,0|2,0,0]=3 264 B10R1.61 O=C(C1=CN=CN=C1N)O AK-34045 [0,1,0,0,0,0|3,0,0]=4 265 B10R1.61 O=C(C1=CN=CN=C1O)N AK343645 [0,1,0,0,0,0|3,0,0]=4 266 B10R1.61 O=C(C1=CN=CNC1=O)O AK-39341 [0,1,0,0,0,0|3,0,0]=4 267 B10R1.61 O=C(C1=NC=CC=C1N)O AK-25432 [0,1,0,0,0,0|2,0,0]=3 268 B10R1.61 O=C(C1=NC=CN=C1Cl)N AK-80835 [0,1,0,0,0,0|1,0,0]=2 269 B10R1.61 O=C(C1=NC=CN=C1I)O AK-30598 [0,1,0,0,0,0|1,0,0]=2 270 B10R1.61 O=C(C1=NC=CN=C1O)N AK-39215 [0,1,0,0,0,0|1,0,0]=2 271 B10R1.61 O=C(C1=NC=CNC1=O)O AK-30536 [0,1,0,0,0,0|1,0,1]=3 272 B10R1.61 O=C(C1=NC=NC=C1C)O AK140920 [0,1,0,0,0,0|3,0,0]=4 273 B10R1.61 O=C(N)C1=CC=CC=C1Br AK-47071 [0,1,0,0,0,0|3,0,0]=4 274 B10R1.61 O=C(N)C1=CC=CC=C1Cl AK128986 [0,1,0,0,0,0|3,0,0]=4 275 B10R1.61 O=C(N)C1=CC=CC=C1F AK161780 [0,1,0,0,0,0|3,0,0]=4 276 B10R1.61 O=C(N)C1=CC=CC=C1I AK115884 [0,1,0,0,0,0|3,0,0]=4 277 B10R1.61 O=C(N)C1=CC=CC=C1N AK109256 [0,1,0,0,0,0|3,0,0]=4 278 B10R1.61 O=C(N)C1=NC=CC=C1C AK-48603 [0,1,0,0,0,0|2,0,0]=3 279 B10R1.61 O=C(N)C1=NC=CC=C1N AK-35369 [0,1,0,0,0,0|2,0,0]=3 280 B10R1.61 O=C(O)C1=C(N)N=CC=C1 AK-26982 [0,1,0,0,0,0|2,0,0]=3 281 B10R1.61 O=C(O)C1=C(S)N=CC=C1 AK-48961 [0,1,0,0,0,0|2,0,0]=3 282 B10R1.61 O=C(O)C1=CC=CC=C1Br AK-77301 [0,1,0,0,0,0|3,0,0]=4 283 B10R1.61 O=C(O)C1=CC=CC=C1C AK116916 [0,1,0,0,0,0|3,0,0]=4 284 B10R1.61 O=C(O)C1=CC=CC=C1Cl AK-44481 [0,1,0,0,0,0|3,0,0]=4 285 B10R1.61 O=C(O)C1=CC=CC=C1I AK-73132 [0,1,0,0,0,0|3,0,0]=4 286 B10R1.61 O=C(O)C1=CN=CC=C1Br AK-25100 [0,1,0,0,0,0|2,0,0]=3 287 B10R1.61 O=C(O)C1=CN=CC=C1C AK-75600 [0,1,0,0,0,0|2,0,0]=3 288 B10R1.61 O=C(O)C1=NC=CC=C1I AK-29488 [0,1,0,0,0,0|2,0,0]=3 289 B10R1.61 O=C(O)C1=NC=CC=C1O AK-26380 [0,1,0,0,0,0|2,0,0]=3 290 B10R1.61 O=C1C(=CC=CN1)C(O)=O AK-47329 [0,1,0,0,0,0|2,0,1]=4 291 B10R1.61 O=C1C(=CNC=C1)C(=O)O AK-26174 [0,1,0,0,0,0|2,0,1]=4 292 B10R1.61 O=C1C(C(C)=O)=CC=CN1 AK-35911 [0,1,0,0,0,0|1,0,1]=3 293 B10R1.61 O=C1C(C(C)=O)=CNC=C1 AK501394 [0,1,0,0,0,0|1,0,1]=3 294 B10R1.61 O=[N+](C1=C(Br)C=CN=C1)[O-] AK-34243 [0,1,0,0,0,0|3,0,0]=4 295 B10R1.61 O=[N+](C1=C(C)C=CN=C1)[O-] AK-28081 [0,1,0,0,0,0|3,0,0]=4 296 B10R1.61 O=[N+](C1=C(N)C=CN=C1)[O-] AK-28863 [0,1,0,0,0,0|3,0,0]=4 297 B10R1.61 O=[N+](C1=CC=CN=C1C)[O-] AK-23642 [0,1,0,0,0,0|3,0,0]=4 298 B10R1.61 O=[N+](C1=CC=CN=C1Cl)[O-] AK-27005 [0,1,0,0,0,0|3,0,0]=4 299 B10R1.61 O=[N+](C1=NC=CC=C1Br)[O-] AK-26100 [0,1,0,0,0,0|3,0,0]=4 300 B10R1.61 O=[N+](C1=NC=CC=C1I)[O-] AK140224 [0,1,0,0,0,0|3,0,0]=4 301 B10R1.61 O=[N+](C1=NC=CN=C1Cl)[O-] AK-27354 [0,1,0,0,0,0|2,0,0]=3 302 B10R1.61 OC(=O)C1=CC=CN=C1Br AK-25846 [0,1,0,0,0,0|2,0,0]=3 303 B10R1.61 OC1=CC=CC=C1C(N)=O AK-81394 [0,1,0,0,0,0|3,0,0]=4 304 B10R1.61 OC1=CC=CC=C1C(O)=O AK397674 [0,1,0,0,0,0|3,0,0]=4 305 B10R1.61 OC1=CC=CN=C1[N+]([O-])=O AK-28551 [0,1,0,0,0,0|3,0,0]=4 306 B10R1.61 SC1=NC=CC=C1[N+]([O-])=O AK-49743 [0,1,0,0,0,0|3,0,0]=4 307 B10R1.113 BrC1=CC(=CN=C1)C(=C)C AK-40102 [0,1,0,0,0,0|2,0,0]=3 308 B10R1.113 BrC1=CC(=CN=C1)[N+](=O)[O-] AK-24340 [0,1,0,0,0,0|3,0,0]=4 309 B10R1.113 BrC1=CC(=NC=C1)N(C)C AK-49151 [0,1,0,0,0,0|3,0,0]=4 310 B10R1.113 BrC1=NC(=CC=C1)[N+](=O)[O-] AK-25599 [0,1,0,0,0,0|3,0,0]=4 311 B10R1.113 C(C)(=O)C1=CC(=CN=C1)Br AK-25899 [0,1,0,0,0,0|1,0,0]=2 312 B10R1.113 C(C)(=O)C1=CC(=NC=C1)C AK-26955 [0,1,0,0,0,0|3,0,0]=4 313 B10R1.113 C(C)(=O)C1=NC(=CC=C1)Br AK-30565 [0,1,0,0,0,0|1,0,0]=2 314 B10R1.113 C1=C(C(C)=O)C=C(C=C1)O AK-46681 [0,1,0,0,0,0|2,0,0]=3 315 B10R1.113 C1=C(C=CC=C1Cl)C(O)=O AK-43975 [0,1,0,0,0,0|3,0,0]=4 316 B10R1.113 C1=C(C=CC=C1F)C(O)=O AK-53854 [0,1,0,0,0,0|3,0,0]=4 317 B10R1.113 C1=C(C=NC=C1Br)C(N)=O AK-34529 [0,1,0,0,0,0|2,0,0]=3 318 B10R1.113 C1=C(C=NC=C1C(O)=O)F AK-25931 [0,1,0,0,0,0|2,0,0]=3 319 B10R1.113 C1=C(C=NC=C1C)C(O)=O AK-23837 [0,1,0,0,0,0|2,0,0]=3 320 B10R1.113 C1=C(C=NC=C1Cl)C(O)=O AK-25160 [0,1,0,0,0,0|2,0,0]=3 321 B10R1.113 C1=C(N=C(C=C1)Cl)[N+]([O-])=O AK-28534 [0,1,0,0,0,0|3,0,0]=4 322 B10R1.113 C1=CC=C(F)N=C1C(=O)O AK-30385 [0,1,0,0,0,0|2,0,0]=3 323 B10R1.113 C1=CC=C(N=C1C(O)=O)C AK-27736 [0,1,0,0,0,0|2,0,0]=3 324 B10R1.113 C1=NC=C(C=C1C(=O)N)N AK-26169 [0,1,0,0,0,0|2,0,0]=3 325 B10R1.113 C1=NC=C(Cl)N=C1C(=O)O AK-27777 [0,1,0,0,0,0|1,0,0]=2 326 B10R1.113 C1=NC=C(N=C1C(=O)O)C AK-26120 [0,1,0,0,0,0|1,0,0]=2 327 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 AK-34279 [0,1,0,0,0,0|3,0,0]=4 328 B10R1.113 CC(=O)C1=CC=NC(Cl)=N1 AK100632 [0,1,0,0,0,0|2,0,0]=3 329 B10R1.113 CC(C1=CC(F)=CN=C1)=O AK101043 [0,1,0,0,0,0|1,0,0]=2 330 B10R1.113 CC(C1=CC(N)=NC=C1)=O AK134215 [0,1,0,0,0,0|3,0,0]=4 331 B10R1.113 CC(C1=CC=CC(Br)=C1)=O AK-44590 [0,1,0,0,0,0|2,0,0]=3 332 B10R1.113 CC(C1=CC=CC(C)=C1)=O AK143347 [0,1,0,0,0,0|2,0,0]=3 333 B10R1.113 CC(C1=NC(Cl)=CC=C1)=O AK-29671 [0,1,0,0,0,0|1,0,0]=2 334 B10R1.113 CC(C1=NC(F)=CC=C1)=O AK-74181 [0,1,0,0,0,0|1,0,0]=2 335 B10R1.113 CC(C1=NC=CC(C)=C1)=O AK-61872 [0,1,0,0,0,0|1,0,0]=2 336 B10R1.113 CC(C1=NC=CC(Cl)=C1)=O AK-30041 [0,1,0,0,0,0|1,0,0]=2 337 B10R1.113 CC(C1=NC=NC(C)=C1)=O AK-78932 [0,1,0,0,0,0|2,0,0]=3 338 B10R1.113 CC(O)C1=NC(Br)=CC=C1 AK-58995 [0,1,0,0,0,0|1,0,2]=4 339 B10R1.113 CC1=CC(=NC=C1)[N+]([O-])=O AK-33823 [0,1,0,0,0,0|3,0,0]=4 340 B10R1.113 CC1=CC=CC(C(C)=O)=N1 AK-30134 [0,1,0,0,0,0|1,0,0]=2 341 B10R1.113 CC1=CC=NC(=C1)C(=O)O AK-30381 [0,1,0,0,0,0|2,0,0]=3 342 B10R1.113 CC1=CC=NC(=N1)C(O)=O AK-36910 [0,1,0,0,0,0|3,0,0]=4 343 B10R1.113 CC1=NC=CC(=N1)C(=O)O AK-23648 [0,1,0,0,0,0|3,0,0]=4 344 B10R1.113 CN(C)C1=CN=CC(Cl)=N1 AK-74056 [0,1,0,0,0,0|2,0,0]=3 345 B10R1.113 C[C@@H](N)C1=CC(Cl)=CN=C1 AK668419 [0,1,0,0,0,0|2,0,1]=4 346 B10R1.113 C[C@@H](N)C1=NC(F)=CC=C1 AK668445 [0,1,0,0,0,0|2,0,1]=4 347 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 AK335908 [0,1,0,0,0,0|2,0,1]=4 348 B10R1.113 ClC1=CC(=CN=C1)N(=O)=O AK-23519 [0,1,0,0,0,0|3,0,0]=4 349 B10R1.113 ClC1=CC(=NC=C1)[N+](=O)[O-] AK-23757 [0,1,0,0,0,0|3,0,0]=4 350 B10R1.113 ClC1=NC=CC(=N1)C(=O)O AK-28365 [0,1,0,0,0,0|3,0,0]=4 351 B10R1.113 N=C(N)C1=NC=CC(C)=C1 AK130218 [0,1,0,0,0,0|3,0,0]=4 352 B10R1.113 NC(=O)C1=CN=CC(Cl)=N1 AK-39096 [0,1,0,0,0,0|1,0,0]=2 353 B10R1.113 NC1=CC(C(C)=O)=CC=C1 AK-83273 [0,1,0,0,0,0|2,0,0]=3 354 B10R1.113 NC1=CC=NC(=C1)C(=O)O AK-72771 [0,1,0,0,0,0|2,0,0]=3 355 B10R1.113 NC1=CN=CC(=C1)C(O)=O AK-34306 [0,1,0,0,0,0|2,0,0]=3 356 B10R1.113 NC1=CN=CC(=N1)C(=O)O AK-30537 [0,1,0,0,0,0|1,0,0]=2 357 B10R1.113 NC1=NC(C(C)C)=CC=C1 AK-29534 [0,1,0,0,0,0|2,0,1]=4 358 B10R1.113 O=C(C1=CC=CC(Cl)=N1)O AK-26005 [0,1,0,0,0,0|2,0,0]=3 359 B10R1.113 O=C(C1=CC=CC(N1)=O)O AK-25557 [0,1,0,0,0,0|2,0,1]=4 360 B10R1.113 O=C(C1=NC(Br)=CN=C1)O AK158200 [0,1,0,0,0,0|1,0,0]=2 361 B10R1.113 O=C(C1=NC(Br)=NC=C1)O AK145986 [0,1,0,0,0,0|3,0,0]=4 362 B10R1.113 O=C(C1=NC(Cl)=NC=C1)N AK107035 [0,1,0,0,0,0|3,0,0]=4 363 B10R1.113 O=C(C1=NC(N)=NC=C1)N AK145739 [0,1,0,0,0,0|3,0,0]=4 364 B10R1.113 O=C(C1=NC(N)=NC=C1)O AK-65335 [0,1,0,0,0,0|3,0,0]=4 365 B10R1.113 O=C(C1=NC=CC(Br)=C1)O AK-23753 [0,1,0,0,0,0|2,0,0]=3 366 B10R1.113 O=C(C1=NC=NC(C)=C1)O AK114394 [0,1,0,0,0,0|3,0,0]=4 367 B10R1.113 O=C(C1=NN=CC(Cl)=C1)O AK398901 [0,1,0,0,0,0|3,0,0]=4 368 B10R1.113 O=C(N)C1=CC=CC(Br)=C1 AK-61366 [0,1,0,0,0,0|3,0,0]=4 369 B10R1.113 O=C(N)C1=NC=CC(N)=C1 AK103735 [0,1,0,0,0,0|2,0,0]=3 370 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 AK-77039 [0,1,0,0,0,0|3,0,0]=4 371 B10R1.113 O=C(O)C1=CC=CC(C)=C1 AK116994 [0,1,0,0,0,0|3,0,0]=4 372 B10R1.113 O=C(O)C1=CC=CC(I)=C1 AK-40488 [0,1,0,0,0,0|3,0,0]=4 373 B10R1.113 O=C(O)C1=CC=CC(N)=C1 AK-41177 [0,1,0,0,0,0|3,0,0]=4 374 B10R1.113 O=C(O)C1=CC=CC(O)=C1 AK-50288 [0,1,0,0,0,0|3,0,0]=4 375 B10R1.113 O=C(O)C1=CN=CC(Br)=C1 AK-25583 [0,1,0,0,0,0|2,0,0]=3 376 B10R1.113 O=C(O)C1=CN=CC(I)=C1 AK-28811 [0,1,0,0,0,0|2,0,0]=3 377 B10R1.113 O=C(O)C1=CN=CC(O)=C1 AK-25698 [0,1,0,0,0,0|2,0,0]=3 378 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 AK-23768 [0,1,0,0,0,0|2,0,0]=3 379 B10R1.113 O=C(O)C1=NC=CC(I)=C1 AK-30405 [0,1,0,0,0,0|2,0,0]=3 380 B10R1.113 O=C1NN=CC(=C1)C(=O)O AK-26372 [0,1,0,0,0,0|3,0,0]=4 381 B10R1.113 O=[N+](C1=NC=CC(Br)=C1)[O-] AK132918 [0,1,0,0,0,0|3,0,0]=4 382 B10R1.113 O=[N+](C1=NC=CC(N)=C1)[O-] AK-28786 [0,1,0,0,0,0|3,0,0]=4 383 B10R1.113 OC(=O)C1=NC(Br)=CC=C1 AK-25597 [0,1,0,0,0,0|2,0,0]=3 384 B10R1.113 OC(=O)C1=NC=NC(Cl)=C1 AK-29233 [0,1,0,0,0,0|3,0,0]=4 385 B10R1.113 OC1=CC([N+]([O-])=O)=CN=C1 AK-28936 [0,1,0,0,0,0|3,0,0]=4 386 B10R1.113 [N+](=O)([O-])C1=CC=CC(=N1)N AK-28785 [0,1,0,0,0,0|3,0,0]=4 387 B10R1.113 [N+](=O)([O-])C1=CN=CC(=C1)N AK-29617 [0,1,0,0,0,0|3,0,0]=4 388 B10R1.113 [O-][N+](=O)C1=CN=CC(F)=C1 AK100223 [0,1,0,0,0,0|3,0,0]=4 389 B10R1.113 [O-][N+](=O)C1=NC=CC(F)=C1 AK-98164 [0,1,0,0,0,0|3,0,0]=4 390 B10R2.320 C1=CC=CC2=C1CC2=O AK-72898 [0,0,0,1,0,0|2,0,0]=3 391 B8R1.7 C1=C(C(=O)O)[NH]C=N1 AK-25282 [0,0,0,0,1,0|1,0,1]=3 392 B8R1.7 C1=C([N+]([O-])=O)[NH]C=N1 AK-34599 [0,0,0,0,1,0|2,0,1]=4 393 B8R1.7 C1=C([N+]([O-])=O)[NH]N=C1 AK-27124 [0,0,0,0,1,0|3,0,0]=4 394 B8R1.7 C1=CC=N[N]1[N+](=O)[O-] AK-50064 [0,0,0,0,1,0|3,0,0]=4 395 B8R1.7 C1=COC=C1C(O)=O AK-32276 [0,0,0,0,1,0|2,0,0]=3 396 B8R1.7 C1=CSC(=N1)C(C)=O AK-46781 [0,0,0,0,1,0|1,0,0]=2 397 B8R1.7 C1=NC=C(S1)C(=O)O AK-27761 [0,0,0,0,1,0|2,0,0]=3 398 B8R1.7 C1=N[NH]C=C1C(O)=O AK-25877 [0,0,0,0,1,0|2,0,0]=3 399 B8R1.7 C1=N[NH]C=C1[N+]([O-])=O AK-23786 [0,0,0,0,1,0|3,0,0]=4 400 B8R1.7 CC(=O)C1=CC=CN1 AK-53458 [0,0,0,0,1,0|0,0,1]=2 401 B8R1.7 CC(=O)C1=CC=NO1 AK-68495 [0,0,0,0,1,0|1,0,0]=2 402 B8R1.7 CC(=O)C1=CSC=C1 AK-44537 [0,0,0,0,1,0|1,0,0]=2 403 B8R1.7 CC(C1=CC=CO1)C AK120816 [0,0,0,0,1,0|2,0,1]=4 404 B8R1.7 CC(C1=NC=CN1)C AK106223 [0,0,0,0,1,0|1,0,2]=4 405 B8R1.7 CC(N)C1=NC=CS1 AK-77903 [0,0,0,0,1,0|2,0,1]=4 406 B8R1.7 CC(N)C1=NC=CS1 AK-77904 [0,0,0,0,1,0|2,0,1]=4 407 B8R1.7 CC(N1C=CN=C1)C AK-79287 [0,0,0,0,1,0|2,0,1]=4 408 B8R1.7 CC(N1N=CC=C1)C AK-61646 [0,0,0,0,1,0|2,0,1]=4 409 B8R1.7 C[C@@H](N)C1=NC=CS1 AK153996 [0,0,0,0,1,0|2,0,1]=4 410 B8R1.7 C[C@H](N)C1=CC=CO1 AK544263 [0,0,0,0,1,0|2,0,1]=4 411 B8R1.7 C[C@H](N)C1=CC=CS1 AK486945 [0,0,0,0,1,0|2,0,1]=4 412 B8R1.7 C[C@H](N)C1=NC=CS1 AK153993 [0,0,0,0,1,0|2,0,1]=4 413 B8R1.7 N=C(C1=NC=CS1)N AK-78239 [0,0,0,0,1,0|3,0,0]=4 414 B8R1.7 N=C(N1N=CC=C1)N AK-27720 [0,0,0,0,1,0|3,0,0]=4 415 B8R1.7 N=C(N1N=CN=C1)N AK-88472 [0,0,0,0,1,0|3,0,0]=4 416 B8R1.7 NC(=O)C1=COC=N1 AK-99961 [0,0,0,0,1,0|2,0,0]=3 417 B8R1.7 NC(=O)C1=NC=NN1 AK-32575 [0,0,0,0,1,0|2,0,0]=3 418 B8R1.7 O1C=CC(=N1)C(=O)O AK-27692 [0,0,0,0,1,0|2,0,0]=3 419 B8R1.7 O1N=CC(=N1)C(=O)O AK-32069 [0,0,0,0,1,0|2,0,0]=3 420 B8R1.7 O=C(C1=CC=CN1)O AK-44225 [0,0,0,0,1,0|1,0,1]=3 421 B8R1.7 O=C(C1=CC=CO1)O AK-72863 [0,0,0,0,1,0|2,0,0]=3 422 B8R1.7 O=C(C1=CC=CS1)[O-] AK110095 [0,0,0,0,1,0|2,0,0]=3 423 B8R1.7 O=C(C1=CC=NO1)O AK-25596 [0,0,0,0,1,0|2,0,0]=3 424 B8R1.7 O=C(C1=CC=NS1)O AK-94814 [0,0,0,0,1,0|2,0,0]=3 425 B8R1.7 O=C(C1=CN=CO1)O AK-28732 [0,0,0,0,1,0|2,0,0]=3 426 B8R1.7 O=C(C1=CNC=C1)C AK-45953 [0,0,0,0,1,0|0,0,1]=2 427 B8R1.7 O=C(C1=CNC=N1)C AK-45163 [0,0,0,0,1,0|0,0,1]=2 428 B8R1.7 O=C(C1=COC=N1)O AK-29026 [0,0,0,0,1,0|2,0,0]=3 429 B8R1.7 O=C(C1=CSC=C1)O AK-46373 [0,0,0,0,1,0|2,0,0]=3 430 B8R1.7 O=C(C1=CSC=N1)O AK-23931 [0,0,0,0,1,0|2,0,0]=3 431 B8R1.7 O=C(C1=CSN=C1)O AK-84534 [0,0,0,0,1,0|2,0,0]=3 432 B8R1.7 O=C(C1=NC=CN1)N AK139797 [0,0,0,0,1,0|1,0,1]=3 433 B8R1.7 O=C(C1=NC=CO1)[O-] AK-93393 [0,0,0,0,1,0|2,0,0]=3 434 B8R1.7 O=C(C1=NNC=C1)N AK-27992 [0,0,0,0,1,0|2,0,0]=3 435 B8R1.7 O=C(C1=NNC=C1)O AK-29904 [0,0,0,0,1,0|2,0,0]=3 436 B8R1.7 O=[N+](C1=CC=CN1)[O-] AK-77322 [0,0,0,0,1,0|2,0,1]=4 437 B8R1.7 O=[N+](C1=NC=CN1)[O-] AK-28550 [0,0,0,0,1,0|2,0,1]=4 438 B8R1.7 OC(=O)C1=CNC=C1 AK-26450 [0,0,0,0,1,0|1,0,1]=3 439 B8R1.7 OC(=O)C1=CNN=N1 AK-28855 [0,0,0,0,1,0|2,0,1]=4 440 B8R1.7 S1C=C(N=C1)C(C)=O AK-39395 [0,0,0,0,1,0|1,0,0]=2 441 B8R1.7 S1C=CN=C1C(=O)O AK-21895 [0,0,0,0,1,0|2,0,0]=3 442 B8R1.7 S=C(C1=CC=CS1)N AK-40144 [0,0,0,0,1,0|2,1,0]=4 443 B8R1.7 [N+](=O)([O-])C1=CON=C1 AK-24625 [0,0,0,0,1,0|3,0,0]=4 444 B8R1.7 [NH]1C=CN=C1C(=O)O AK-27693 [0,0,0,0,1,0|1,0,1]=3 445 B8R1.7 [O-]C(=O)C1=CC=CS1 AK111442 [0,0,0,0,1,0|2,0,0]=3 446 B8R1.7 [O-][N+](=O)C1=CNC=C1 AK-82340 [0,0,0,0,1,0|2,0,1]=4 447 B10R1.18 C1=C(C=CN=C1)CC(C)=O AK-47657 [0,0,0,0,0,1|3,0,0]=4 448 B10R1.18 C1=NC=CC=C1CC(O)=O AK-26036 [0,0,0,0,0,1|2,0,0]=3 449 B10R1.18 CC(CC1=NC=CC=C1)=O AK-32596 [0,0,0,0,0,1|1,0,0]=2 450 B10R1.18 CC(NC1=NC=CC=N1)=O AK137493 [0,0,0,0,0,1|2,0,0]=3 451 B10R1.18 CC(OC1=CC=CN=C1)C AK167273 [0,0,0,0,0,1|2,0,1]=4 452 B10R1.18 CC(OC1=NC=CC=C1)C AK-47912 [0,0,0,0,0,1|2,0,1]=4 453 B10R1.18 C\C(C)=C/C1=CC=CC=C1 AK113914 [0,0,0,0,0,1|3,0,0]=4 454 B10R1.18 N1=CN=CC(=C1)CC(=O)O AK-32588 [0,0,0,0,0,1|3,0,0]=4 455 B10R1.18 O=C(N)CC1=CC=CC=C1 AK-45803 [0,0,0,0,0,1|3,0,0]=4 456 B10R1.18 O=C(N)CC1=CC=CN=C1 AK-81612 [0,0,0,0,0,1|2,0,0]=3 457 B10R1.18 O=C(N)CC1=NC=CC=N1 AK133068 [0,0,0,0,0,1|3,0,0]=4 458 B10R1.18 O=C(N)NC1=NC=CN=C1 AK321494 [0,0,0,0,0,1|1,0,0]=2 459 B10R1.18 O=C(O)CC1=CC=CN=C1 AK-26773 [0,0,0,0,0,1|2,0,0]=3 460 B10R1.18 OC(=O)CC1=CC=CC=N1 AK-45110 [0,0,0,0,0,1|2,0,0]=3 461 B10R1.18 S=C(N)NC1=NC=CC=C1 AK158972 [0,0,0,0,0,1|2,1,0]=4 462 B10R1.18 S=C(N)NC1=NC=CN=C1 AK323308 [0,0,0,0,0,1|1,1,0]=3 463 B7R0.4 C\C=C\C=C\C([O-])=O AK-47286 [1,0,1,0,0,0|2,0,0]=4 464 B7R1.3 BrC1=NC=CN=C1 AK-21911 [2,0,0,0,0,0|1,0,0]=3 465 B7R1.3 C1=C(C)C=NC=N1 AK-30562 [2,0,0,0,0,0|2,0,0]=4 466 B7R1.3 C1=C(C)C=NN=C1 AK-30760 [2,0,0,0,0,0|2,0,0]=4 467 B7R1.3 CC1=CN=CC=N1 AK-88672 [2,0,0,0,0,0|0,0,0]=2 468 B7R1.3 CC1=NC=NC=C1 AK-34763 [2,0,0,0,0,0|2,0,0]=4 469 B7R1.3 IC1=CC=CN=C1 AK-46371 [2,0,0,0,0,0|2,0,0]=4 470 B7R1.3 IC1=CN=CC=N1 AK-23638 [2,0,0,0,0,0|1,0,0]=3 471 B7R1.3 IC1=NC=CC=C1 AK-43060 [2,0,0,0,0,0|2,0,0]=4 472 B7R1.3 NC1=NC=CN=C1 AK-24896 [2,0,0,0,0,0|1,0,0]=3 473 B7R1.3 NC1=NC=CN=N1 AK-39292 [2,0,0,0,0,0|2,0,0]=4 474 B7R1.3 O=C1C=CC=NN1 AK-29318 [2,0,0,0,0,0|2,0,0]=4 475 B7R1.3 O=C1NC=CN=C1 AK-24500 [2,0,0,0,0,0|0,0,1]=3 476 B7R1.3 OC1=CC=CN=C1 AK-44238 [2,0,0,0,0,0|1,0,1]=4 477 B9R1.1 BrC1=CN=C(C=C1)CC AK-34965 [1,1,0,0,0,0|1,0,1]=4 478 B9R1.1 BrC1=CN=C(C=C1)NC AK-46585 [1,1,0,0,0,0|2,0,0]=4 479 B9R1.1 BrC1=NC=C(C=C1)OC AK-25274 [1,1,0,0,0,0|2,0,0]=4 480 B9R1.1 BrC1=NC=C(N=C1)C#N AK-24125 [1,1,0,0,0,0|1,0,1]=4 481 B9R1.1 C1=C(C=CC(=C1)I)C=O AK-75599 [1,1,0,0,0,0|2,0,0]=4 482 B9R1.1 C1=CC(=CN=C1OC)Br AK-32435 [1,1,0,0,0,0|2,0,0]=4 483 B9R1.1 C1=CC(=CN=C1OC)N AK-24754 [1,1,0,0,0,0|2,0,0]=4 484 B9R1.1 C1=NC(=CC=C1C=O)Br AK-25442 [1,1,0,0,0,0|1,0,0]=3 485 B9R1.1 C1=NC(=CC=C1C=O)Cl AK-25624 [1,1,0,0,0,0|1,0,0]=3 486 B9R1.1 C1=NC(=NC=C1C=O)N AK-28546 [1,1,0,0,0,0|2,0,0]=4 487 B9R1.1 CC1=CC=C(C=O)C=C1 AK-65210 [1,1,0,0,0,0|2,0,0]=4 488 B9R1.1 CC1=CN=C(C=C1)C=O AK-35332 [1,1,0,0,0,0|1,0,0]=3 489 B9R1.1 CC1=CN=C(C=N1)CO AK-24727 [1,1,0,0,0,0|0,0,2]=4 490 B9R1.1 CC1=CN=C(CCl)C=N1 AK138019 [1,1,0,0,0,0|1,0,1]=4 491 B9R1.1 CC1=CN=C(OC)C=C1 AK-58301 [1,1,0,0,0,0|2,0,0]=4 492 B9R1.1 CC1=NC=C(C=C1)C=O AK-26076 [1,1,0,0,0,0|1,0,0]=3 493 B9R1.1 CCC1=CN=C(C=N1)C AK-58106 [1,1,0,0,0,0|0,0,1]=3 494 B9R1.1 CCC1=CN=C(Cl)C=C1 AK-48582 [1,1,0,0,0,0|1,0,1]=4 495 B9R1.1 CCC1=NC=C(Cl)C=C1 AK134672 [1,1,0,0,0,0|1,0,1]=4 496 B9R1.1 CNC1=NC=C(Br)N=C1 AK136913 [1,1,0,0,0,0|1,0,0]=3 497 B9R1.1 CNC1=NC=C(Cl)C=C1 AK123580 [1,1,0,0,0,0|2,0,0]=4 498 B9R1.1 COC1=CN=C(Br)C=N1 AK-24261 [1,1,0,0,0,0|1,0,0]=3 499 B9R1.1 COC1=CN=C(Cl)C=C1 AK-33219 [1,1,0,0,0,0|2,0,0]=4 500 B9R1.1 COC1=CN=C(F)C=C1 AK-61561 [1,1,0,0,0,0|2,0,0]=4 501 B9R1.1 COC1=NC=C(Cl)C=C1 AK-44270 [1,1,0,0,0,0|2,0,0]=4 502 B9R1.1 COC1=NC=C(Cl)N=C1 AK-64586 [1,1,0,0,0,0|1,0,0]=3 503 B9R1.1 COC1=NC=C(F)C=C1 AK-27023 [1,1,0,0,0,0|2,0,0]=4 504 B9R1.1 COC1=NC=C(I)C=C1 AK-58302 [1,1,0,0,0,0|2,0,0]=4 505 B9R1.1 CSC1=CN=C(Br)C=N1 AK-47704 [1,1,0,0,0,0|1,0,0]=3 506 B9R1.1 CSC1=CN=C(N)C=C1 AK-40039 [1,1,0,0,0,0|2,0,0]=4 507 B9R1.1 ClC1=CN=C(C=C1)C=O AK-44636 [1,1,0,0,0,0|1,0,0]=3 508 B9R1.1 ClC1=NC=C(C=O)C=N1 AK-29616 [1,1,0,0,0,0|2,0,0]=4 509 B9R1.1 ClC1=NC=C(C=O)N=C1 AK-87373 [1,1,0,0,0,0|0,0,0]=2 510 B9R1.1 ClC1=NC=C(N=C1)C#N AK-24124 [1,1,0,0,0,0|1,0,1]=4 511 B9R1.1 FC1=NC=C(C=C1)C=O AK-25098 [1,1,0,0,0,0|1,0,0]=3 512 B9R1.1 N#CC1=NC=C(N)N=C1 AK-21935 [1,1,0,0,0,0|1,0,1]=4 513 B9R1.1 NC1=CC=C(CC)N=C1 AK-78651 [1,1,0,0,0,0|1,0,1]=4 514 B9R1.1 NC1=CN=C(NC)C=C1 AK-75542 [1,1,0,0,0,0|2,0,0]=4 515 B9R1.1 NC1=CN=C(NC)C=C1 AK141591 [1,1,0,0,0,0|2,0,0]=4 516 B9R1.1 NC1=NC=C(C=C1)OC AK-27987 [1,1,0,0,0,0|2,0,0]=4 517 B9R1.1 NC1=NC=C(N=C1)CC AK-26631 [1,1,0,0,0,0|0,0,1]=3 518 B9R1.1 NC1=NC=C(N=C1)OC AK-24108 [1,1,0,0,0,0|1,0,0]=3 519 B9R1.1 O=CC1=CC=C(Br)C=C1 AK-80048 [1,1,0,0,0,0|2,0,0]=4 520 B9R1.1 O=CC1=CC=C(Cl)C=C1 AK-76679 [1,1,0,0,0,0|2,0,0]=4 521 B9R1.1 O=CC1=CC=C(F)C=C1 AK-84401 [1,1,0,0,0,0|2,0,0]=4 522 B9R1.1 O=CC1=CC=C(O)C=C1 AK-77323 [1,1,0,0,0,0|2,0,0]=4 523 B9R1.1 O=CC1=CN=C(C)N=C1 AK-36829 [1,1,0,0,0,0|2,0,0]=4 524 B9R1.1 O=CC1=CN=C(N)C=C1 AK114395 [1,1,0,0,0,0|1,0,0]=3 525 B9R1.1 O=CC1=CN=C(N)C=C1 AK125046 [1,1,0,0,0,0|1,0,0]=3 526 B9R1.1 O=CC1=CN=C(N)N=C1 AK118712 [1,1,0,0,0,0|2,0,0]=4 527 B9R1.1 O=CC1=CN=C(O)N=C1 AK199230 [1,1,0,0,0,0|2,0,0]=4 528 B9R1.1 O=CC1=NC=C(Br)C=C1 AK-27944 [1,1,0,0,0,0|1,0,0]=3 529 B9R1.1 O=CC1=NC=C(C)N=C1 AK-40389 [1,1,0,0,0,0|0,0,0]=2 530 B9R1.1 O=CC1=NC=C(F)C=C1 AK-34624 [1,1,0,0,0,0|1,0,0]=3 531 B9R1.1 O=CC1=NC=C(O)C=C1 AK-34625 [1,1,0,0,0,0|1,0,0]=3 532 B9R1.1 O=CC=1C=CC(NC1)=O AK-28718 [1,1,0,0,0,0|1,0,1]=4 533 B9R1.1 OC1=CN=C(C=C1)OC AK-26060 [1,1,0,0,0,0|2,0,0]=4 534 B9R1.1 OCC1=NC=C(Cl)N=C1 AK-43110 [1,1,0,0,0,0|0,0,2]=4 535 B9R1.2 BrC1=CC(=CN=C1)CC AK-54800 [1,1,0,0,0,0|1,0,1]=4 536 B9R1.2 BrC1=NC(=CN=C1)C#N AK-24988 [1,1,0,0,0,0|1,0,1]=4 537 B9R1.2 C1=C(C=CN=C1OC)N AK-28456 [1,1,0,0,0,0|2,0,0]=4 538 B9R1.2 C1=CC=C(Br)N=C1C=O AK-25797 [1,1,0,0,0,0|1,0,0]=3 539 B9R1.2 C1=CC=C(N=C1OC)Br AK-25939 [1,1,0,0,0,0|2,0,0]=4 540 B9R1.2 C1=CC=C(N=C1OC)C AK-44038 [1,1,0,0,0,0|2,0,0]=4 541 B9R1.2 C1=CC=C(N=C1OC)Cl AK-25492 [1,1,0,0,0,0|2,0,0]=4 542 B9R1.2 C1=NC=C(C#N)N=C1Cl AK-24986 [1,1,0,0,0,0|1,0,1]=4 543 B9R1.2 CC1=CC(=CN=C1)C=O AK-28384 [1,1,0,0,0,0|1,0,0]=3 544 B9R1.2 CC1=CC(=NC=C1)C=O AK-24250 [1,1,0,0,0,0|1,0,0]=3 545 B9R1.2 CC1=CC(OC)=NC=C1 AK-39493 [1,1,0,0,0,0|2,0,0]=4 546 B9R1.2 CC1=NC=CC(=N1)C=O AK-23647 [1,1,0,0,0,0|2,0,0]=4 547 B9R1.2 CCC1=CC=CC(Br)=N1 AK-65167 [1,1,0,0,0,0|1,0,1]=4 548 B9R1.2 CCC1=NC=CC(Br)=C1 AK129552 [1,1,0,0,0,0|1,0,1]=4 549 B9R1.2 CNC1=NC(Cl)=CC=C1 AK-48574 [1,1,0,0,0,0|2,0,0]=4 550 B9R1.2 CNC1=NC=CC(Br)=C1 AK141589 [1,1,0,0,0,0|2,0,0]=4 551 B9R1.2 COC1=CC=CC(F)=N1 AK130132 [1,1,0,0,0,0|2,0,0]=4 552 B9R1.2 COC1=CN=CC(=C1)O AK-28499 [1,1,0,0,0,0|2,0,0]=4 553 B9R1.2 COC1=CN=CC(Br)=C1 AK-26045 [1,1,0,0,0,0|2,0,0]=4 554 B9R1.2 COC1=CN=CC(I)=N1 AK-94548 [1,1,0,0,0,0|1,0,0]=3 555 B9R1.2 COC1=NC=CC(Br)=C1 AK-47404 [1,1,0,0,0,0|2,0,0]=4 556 B9R1.2 COC1=NC=CC(F)=C1 AK-77188 [1,1,0,0,0,0|2,0,0]=4 557 B9R1.2 COC1=NC=CC(I)=C1 AK-37008 [1,1,0,0,0,0|2,0,0]=4 558 B9R1.2 CSC1=CC=CC(Br)=N1 AK159822 [1,1,0,0,0,0|2,0,0]=4 559 B9R1.2 ClC1=CC(=NC=C1)OC AK-26290 [1,1,0,0,0,0|2,0,0]=4 560 B9R1.2 ClC1=CC(=NC=C1)SC AK-25786 [1,1,0,0,0,0|2,0,0]=4 561 B9R1.2 ClC1=CC(C=C)=NC=C1 AK100297 [1,1,0,0,0,0|1,0,1]=4 562 B9R1.2 ClC1=CN=CC(=N1)NC AK-41779 [1,1,0,0,0,0|1,0,0]=3 563 B9R1.2 ClC1=NC(=CN=C1)OC AK-29172 [1,1,0,0,0,0|1,0,0]=3 564 B9R1.2 ClC1=NC(C=O)=CN=C1 AK-64725 [1,1,0,0,0,0|0,0,0]=2 565 B9R1.2 FC1=CC(=CN=C1)C=O AK-30355 [1,1,0,0,0,0|1,0,0]=3 566 B9R1.2 FC1=CC(C=O)=NC=C1 AK-32767 [1,1,0,0,0,0|1,0,0]=3 567 B9R1.2 FC1=NC(=CC=C1)C=O AK-25580 [1,1,0,0,0,0|1,0,0]=3 568 B9R1.2 NC1=CC(=CN=C1)OC AK-27775 [1,1,0,0,0,0|2,0,0]=4 569 B9R1.2 NC1=CC(NC)=NC=C1 AK118733 [1,1,0,0,0,0|2,0,0]=4 570 B9R1.2 NC1=NC(=CC=C1)OC AK-27734 [1,1,0,0,0,0|2,0,0]=4 571 B9R1.2 NC1=NC(=CN=C1)C#N AK-24987 [1,1,0,0,0,0|1,0,1]=4 572 B9R1.2 NC1=NC(=CN=C1)OC AK-24224 [1,1,0,0,0,0|1,0,0]=3 573 B9R1.2 NC1=NC(CC)=CC=C1 AK-28992 [1,1,0,0,0,0|1,0,1]=4 574 B9R1.2 NCC1=NC(Cl)=CN=C1 AK130178 [1,1,0,0,0,0|1,0,1]=4 575 B9R1.2 O=CC1=CC=CC(Br)=C1 AK-77027 [1,1,0,0,0,0|2,0,0]=4 576 B9R1.2 O=CC1=CC=CC(Cl)=C1 AK-68812 [1,1,0,0,0,0|2,0,0]=4 577 B9R1.2 O=CC1=CC=CC(F)=C1 AK112743 [1,1,0,0,0,0|2,0,0]=4 578 B9R1.2 O=CC1=CC=CC(I)=C1 AK-50045 [1,1,0,0,0,0|2,0,0]=4 579 B9R1.2 O=CC1=CC=CC(N)=C1 AK121859 [1,1,0,0,0,0|2,0,0]=4 580 B9R1.2 O=CC1=CC=CC(O)=C1 AK-77369 [1,1,0,0,0,0|2,0,0]=4 581 B9R1.2 O=CC1=CN=CC(Br)=C1 AK-25300 [1,1,0,0,0,0|1,0,0]=3 582 B9R1.2 O=CC1=CN=CC(O)=C1 AK139755 [1,1,0,0,0,0|1,0,0]=3 583 B9R1.2 O=CC1=NC(C)=CC=C1 AK-45099 [1,1,0,0,0,0|1,0,0]=3 584 B9R1.2 O=CC1=NC(Cl)=CC=C1 AK-29361 [1,1,0,0,0,0|1,0,0]=3 585 B9R1.2 O=CC1=NC=CC(Br)=C1 AK-29828 [1,1,0,0,0,0|1,0,0]=3 586 B9R1.2 OC1=CC(OC)=NC=C1 AK-68345 [1,1,0,0,0,0|2,0,0]=4 587 B9R1.2 OCC1=CN=CC(Br)=N1 AK-68017 [1,1,0,0,0,0|0,0,2]=4 588 B9R1.2 OCC1=NC(Cl)=CN=C1 AK-98157 [1,1,0,0,0,0|0,0,2]=4 589 B9R1.8 C1=C(CCN)N=CC=C1 AK-73075 [1,1,0,0,0,0|1,0,1]=4 590 B9R1.8 C1=C(N=CC=C1)COC AK-32294 [1,1,0,0,0,0|1,0,1]=4 591 B9R1.8 CCCC1=NC=CN=C1 AK305719 [1,1,0,0,0,0|0,0,1]=3 592 B9R1.8 CCNC1=CC=CN=C1 AK126739 [1,1,0,0,0,0|1,0,1]=4 593 B9R1.8 CCNC1=NC=CN=C1 AK159718 [1,1,0,0,0,0|0,0,1]=3 594 B9R1.8 CCOC1=NC=CC=C1 AK-88755 [1,1,0,0,0,0|1,0,1]=4 595 B9R1.8 CNCC1=CC=CN=C1 AK-77094 [1,1,0,0,0,0|1,0,1]=4 596 B9R1.8 CNCC1=NC=CC=C1 AK-82805 [1,1,0,0,0,0|1,0,1]=4 597 B9R1.8 CNCC1=NC=CN=C1 AK-32984 [1,1,0,0,0,0|0,0,1]=3 598 B9R1.8 NCCC1=CC=CN=C1 AK-45879 [1,1,0,0,0,0|1,0,1]=4 599 B9R1.8 OCCC1=NC=CN=C1 AK-45393 [1,1,0,0,0,0|0,0,1]=3 600 B9R1.15 BrC1=C(C=NC=C1)OC AK-46696 [1,1,0,0,0,0|2,0,0]=4 601 B9R1.15 BrC1=CC=CN=C1OC AK-33153 [1,1,0,0,0,0|2,0,0]=4 602 B9R1.15 BrC1=NC=CC=C1C=O AK-33078 [1,1,0,0,0,0|1,0,0]=3 603 B9R1.15 C1=C(I)C(=NC=C1)OC AK-25295 [1,1,0,0,0,0|2,0,0]=4 604 B9R1.15 C1=CC=NC(=C1C=O)Cl AK-25854 [1,1,0,0,0,0|1,0,0]=3 605 B9R1.15 C1=CC=NC(=C1C=O)F AK-29226 [1,1,0,0,0,0|1,0,0]=3 606 B9R1.15 C1=CN=C(C(=N1)C#N)Cl AK-21979 [1,1,0,0,0,0|1,0,1]=4 607 B9R1.15 C1=NC(=C(N=C1)Cl)NN AK-24564 [1,1,0,0,0,0|2,0,0]=4 608 B9R1.15 CC1=CC=CN=C1OC AK126197 [1,1,0,0,0,0|2,0,0]=4 609 B9R1.15 CC1=NC=CN=C1CC AK114356 [1,1,0,0,0,0|0,0,1]=3 610 B9R1.15 CCC1=C(Br)C=CN=C1 AK328293 [1,1,0,0,0,0|1,0,1]=4 611 B9R1.15 CCC1=C(Cl)N=CC=N1 AK-54851 [1,1,0,0,0,0|0,0,1]=3 612 B9R1.15 CCC1=NC=CC=C1Br AK128590 [1,1,0,0,0,0|1,0,1]=4 613 B9R1.15 CNC1=CC=CN=C1Cl AK115045 [1,1,0,0,0,0|2,0,0]=4 614 B9R1.15 CNC1=NC=CC=C1Cl AK140218 [1,1,0,0,0,0|2,0,0]=4 615 B9R1.15 CNC1=NC=CN=C1N AK-23939 [1,1,0,0,0,0|1,0,0]=3 616 B9R1.15 COC1=C(Br)N=CC=N1 AK-37282 [1,1,0,0,0,0|1,0,0]=3 617 B9R1.15 COC1=C(C)N=CC=N1 AK-29085 [1,1,0,0,0,0|1,0,0]=3 618 B9R1.15 COC1=CC=CN=C1Br AK-29048 [1,1,0,0,0,0|2,0,0]=4 619 B9R1.15 COC1=CC=CN=C1F AK-63160 [1,1,0,0,0,0|2,0,0]=4 620 B9R1.15 COC1=NC=CC=C1Cl AK-33154 [1,1,0,0,0,0|2,0,0]=4 621 B9R1.15 COC1=NC=CC=C1F AK-33314 [1,1,0,0,0,0|2,0,0]=4 622 B9R1.15 COC1=NC=CN=C1I AK-94547 [1,1,0,0,0,0|1,0,0]=3 623 B9R1.15 CSC1=NC=CN=C1C AK-53396 [1,1,0,0,0,0|1,0,0]=3 624 B9R1.15 ClC1=NC=CN=C1CCl AK-37298 [1,1,0,0,0,0|1,0,1]=4 625 B9R1.15 ClC1=NC=CN=C1OC AK-25926 [1,1,0,0,0,0|1,0,0]=3 626 B9R1.15 FC1=CC=CN=C1C=O AK-25751 [1,1,0,0,0,0|1,0,0]=3 627 B9R1.15 N#CC1=NC=CN=C1N AK-27803 [1,1,0,0,0,0|1,0,1]=4 628 B9R1.15 NC1=C(C=O)C=CC=C1 AK-45623 [1,1,0,0,0,0|2,0,0]=4 629 B9R1.15 NC1=C(OC)C=NC=C1 AK-46304 [1,1,0,0,0,0|2,0,0]=4 630 B9R1.15 NC1=CC=CN=C1OC AK-28363 [1,1,0,0,0,0|2,0,0]=4 631 B9R1.15 NC1=NC=CC=C1OC AK-25256 [1,1,0,0,0,0|2,0,0]=4 632 B9R1.15 NC1=NC=CN=C1C#C AK-24395 [1,1,0,0,0,0|0,0,2]=4 633 B9R1.15 NC1=NC=CN=C1C=O AK-30729 [1,1,0,0,0,0|0,0,0]=2 634 B9R1.15 NC1=NC=CN=C1CC AK-30572 [1,1,0,0,0,0|0,0,1]=3 635 B9R1.15 NC1=NC=CN=C1OC AK-23933 [1,1,0,0,0,0|1,0,0]=3 636 B9R1.15 NCC1=NC=CN=C1Cl AK-42166 [1,1,0,0,0,0|1,0,1]=4 637 B9R1.15 NCC1=NC=CN=C1Cl AK-64298 [1,1,0,0,0,0|1,0,1]=4 638 B9R1.15 O=C1C(CC)=NC=CN1 AK198883 [1,1,0,0,0,0|0,0,2]=4 639 B9R1.15 O=CC1=C(C)N=CC=C1 AK-35801 [1,1,0,0,0,0|1,0,0]=3 640 B9R1.15 O=CC1=CC=CC=C1Br AK-50022 [1,1,0,0,0,0|2,0,0]=4 641 B9R1.15 O=CC1=CC=CC=C1F AK-88670 [1,1,0,0,0,0|2,0,0]=4 642 B9R1.15 O=CC1=CC=CC=C1I AK-94125 [1,1,0,0,0,0|2,0,0]=4 643 B9R1.15 O=CC1=CC=CC=C1N AK550048 [1,1,0,0,0,0|2,0,0]=4 644 B9R1.15 O=CC1=CC=CN=C1N AK-24791 [1,1,0,0,0,0|1,0,0]=3 645 B9R1.15 O=CC1=CC=CNC1=O AK-23653 [1,1,0,0,0,0|1,0,1]=4 646 B9R1.15 O=CC1=CN=CC=C1N AK-35124 [1,1,0,0,0,0|1,0,0]=3 647 B9R1.15 O=CC1=NC=CC=C1C AK-26127 [1,1,0,0,0,0|1,0,0]=3 648 B9R1.15 O=CC1=NC=CC=C1Cl AK-28957 [1,1,0,0,0,0|1,0,0]=3 649 B9R1.15 OC1=C(C=O)N=CC=C1 AK-47968 [1,1,0,0,0,0|1,0,0]=3 650 B9R1.15 OC1=CC=CN=C1OC AK261041 [1,1,0,0,0,0|2,0,0]=4 651 B9R1.15 OCC1=C(Cl)N=CC=N1 AK-39229 [1,1,0,0,0,0|0,0,2]=4 652 B9R1.11 BrCC(=O)C1=CC=CS1 AK-53454 [0,1,0,0,1,0|1,0,0]=3 653 B9R1.11 BrCC(C1=NC=CS1)=O AK-45640 [0,1,0,0,1,0|1,0,0]=3 654 B9R1.11 C1=C(C(=O)OC)SC=N1 AK-29865 [0,1,0,0,1,0|1,0,0]=3 655 B9R1.11 CCC(C1=NC=CS1)=O AK113134 [0,1,0,0,1,0|1,0,0]=3 656 B9R1.11 COC(=O)C1=CNC=C1 AK-39320 [0,1,0,0,1,0|0,0,1]=3 657 B9R1.11 COC(=O)C1=COC=N1 AK100835 [0,1,0,0,1,0|1,0,0]=3 658 B9R1.11 COC(=O)C1=NC=CO1 AK109950 [0,1,0,0,1,0|1,0,0]=3 659 B9R1.11 O=C(C1=CC=CN1)OC AK-27729 [0,1,0,0,1,0|0,0,1]=3 660 B9R1.11 O=C(C1=CC=CS1)OC AK-48323 [0,1,0,0,1,0|1,0,0]=3 661 B9R1.11 O=C(C1=CN=CN1)OC AK-25496 [0,1,0,0,1,0|0,0,1]=3 662 B9R1.11 O=C(C1=CN=CN1)OC AK-40808 [0,1,0,0,1,0|0,0,1]=3 663 B9R1.11 O=C(C1=CNN=C1)OC AK-65272 [0,1,0,0,1,0|1,0,0]=3 664 B9R1.11 O=C(C1=CSC=C1)OC AK-48045 [0,1,0,0,1,0|1,0,0]=3 665 B9R1.11 O=C(C1=CSC=N1)OC AK-21853 [0,1,0,0,1,0|1,0,0]=3 666 B9R1.11 O=C(C1=NC=CN1)OC AK-59662 [0,1,0,0,1,0|0,0,1]=3 667 B9R1.11 O=C(C1=NC=CS1)OC AK-50497 [0,1,0,0,1,0|1,0,0]=3 668 B9R1.11 O=C(C1=NNC=C1)OC AK-31981 [0,1,0,0,1,0|1,0,0]=3 669 B9R1.11 O=C(C1=NNC=N1)OC AK-30559 [0,1,0,0,1,0|1,0,0]=3 670 B9R1.35 BrC1=CC(=CS1)C(=O)O AK-28622 [0,1,0,0,1,0|2,0,0]=4 671 B9R1.35 BrC1=CC(=CS1)C(C)=O AK-35777 [0,1,0,0,1,0|1,0,0]=3 672 B9R1.35 C1=C(C(=O)O)SC(=N1)N AK-24488 [0,1,0,0,1,0|2,0,0]=4 673 B9R1.35 C1=C(C)ON=C1C(N)=O AK-26695 [0,1,0,0,1,0|2,0,0]=4 674 B9R1.35 C1=C(C)[NH]N=C1C(O)=O AK-27812 [0,1,0,0,1,0|2,0,0]=4 675 B9R1.35 C1=C(N=C(S1)N)C(=O)C AK-54799 [0,1,0,0,1,0|1,0,0]=3 676 B9R1.35 C1=C(OC(=C1)Br)C(O)=O AK-35759 [0,1,0,0,1,0|2,0,0]=4 677 B9R1.35 C1=C(OC(=C1)C)C(O)=O AK-44799 [0,1,0,0,1,0|2,0,0]=4 678 B9R1.35 C1=C(ON=C1Br)C(=O)O AK-21783 [0,1,0,0,1,0|2,0,0]=4 679 B9R1.35 C1=C(SC(=C1)C(O)=O)Cl AK-29045 [0,1,0,0,1,0|2,0,0]=4 680 B9R1.35 C1=C(SC(=C1)C)C(=O)C AK-33183 [0,1,0,0,1,0|1,0,0]=3 681 B9R1.35 C1=C(SC(=C1)Cl)C(C)=O AK-47623 [0,1,0,0,1,0|1,0,0]=3 682 B9R1.35 C1=C(SC(=N1)C)C(=O)O AK-35030 [0,1,0,0,1,0|2,0,0]=4 683 B9R1.35 CC(=O)C1=CC=C(C)O1 AK-77189 [0,1,0,0,1,0|1,0,0]=3 684 B9R1.35 CC(=O)C1=NC(C)=CO1 AK-80747 [0,1,0,0,1,0|1,0,0]=3 685 B9R1.35 CC(=O)C1=NOC(C)=C1 AK-47045 [0,1,0,0,1,0|1,0,0]=3 686 B9R1.35 CC(C1=CC(Cl)=CS1)=O AK-77338 [0,1,0,0,1,0|1,0,0]=3 687 B9R1.35 CC1=CC=C(N1)C(O)=O AK100045 [0,1,0,0,1,0|1,0,1]=4 688 B9R1.35 CC1=CN=C(S1)C(=O)O AK-26650 [0,1,0,0,1,0|2,0,0]=4 689 B9R1.35 CN1C=C(C=N1)C(C)=O AK-34919 [0,1,0,0,1,0|1,0,0]=3 690 B9R1.35 CN1C=CC(=C1)C(O)=O AK-28665 [0,1,0,0,1,0|1,0,1]=4 691 B9R1.35 CN1C=CC(=N1)C(N)=O AK102817 [0,1,0,0,1,0|2,0,0]=4 692 B9R1.35 C[N]1C=C(N=C1)C(=O)N AK-47806 [0,1,0,0,1,0|1,0,1]=4 693 B9R1.35 ClC1=CC(=CS1)C(=O)O AK-29222 [0,1,0,0,1,0|2,0,0]=4 694 B9R1.35 O=C(C1=CC(Br)=CN1)N AK106602 [0,1,0,0,1,0|1,0,1]=4 695 B9R1.35 O=C(C1=CC(Br)=CO1)N AK120768 [0,1,0,0,1,0|2,0,0]=4 696 B9R1.35 O=C(C1=CC(Br)=CS1)N AK-90412 [0,1,0,0,1,0|2,0,0]=4 697 B9R1.35 O=C(C1=CC(Br)=CS1)O AK-24697 [0,1,0,0,1,0|2,0,0]=4 698 B9R1.35 O=C(C1=CC(C)=NO1)O AK-29291 [0,1,0,0,1,0|2,0,0]=4 699 B9R1.35 O=C(C1=CC(O)=NO1)N AK143689 [0,1,0,0,1,0|2,0,0]=4 700 B9R1.35 O=C(C1=CC(O)=NO1)O AK-58553 [0,1,0,0,1,0|2,0,0]=4 701 B9R1.35 O=C(C1=CC=C(Br)S1)O AK-26297 [0,1,0,0,1,0|2,0,0]=4 702 B9R1.35 O=C(C1=CC=C(C)S1)O AK-25546 [0,1,0,0,1,0|2,0,0]=4 703 B9R1.35 O=C(C1=CC=C(Cl)O1)O AK-94156 [0,1,0,0,1,0|2,0,0]=4 704 B9R1.35 O=C(C1=CC=C(F)S1)O AK-35162 [0,1,0,0,1,0|2,0,0]=4 705 B9R1.35 O=C(C1=CC=C(I)S1)O AK113691 [0,1,0,0,1,0|2,0,0]=4 706 B9R1.35 O=C(C1=CN(C)C=N1)O AK-30010 [0,1,0,0,1,0|1,0,1]=4 707 B9R1.35 O=C(C1=CN(C)N=C1)O AK-39751 [0,1,0,0,1,0|2,0,0]=4 708 B9R1.35 O=C(C1=CN=C(Br)S1)N AK-48537 [0,1,0,0,1,0|2,0,0]=4 709 B9R1.35 O=C(C1=CN=C(Br)S1)O AK-26941 [0,1,0,0,1,0|2,0,0]=4 710 B9R1.35 O=C(C1=CN=C(C)O1)O AK-43778 [0,1,0,0,1,0|2,0,0]=4 711 B9R1.35 O=C(C1=CNC(C)=C1)O AK-78330 [0,1,0,0,1,0|1,0,1]=4 712 B9R1.35 O=C(C1=CNC(C)=N1)O AK-78654 [0,1,0,0,1,0|1,0,1]=4 713 B9R1.35 O=C(C1=COC(Br)=N1)O AK-76031 [0,1,0,0,1,0|2,0,0]=4 714 B9R1.35 O=C(C1=COC(I)=N1)O AK-41227 [0,1,0,0,1,0|2,0,0]=4 715 B9R1.35 O=C(C1=CSC(Br)=C1)N AK138264 [0,1,0,0,1,0|2,0,0]=4 716 B9R1.35 O=C(C1=CSC(Br)=N1)O AK-23610 [0,1,0,0,1,0|2,0,0]=4 717 B9R1.35 O=C(C1=CSC(Cl)=N1)O AK-48303 [0,1,0,0,1,0|2,0,0]=4 718 B9R1.35 O=C(C1=CSC(N)=N1)N AK109042 [0,1,0,0,1,0|2,0,0]=4 719 B9R1.35 O=C(C1=NC(Br)=CS1)O AK-40795 [0,1,0,0,1,0|2,0,0]=4 720 B9R1.35 O=C(C1=NC(C)=CN1)O AK-29453 [0,1,0,0,1,0|1,0,1]=4 721 B9R1.35 O=C(C1=NC=C(Br)S1)O AK122038 [0,1,0,0,1,0|2,0,0]=4 722 B9R1.35 O=C(C1=NN(C)C=C1)O AK-79303 [0,1,0,0,1,0|2,0,0]=4 723 B9R1.35 O=C(C1=NNC(Br)=C1)O AK128451 [0,1,0,0,1,0|2,0,0]=4 724 B9R1.35 O=C(C1=NNC(Cl)=C1)O AK112708 [0,1,0,0,1,0|2,0,0]=4 725 B9R1.35 O=C(C1=NOC(C)=C1)O AK-25795 [0,1,0,0,1,0|2,0,0]=4 726 B9R1.35 O=C(Cl)C1=CC=C(Cl)S1 AK-48243 [0,1,0,0,1,0|2,0,0]=4 727 B9R1.35 O=C(O)C1=CC(Br)=CO1 AK-41331 [0,1,0,0,1,0|2,0,0]=4 728 B9R1.35 O=C1NN(C(C)=O)C=C1 AK676222 [0,1,0,0,1,0|1,0,1]=4 729 B9R1.35 OC(=O)C1=CC(Br)=CN1 AK-27737 [0,1,0,0,1,0|1,0,1]=4 730 B9R1.35 OC(=O)C1=CC(Cl)=CS1 AK-89071 [0,1,0,0,1,0|2,0,0]=4 731 B9R1.35 OC(=O)C1=CC(F)=CS1 AK-29152 [0,1,0,0,1,0|2,0,0]=4 732 B9R1.35 OC(=O)C1=CC=C(Br)N1 AK100216 [0,1,0,0,1,0|1,0,1]=4 733 B9R1.35 OC(=O)C1=COC(Cl)=N1 AK-72648 [0,1,0,0,1,0|2,0,0]=4 734 B9R1.35 OC(=O)C1=NNC(O)=C1 AK-96196 [0,1,0,0,1,0|2,0,0]=4 735 B9R1.41 BrC1=C[NH]N=C1C(=O)N AK-39986 [0,1,0,0,1,0|2,0,0]=4 736 B9R1.41 C1=CC(=C(S1)N)C(=O)N AK-50549 [0,1,0,0,1,0|2,0,0]=4 737 B9R1.41 C1=NC(=C(C(O)=O)O1)C AK-25663 [0,1,0,0,1,0|2,0,0]=4 738 B9R1.41 C1=NC(=C([NH]1)C(=O)N)O AK-26137 [0,1,0,0,1,0|1,0,1]=4 739 B9R1.41 CC(=O)N1C=COC1=O AK-82187 [0,1,0,0,1,0|2,0,0]=4 740 B9R1.41 CC(C1=CC=CN1C)=O AK148515 [0,1,0,0,1,0|0,0,1]=3 741 B9R1.41 CC(C1=CN=CN1C)=O AK140652 [0,1,0,0,1,0|0,0,1]=3 742 B9R1.41 CC1=C(C=CN1)C(O)=O AK-77215 [0,1,0,0,1,0|1,0,1]=4 743 B9R1.41 CC1=C(OC=C1)C(O)=O AK-89342 [0,1,0,0,1,0|2,0,0]=4 744 B9R1.41 CC1=NOC=C1C(=O)O AK-33667 [0,1,0,0,1,0|2,0,0]=4 745 B9R1.41 CN1C=CN=C1C(C)=O AK-54843 [0,1,0,0,1,0|0,0,1]=3 746 B9R1.41 CN1N=CC=C1C(C)=O AK-40773 [0,1,0,0,1,0|1,0,0]=3 747 B9R1.41 ClC1=C(C=CS1)C(=O)O AK-29355 [0,1,0,0,1,0|2,0,0]=4 748 B9R1.41 FC1=C(SC=C1)C(=O)O AK-29153 [0,1,0,0,1,0|2,0,0]=4 749 B9R1.41 O=C(C1=C(Br)C=CS1)O AK-29480 [0,1,0,0,1,0|2,0,0]=4 750 B9R1.41 O=C(C1=C(Br)C=NN1)O AK-59621 [0,1,0,0,1,0|2,0,0]=4 751 B9R1.41 O=C(C1=C(Br)SC=C1)O AK-34310 [0,1,0,0,1,0|2,0,0]=4 752 B9R1.41 O=C(C1=C(Br)SC=N1)O AK-22047 [0,1,0,0,1,0|2,0,0]=4 753 B9R1.41 O=C(C1=C(C)C=CN1)O AK-36827 [0,1,0,0,1,0|1,0,1]=4 754 B9R1.41 O=C(C1=C(C)C=CS1)O AK-25644 [0,1,0,0,1,0|2,0,0]=4 755 B9R1.41 O=C(C1=C(C)C=NO1)O AK-25674 [0,1,0,0,1,0|2,0,0]=4 756 B9R1.41 O=C(C1=C(C)N=CS1)O AK-29930 [0,1,0,0,1,0|2,0,0]=4 757 B9R1.41 O=C(C1=C(C)OC=N1)O AK-24069 [0,1,0,0,1,0|2,0,0]=4 758 B9R1.41 O=C(C1=C(C)ON=C1)O AK-32464 [0,1,0,0,1,0|2,0,0]=4 759 B9R1.41 O=C(C1=C(C)SC=C1)O AK-33900 [0,1,0,0,1,0|2,0,0]=4 760 B9R1.41 O=C(C1=C(C)SC=N1)O AK-25323 [0,1,0,0,1,0|2,0,0]=4 761 B9R1.41 O=C(C1=C(Cl)C=NN1)O AK-75702 [0,1,0,0,1,0|2,0,0]=4 762 B9R1.41 O=C(C1=C(Cl)C=NS1)O AK314030 [0,1,0,0,1,0|2,0,0]=4 763 B9R1.41 O=C(C1=C(I)C=CS1)O AK167455 [0,1,0,0,1,0|2,0,0]=4 764 B9R1.41 O=C(C1=C(I)C=NN1)O AK-92905 [0,1,0,0,1,0|2,0,0]=4 765 B9R1.41 O=C(C1=C(N)NC=N1)N AK-34082 [0,1,0,0,1,0|1,0,1]=4 766 B9R1.41 O=C(C1=C(N)NC=N1)N AK-48933 [0,1,0,0,1,0|1,0,1]=4 767 B9R1.41 O=C(C1=C(N)SC=N1)N AK-88620 [0,1,0,0,1,0|2,0,0]=4 768 B9R1.41 O=C(C1=CC=CN1N)N AK-45334 [0,1,0,0,1,0|1,0,1]=4 769 B9R1.41 O=C(C1=CC=NN1C)O AK-33521 [0,1,0,0,1,0|2,0,0]=4 770 B9R1.41 O=C(C1=CN=CN1C)O AK-35106 [0,1,0,0,1,0|1,0,1]=4 771 B9R1.41 O=C(C1=CNN=C1C)O AK-39586 [0,1,0,0,1,0|2,0,0]=4 772 B9R1.41 O=C(C1=CNN=C1N)N AK-48317 [0,1,0,0,1,0|2,0,0]=4 773 B9R1.41 O=C(C1=CNN=C1N)O AK-46321 [0,1,0,0,1,0|2,0,0]=4 774 B9R1.41 O=C(C1=CSC=C1C)O AK-64461 [0,1,0,0,1,0|2,0,0]=4 775 B9R1.41 O=C(C1=NC=CN1C)O AK-28560 [0,1,0,0,1,0|1,0,1]=4 776 B9R1.41 O=C(C1=NC=NN1C)O AK179208 [0,1,0,0,1,0|2,0,0]=4 777 B9R1.41 O=C(C1=NNC=C1Br)O AK-46340 [0,1,0,0,1,0|2,0,0]=4 778 B9R1.41 O=C(C1=NOC=C1C)O AK101261 [0,1,0,0,1,0|2,0,0]=4 779 B9R1.41 O=C(C1=NON=C1N)O AK-46296 [0,1,0,0,1,0|2,0,0]=4 780 B9R1.41 OC(=O)C1=C(Br)C=CO1 AK110945 [0,1,0,0,1,0|2,0,0]=4 781 B9R1.41 OC(=O)C1=C(Cl)C=CS1 AK-48375 [0,1,0,0,1,0|2,0,0]=4 782 B9R1.41 OC(=O)C1=C(Cl)NN=C1 AK-99982 [0,1,0,0,1,0|2,0,0]=4 783 B11R1.20 BrC1=CN=C(C=C1)CC(=O)O AK-46600 [0,1,0,0,0,1|2,0,0]=4 784 B11R1.20 C1=CC(=CC=C1CC(C)=O)F AK-50578 [0,1,0,0,0,1|2,0,0]=4 785 B11R1.20 CC(NC1=CC=C(C)C=C1)=O AK208638 [0,1,0,0,0,1|2,0,0]=4 786 B11R1.20 CC(NC1=CC=C(I)C=C1)=O AK115722 [0,1,0,0,0,1|2,0,0]=4 787 B11R1.20 CC(NC1=CC=C(O)N=C1)=O AK152813 [0,1,0,0,0,1|1,0,0]=3 788 B11R1.20 CC(NC1=NC=C(Br)C=C1)=O AK-32386 [0,1,0,0,0,1|1,0,0]=3 789 B11R1.20 CC(NC1=NC=C(O)C=C1)=O AK114074 [0,1,0,0,0,1|1,0,0]=3 790 B11R1.20 O=C(N)CC1=NC=C(Br)C=C1 AK141365 [0,1,0,0,0,1|2,0,0]=4 791 B11R1.20 O=C(O)CC1=CC=C(Cl)N=C1 AK-48828 [0,1,0,0,0,1|2,0,0]=4 792 B11R1.20 O=C(O)CC1=CC=C(N)N=C1 AK112112 [0,1,0,0,0,1|2,0,0]=4 793 B11R1.20 O=C(O)CC1=NC=C(C)C=C1 AK139129 [0,1,0,0,0,1|2,0,0]=4 794 B11R1.36 CC(C(C1=CC=CC=C1)=O)=O AK116651 [0,1,0,0,0,1|2,0,0]=4 795 B11R1.40 O=C(NC)CC1=CC=CN=C1 AK175433 [0,1,0,0,0,1|1,0,0]=3 796 B11R1.40 O=C(NC1=CC=CC=C1)CCl AK-95957 [0,1,0,0,0,1|2,0,0]=4 797 B11R1.40 O=C(NC1=NC=CC=C1)CCl AK-32350 [0,1,0,0,0,1|1,0,0]=3 798 B11R1.40 O=C(OC)CC1=CC=CC=C1 AK163377 [0,1,0,0,0,1|2,0,0]=4 799 B11R1.40 O=C(OC)CC1=NC=CN=C1 AK-45166 [0,1,0,0,0,1|0,0,0]=2 800 B11R1.40 O=C(OC)CC1=NC=NC=C1 AK-47129 [0,1,0,0,0,1|2,0,0]=4 801 B11R1.40 O=C(OC)OC1=CC=CC=C1 AK600729 [0,1,0,0,0,1|2,0,0]=4 802 B11R1.40 O=C(OC1=CC=CC=C1)CBr AK105971 [0,1,0,0,0,1|2,0,0]=4 803 B11R1.86 C1=C(CC(=O)C)C(=CC=C1)Br AK-47295 [0,1,0,0,0,1|2,0,0]=4 804 B11R1.86 CC(C)CC1=NC=CN=C1C AK-59003 [0,1,0,0,0,1|1,0,1]=4 805 B11R1.86 CC(CC1=CC=CC=C1F)=O AK117069 [0,1,0,0,0,1|2,0,0]=4 806 B11R1.86 CC(NC1=CC=CC=C1N)=O AK112083 [0,1,0,0,0,1|2,0,0]=4 807 B11R1.86 CC(NC1=CC=CC=C1O)=O AK116958 [0,1,0,0,0,1|2,0,0]=4 808 B11R1.86 CC(NC1=NC=CC=C1O)=O AK124571 [0,1,0,0,0,1|1,0,0]=3 809 B11R1.86 NC1=NC=CC=C1CC(O)=O AK-68736 [0,1,0,0,0,1|2,0,0]=4 810 B11R1.86 O=C(O)CC1=CC=CN=C1Cl AK139178 [0,1,0,0,0,1|2,0,0]=4 811 B11R1.86 O=C(O)CC1=NC=CC=C1Cl AK-88771 [0,1,0,0,0,1|2,0,0]=4 812 B11R1.157 CC(=O)CC1=CC(F)=CC=C1 AK-60937 [0,1,0,0,0,1|2,0,0]=4 813 B11R1.157 CC(=O)NC1=NC(=O)NC=C1 AK-96691 [0,1,0,0,0,1|2,0,0]=4 814 B11R1.157 CC(=O)NC1=NC(N)=CC=C1 AK103372 [0,1,0,0,0,1|1,0,0]=3 815 B11R1.157 CC(=O)NC1=NC=CC(N)=C1 AK-41020 [0,1,0,0,0,1|1,0,0]=3 816 B11R1.157 CC(CC1=CC=CC(Br)=C1)=O AK-94137 [0,1,0,0,0,1|2,0,0]=4 817 B11R1.157 CC(NC1=CC=CC(N)=C1)=O AK-76549 [0,1,0,0,0,1|2,0,0]=4 818 B11R1.157 CC(NC1=CC=CC(O)=C1)=O AK-84439 [0,1,0,0,0,1|2,0,0]=4 819 B11R1.157 CC(NC1=NC(Br)=CC=C1)=O AK-92376 [0,1,0,0,0,1|1,0,0]=3 820 B11R1.157 CC(NC1=NC=CC(Cl)=C1)=O AK-29058 [0,1,0,0,0,1|1,0,0]=3 821 B11R1.157 CC(OC1=CC=CC(Br)=C1)=O AK-80146 [0,1,0,0,0,1|2,0,0]=4 822 B11R1.157 CC(OC1=CC=CC(F)=C1)=O AK135677 [0,1,0,0,0,1|2,0,0]=4 823 B11R1.157 ClC1=CN=CC(=N1)CC(=O)O AK-26671 [0,1,0,0,0,1|1,0,0]=3 824 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 AK113021 [0,1,0,0,0,1|2,0,0]=4 825 B11R1.157 O=C(O)CC1=NC(Br)=CC=C1 AK117142 [0,1,0,0,0,1|2,0,0]=4 826 B11R1.157 O=C(O)CC1=NC(Cl)=CC=C1 AK117649 [0,1,0,0,0,1|2,0,0]=4 827 B11R1.157 O=C(O)CC1=NC=CC(C)=C1 AK-68184 [0,1,0,0,0,1|2,0,0]=4 828 B11R1.157 O=C(O)CC1=NC=CC(Cl)=C1 AK164883 [0,1,0,0,0,1|2,0,0]=4 829 B11R1.157 O=C([O-])CC1=NC(C)=CC=C1 AK-91618 [0,1,0,0,0,1|2,0,0]=4 830 B11R1.3 C1=CC(=NC=C1C(=O)O)NN AK-33131 [0,2,0,0,0,0|2,0,0]=4 831 B11R1.3 CC(=O)C1=NC=C(N=C1)C#N AK-55120 [0,2,0,0,0,0|0,0,0]=2 832 B11R1.3 CC(C1=CC=C(CBr)C=C1)=O AK-35404 [0,2,0,0,0,0|2,0,0]=4 833 B11R1.3 CC(C1=CC=C(CN)C=C1)=O AK158889 [0,2,0,0,0,0|2,0,0]=4 834 B11R1.3 CC(C1=CC=C(NC)C=C1)=O AK145581 [0,2,0,0,0,0|2,0,0]=4 835 B11R1.3 CC(C1=CC=C(OC)N=C1)=O AK-76404 [0,2,0,0,0,0|1,0,0]=3 836 B11R1.3 CC(C1=CC=C(SC)C=C1)=O AK164075 [0,2,0,0,0,0|2,0,0]=4 837 B11R1.3 CCC1=CN=C(C=C1)C(O)=O AK-29521 [0,2,0,0,0,0|2,0,0]=4 838 B11R1.3 COC1=CN=C(C=C1)C(=O)O AK-29097 [0,2,0,0,0,0|2,0,0]=4 839 B11R1.3 COC1=CN=C(C=N1)C(=O)O AK-25141 [0,2,0,0,0,0|1,0,0]=3 840 B11R1.3 N#CC1=CC=C(C(C)=O)C=C1 AK-44531 [0,2,0,0,0,0|2,0,0]=4 841 B11R1.3 O=C(C1=CN=C(OC)C=C1)O AK-30103 [0,2,0,0,0,0|2,0,0]=4 842 B11R1.3 O=C(C1=NC=C(C#N)N=C1)O AK137311 [0,2,0,0,0,0|1,0,0]=3 843 B11R1.3 O=C(O)C1=CN=C(CO)C=C1 AK123526 [0,2,0,0,0,0|2,0,0]=4 844 B11R1.3 O=C(O)C1=NC=C(CO)C=C1 AK127091 [0,2,0,0,0,0|2,0,0]=4 845 B11R1.21 BrC1=C(C=C(C=C1)C(C)=O)F AK-34604 [0,2,0,0,0,0|2,0,0]=4 846 B11R1.21 BrC1=CN=C(C=C1C)C(=O)O AK-37510 [0,2,0,0,0,0|2,0,0]=4 847 B11R1.21 C1=C(C(=CC=C1C(=O)C)F)C AK-48194 [0,2,0,0,0,0|2,0,0]=4 848 B11R1.21 C1=C(C(=CC=C1C(C)=O)F)Br AK-50601 [0,2,0,0,0,0|2,0,0]=4 849 B11R1.21 C1=C(C=CC(=C1F)O)C(C)=O AK-42173 [0,2,0,0,0,0|2,0,0]=4 850 B11R1.21 C1=CC(=CC(=C1F)Cl)C(=O)C AK-49084 [0,2,0,0,0,0|2,0,0]=4 851 B11R1.21 CC(C1=CC(C)=C(Cl)N=C1)=O AK139010 [0,2,0,0,0,0|1,0,0]=3 852 B11R1.21 CC(C1=CC=C(Br)C(C)=C1)=O AK-65018 [0,2,0,0,0,0|2,0,0]=4 853 B11R1.21 CC(C1=CC=C(Br)C(Cl)=C1)=O AK114290 [0,2,0,0,0,0|2,0,0]=4 854 B11R1.21 CC(C1=CC=C(Cl)C(C)=C1)=O AK-51511 [0,2,0,0,0,0|2,0,0]=4 855 B11R1.21 CC(C1=CC=C(Cl)C(Cl)=C1)=O AK-41915 [0,2,0,0,0,0|2,0,0]=4 856 B11R1.21 CC(C1=CC=C(Cl)C(N)=C1)=O AK-45178 [0,2,0,0,0,0|2,0,0]=4 857 B11R1.21 CC(C1=CC=C(F)C(F)=C1)=O AK-53703 [0,2,0,0,0,0|2,0,0]=4 858 B11R1.21 CC(C1=CC=C(I)C(Br)=C1)=O AK482929 [0,2,0,0,0,0|2,0,0]=4 859 B11R1.21 CC(C1=CC=C(N)C(F)=C1)=O AK-94340 [0,2,0,0,0,0|2,0,0]=4 860 B11R1.21 CC(C1=CC=C(O)C(Br)=C1)=O AK201265 [0,2,0,0,0,0|2,0,0]=4 861 B11R1.21 CC(C1=CC=C(O)C(C)=C1)=O AK-41189 [0,2,0,0,0,0|2,0,0]=4 862 B11R1.21 CC(C1=CC=C(O)C(O)=C1)=O AK-42350 [0,2,0,0,0,0|2,0,0]=4 863 B11R1.21 CC1=C(C)N=C(C=C1)C(O)=O AK-89986 [0,2,0,0,0,0|2,0,0]=4 864 B11R1.21 CC1=C(F)C=CC(=N1)C(O)=O AK-38458 [0,2,0,0,0,0|2,0,0]=4 865 B11R1.21 O=C(C1=CC(Br)=C(Br)N=C1)O AK-29099 [0,2,0,0,0,0|2,0,0]=4 866 B11R1.21 O=C(C1=CC(Cl)=C(Cl)N=C1)O AK-25953 [0,2,0,0,0,0|2,0,0]=4 867 B11R1.21 O=C(C1=NC(Cl)=C(C)C=C1)O AK-76573 [0,2,0,0,0,0|2,0,0]=4 868 B11R1.21 O=C(C1=NC(Cl)=C(Cl)N=C1)O AK133010 [0,2,0,0,0,0|1,0,0]=3 869 B11R1.21 O=C(O)C1=CN=C(Cl)C(Br)=C1 AK-23816 [0,2,0,0,0,0|2,0,0]=4 870 B11R1.21 O=C(O)C1=CN=C(Cl)C(F)=C1 AK173995 [0,2,0,0,0,0|2,0,0]=4 871 B11R1.21 O=C(O)C1=CN=C(Cl)C(I)=C1 AK324930 [0,2,0,0,0,0|2,0,0]=4 872 B11R1.21 O=C(O)C1=CN=C(F)C(Br)=C1 AK-49660 [0,2,0,0,0,0|2,0,0]=4 873 B11R1.21 O=C(O)C1=CN=C(N)C(Br)=C1 AK-25059 [0,2,0,0,0,0|2,0,0]=4 874 B11R1.21 O=C(O)C1=CN=C(N)C(N)=C1 AK126240 [0,2,0,0,0,0|2,0,0]=4 875 B11R1.21 O=C(O)C1=NC(Br)=C(C)C=C1 AK138206 [0,2,0,0,0,0|2,0,0]=4 876 B11R1.21 O=C(O)C1=NC(Br)=C(Cl)C=C1 AK-53664 [0,2,0,0,0,0|2,0,0]=4 877 B11R1.21 O=C(O)C1=NC(Br)=C(F)C=C1 AK-53910 [0,2,0,0,0,0|2,0,0]=4 878 B11R1.21 O=C(O)C1=NC(C)=C(Br)C=C1 AK-61563 [0,2,0,0,0,0|2,0,0]=4 879 B11R1.21 O=C(O)C1=NC(Cl)=C(Cl)C=C1 AK-53898 [0,2,0,0,0,0|2,0,0]=4 880 B11R1.21 O=C(O)C1=NC(Cl)=C(F)C=C1 AK-53913 [0,2,0,0,0,0|2,0,0]=4 881 B11R1.21 O=C(O)C1=NC(O)=C(Br)C=C1 AK-92903 [0,2,0,0,0,0|2,0,0]=4 882 B11R1.21 O=C(O)C1=NC=C(Br)C(Cl)=C1 AK-55136 [0,2,0,0,0,0|2,0,0]=4 883 B11R1.21 O=C(O)C1=NC=C(C)C(Br)=C1 AK137974 [0,2,0,0,0,0|2,0,0]=4 884 B11R1.21 OC(=O)C1=NC=C(Cl)C(Cl)=C1 AK-67884 [0,2,0,0,0,0|2,0,0]=4 885 B11R1.22 BrC1=CN=C(C=N1)C(=O)OC AK-24801 [0,2,0,0,0,0|0,0,0]=2 886 B11R1.22 C1=C(C=CC(=C1)Br)C(OC)=O AK-47340 [0,2,0,0,0,0|2,0,0]=4 887 B11R1.22 C1=C(C=CC(=C1)C)C(CBr)=O AK-73063 [0,2,0,0,0,0|2,0,0]=4 888 B11R1.22 C1=C(C=CC(=C1)Cl)C(CC)=O AK-47430 [0,2,0,0,0,0|2,0,0]=4 889 B11R1.22 C1=C(C=CC(=C1)N)C(OC)=O AK-48394 [0,2,0,0,0,0|2,0,0]=4 890 B11R1.22 C1=CC(=CN=C1C(OC)=O)Br AK-25721 [0,2,0,0,0,0|1,0,0]=3 891 B11R1.22 C1=CC(=NC=C1C(OC)=O)Cl AK-32450 [0,2,0,0,0,0|1,0,0]=3 892 B11R1.22 C1=NC(=CC=C1C(=O)OC)Br AK-27762 [0,2,0,0,0,0|1,0,0]=3 893 B11R1.22 CCC(C1=CC=C(Br)C=C1)=O AK133038 [0,2,0,0,0,0|2,0,0]=4 894 B11R1.22 CCC(C1=CC=C(F)C=C1)=O AK-77665 [0,2,0,0,0,0|2,0,0]=4 895 B11R1.22 CCC(C1=CC=C(I)C=C1)=O AK149241 [0,2,0,0,0,0|2,0,0]=4 896 B11R1.22 CCC(C1=CC=C(O)C=C1)=O AK-44068 [0,2,0,0,0,0|2,0,0]=4 897 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 AK-42930 [0,2,0,0,0,0|2,0,0]=4 898 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 AK-57163 [0,2,0,0,0,0|2,0,0]=4 899 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 AK-25021 [0,2,0,0,0,0|2,0,0]=4 900 B11R1.22 COC(C1=NC=C(C=N1)Br)=O AK-28412 [0,2,0,0,0,0|2,0,0]=4 901 B11R1.22 ClC1=CC=C(C(CN)=O)C=C1 AK-27718 [0,2,0,0,0,0|2,0,0]=4 902 B11R1.22 ClC1=CC=C(N=N1)C(=O)OC AK-24016 [0,2,0,0,0,0|2,0,0]=4 903 B11R1.22 ClC1=CN=C(C=N1)C(=O)NN AK-28354 [0,2,0,0,0,0|1,0,0]=3 904 B11R1.22 ClC1=CN=C(C=N1)C(=O)OC AK-23920 [0,2,0,0,0,0|0,0,0]=2 905 B11R1.22 FC1=CC=C(C=N1)C(=O)OC AK-40001 [0,2,0,0,0,0|1,0,0]=3 906 B11R1.22 IC1=CC=C(C(CBr)=O)C=C1 AK-25760 [0,2,0,0,0,0|2,0,0]=4 907 B11R1.22 NC1=CN=C(C=C1)C(=O)OC AK-24592 [0,2,0,0,0,0|1,0,0]=3 908 B11R1.22 NC1=NC=C(C=N1)C(=O)OC AK-21981 [0,2,0,0,0,0|2,0,0]=4 909 B11R1.22 NCC(=O)C1=CC=C(C=C1)F AK-32227 [0,2,0,0,0,0|2,0,0]=4 910 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 AK101127 [0,2,0,0,0,0|2,0,0]=4 911 B11R1.22 NCC(C1=CC=C(Br)C=C1)=O AK-42272 [0,2,0,0,0,0|2,0,0]=4 912 B11R1.22 O=C(C1=CC=C(Br)C=C1)CCl AK-41703 [0,2,0,0,0,0|2,0,0]=4 913 B11R1.22 O=C(C1=CN=C(Cl)N=C1)NC AK106982 [0,2,0,0,0,0|2,0,0]=4 914 B11R1.22 O=C(C1=CNC(N=C1)=O)OC AK138906 [0,2,0,0,0,0|2,0,0]=4 915 B11R1.22 O=C(C1=COC(C=C1)=O)OC AK-94193 [0,2,0,0,0,0|2,0,0]=4 916 B11R1.22 O=C(C1=NC=C(Cl)C=C1)OC AK-33121 [0,2,0,0,0,0|1,0,0]=3 917 B11R1.22 O=C(C1=NC=C(F)C=N1)OC AK128119 [0,2,0,0,0,0|2,0,0]=4 918 B11R1.22 O=C(C1=NC=C(N)N=C1)OC AK-59002 [0,2,0,0,0,0|0,0,0]=2 919 B11R1.22 O=C(C1=NC=C(O)C=C1)OC AK-48134 [0,2,0,0,0,0|1,0,0]=3 920 B11R1.22 O=C(NC)C1=CC=C(Br)C=C1 AK-86242 [0,2,0,0,0,0|2,0,0]=4 921 B11R1.22 O=C(NC)C1=CN=C(Cl)C=C1 AK-41767 [0,2,0,0,0,0|1,0,0]=3 922 B11R1.22 O=C(NN)C1=NC=C(F)C=C1 AK-97226 [0,2,0,0,0,0|2,0,0]=4 923 B11R1.22 O=C(OC)C1=CC=C(C)C=C1 AK110414 [0,2,0,0,0,0|2,0,0]=4 924 B11R1.22 O=C(OC)C1=CC=C(F)C=C1 AK-45398 [0,2,0,0,0,0|2,0,0]=4 925 B11R1.22 O=C(OC)C1=CC=C(I)C=C1 AK-45406 [0,2,0,0,0,0|2,0,0]=4 926 B11R1.22 O=C(OC)C1=CC=C(O)C=C1 AK-54335 [0,2,0,0,0,0|2,0,0]=4 927 B11R1.22 O=C(OC)C1=CN=C(C)C=C1 AK-28562 [0,2,0,0,0,0|1,0,0]=3 928 B11R1.22 O=C(OC)C1=CN=C(N)C=C1 AK-25008 [0,2,0,0,0,0|1,0,0]=3 929 B11R1.22 O=C(OC)C1=CN=C(O)C=C1 AK-26234 [0,2,0,0,0,0|1,0,0]=3 930 B11R1.22 O=C(OC)C1=NC=C(C)C=C1 AK-76225 [0,2,0,0,0,0|1,0,0]=3 931 B11R1.22 O=C1NN=C(C=C1)C(=O)OC AK-72777 [0,2,0,0,0,0|2,0,0]=4 932 B11R1.22 OC1=CC=C(C=C1)C(=O)CBr AK-34343 [0,2,0,0,0,0|2,0,0]=4 933 B11R1.22 OC1=CN=C(C=N1)C(=O)OC AK-24812 [0,2,0,0,0,0|0,0,0]=2 934 B11R1.166 BrC1=CN=C(C(=C1)C)C(=O)O AK-26400 [0,2,0,0,0,0|2,0,0]=4 935 B11R1.166 BrC1=NC(=CN=C1N(C)C)Br AK-23666 [0,2,0,0,0,0|2,0,0]=4 936 B11R1.166 C1=C(C(=CC=C1Cl)C(C)=O)Cl AK-47301 [0,2,0,0,0,0|2,0,0]=4 937 B11R1.166 C1=C(Cl)C=NC(=C1Cl)C(=O)O AK-24701 [0,2,0,0,0,0|2,0,0]=4 938 B11R1.166 C1=CC(=CC(=C1C(C)=O)F)F AK-46615 [0,2,0,0,0,0|2,0,0]=4 939 B11R1.166 C1=CC(=CC(=C1C(C)=O)F)O AK-49094 [0,2,0,0,0,0|2,0,0]=4 940 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 AK-75553 [0,2,0,0,0,0|2,0,0]=4 941 B11R1.166 CC(C1=CC=C(Br)C=C1Cl)=O AK-77175 [0,2,0,0,0,0|2,0,0]=4 942 B11R1.166 CC(C1=CC=C(Br)C=C1F)=O AK-46535 [0,2,0,0,0,0|2,0,0]=4 943 B11R1.166 CC(C1=CC=C(Br)C=C1N)=O AK-38008 [0,2,0,0,0,0|2,0,0]=4 944 B11R1.166 CC(C1=CC=C(Br)C=C1O)=O AK-40002 [0,2,0,0,0,0|2,0,0]=4 945 B11R1.166 CC(C1=CC=C(C)C=C1F)=O AK115609 [0,2,0,0,0,0|2,0,0]=4 946 B11R1.166 CC(C1=CC=C(Cl)C=C1Br)=O AK-75637 [0,2,0,0,0,0|2,0,0]=4 947 B11R1.166 CC(C1=CC=C(Cl)N=C1Cl)=O AK-49093 [0,2,0,0,0,0|1,0,0]=3 948 B11R1.166 CC(C1=CC=C(F)C=C1Cl)=O AK-53695 [0,2,0,0,0,0|2,0,0]=4 949 B11R1.166 CC(C1=CC=C(O)C=C1Br)=O AK-75734 [0,2,0,0,0,0|2,0,0]=4 950 B11R1.166 CC(C1=CC=C(O)C=C1C)=O AK-50197 [0,2,0,0,0,0|2,0,0]=4 951 B11R1.166 CC(C1=CC=C(O)C=C1Cl)=O AK-36102 [0,2,0,0,0,0|2,0,0]=4 952 B11R1.166 CC(C1=CC=C(O)C=C1O)=O AK-50224 [0,2,0,0,0,0|2,0,0]=4 953 B11R1.166 CC(C1=CN=C(Cl)N=C1Cl)=O AK126287 [0,2,0,0,0,0|2,0,0]=4 954 B11R1.166 CC1=C(C=NC(Cl)=C1)C(O)=O AK-42673 [0,2,0,0,0,0|2,0,0]=4 955 B11R1.166 ClC1=C(C(=O)O)C=CC(=N1)O AK-25883 [0,2,0,0,0,0|2,0,0]=4 956 B11R1.166 ClC1=CC(=C(C=C1)C(C)=O)F AK-46375 [0,2,0,0,0,0|2,0,0]=4 957 B11R1.166 ClC1=CN=C(C(=C1)C)C(=O)O AK-29698 [0,2,0,0,0,0|2,0,0]=4 958 B11R1.166 FC1=NC(=C(C(=O)O)C=C1)C AK-30364 [0,2,0,0,0,0|2,0,0]=4 959 B11R1.166 NC(=O)C1=CC=C(Cl)N=C1Cl AK-97072 [0,2,0,0,0,0|2,0,0]=4 960 B11R1.166 NC(=O)C1=CC=C(Cl)N=C1N AK-64550 [0,2,0,0,0,0|2,0,0]=4 961 B11R1.166 NC(=O)C1=NC=C(Cl)C=C1Cl AK100505 [0,2,0,0,0,0|2,0,0]=4 962 B11R1.166 NC1=C(C(=O)O)C=CC(=N1)Cl AK-31140 [0,2,0,0,0,0|2,0,0]=4 963 B11R1.166 NC1=CC(=C(C=C1)C(C)=O)O AK-34336 [0,2,0,0,0,0|2,0,0]=4 964 B11R1.166 O=C(C1=NC=C(Cl)N=C1Cl)N AK123564 [0,2,0,0,0,0|1,0,0]=3 965 B11R1.166 O=C(C1=NC=C(F)C=C1F)O AK-36274 [0,2,0,0,0,0|2,0,0]=4 966 B11R1.166 O=C(N)C1=CN=C(Cl)C=C1Cl AK-29452 [0,2,0,0,0,0|2,0,0]=4 967 B11R1.166 O=C(N)C1=NC=C(Br)C=C1N AK-48703 [0,2,0,0,0,0|2,0,0]=4 968 B11R1.166 O=C(O)C1=C(C)N=C(Br)C=C1 AK144236 [0,2,0,0,0,0|2,0,0]=4 969 B11R1.166 O=C(O)C1=C(C)N=C(Cl)C=C1 AK-58691 [0,2,0,0,0,0|2,0,0]=4 970 B11R1.166 O=C(O)C1=C(Cl)N=C(C)C=C1 AK-84877 [0,2,0,0,0,0|2,0,0]=4 971 B11R1.166 O=C(O)C1=C(Cl)N=C(Cl)C=C1 AK-25090 [0,2,0,0,0,0|2,0,0]=4 972 B11R1.166 O=C(O)C1=C(F)N=C(Cl)C=C1 AK120480 [0,2,0,0,0,0|2,0,0]=4 973 B11R1.166 O=C(O)C1=C(N)N=C(Br)C=C1 AK-77320 [0,2,0,0,0,0|2,0,0]=4 974 B11R1.166 O=C(O)C1=C(O)N=C(Cl)C=C1 AK-68352 [0,2,0,0,0,0|2,0,0]=4 975 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Br AK-55073 [0,2,0,0,0,0|2,0,0]=4 976 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Cl AK161047 [0,2,0,0,0,0|2,0,0]=4 977 B11R1.166 O=C(O)C1=CN=C(C)C=C1C AK-29000 [0,2,0,0,0,0|2,0,0]=4 978 B11R1.166 O=C(O)C1=CN=C(C)C=C1Cl AK-28459 [0,2,0,0,0,0|2,0,0]=4 979 B11R1.166 O=C(O)C1=CN=C(C)C=C1N AK-29804 [0,2,0,0,0,0|2,0,0]=4 980 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1Br AK167576 [0,2,0,0,0,0|2,0,0]=4 981 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1Cl AK-26772 [0,2,0,0,0,0|2,0,0]=4 982 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1N AK121862 [0,2,0,0,0,0|2,0,0]=4 983 B11R1.166 O=C(O)C1=CN=C(F)C=C1C AK123501 [0,2,0,0,0,0|2,0,0]=4 984 B11R1.166 O=C(O)C1=CN=C(F)C=C1F AK-26362 [0,2,0,0,0,0|2,0,0]=4 985 B11R1.166 O=C(O)C1=CN=C(N)C=C1C AK-68341 [0,2,0,0,0,0|2,0,0]=4 986 B11R1.166 O=C(O)C1=CN=C(N)C=C1Cl AK153190 [0,2,0,0,0,0|2,0,0]=4 987 B11R1.166 O=C(O)C1=CN=C(O)C=C1Cl AK-55097 [0,2,0,0,0,0|2,0,0]=4 988 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Cl AK-53906 [0,2,0,0,0,0|2,0,0]=4 989 B11R1.166 O=C(O)C1=NC=C(C)C=C1Br AK-76925 [0,2,0,0,0,0|2,0,0]=4 990 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Br AK101091 [0,2,0,0,0,0|2,0,0]=4 991 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1N AK120030 [0,2,0,0,0,0|2,0,0]=4 992 B11R1.166 O=C(O)C1=NC=C(F)C=C1Br AK-53675 [0,2,0,0,0,0|2,0,0]=4 993 B11R1.166 OC(=O)C1=C(F)C=C(Br)C=N1 AK-53915 [0,2,0,0,0,0|2,0,0]=4 994 B11R1.166 OC(=O)C1=NC=C(Br)C=C1Br AK-30252 [0,2,0,0,0,0|2,0,0]=4 995 B11R1.166 OC(=O)C1=NC=C(Cl)N=C1Cl AK-51403 [0,2,0,0,0,0|1,0,0]=3 996 B11R1.166 OC(=O)C1=NC=C(F)C=C1Cl AK109963 [0,2,0,0,0,0|2,0,0]=4 997 B11R1.166 OC1=CC(=NC=C1C(=O)O)C AK-25007 [0,2,0,0,0,0|2,0,0]=4 998 B11R1.16 C1=C(C(OCC)=O)N=CC=C1 AK-48935 [0,2,0,0,0,0|1,0,0]=3 999 B11R1.16 CCCC(C1=CC=CC=C1)=O AK164430 [0,2,0,0,0,0|2,0,0]=4 1000 B11R1.16 CCCC(C1=CC=CN=C1)=O AK123326 [0,2,0,0,0,0|1,0,0]=3 1001 B11R1.16 CCOC(=O)C1=NC=CC=N1 AK-85955 [0,2,0,0,0,0|2,0,0]=4 1002 B11R1.16 N#CCC(C1=CC=CC=C1)=O AK-43072 [0,2,0,0,0,0|2,0,0]=4 1003 B11R1.16 O=C(C1=NC=CN=C1)OCC AK-40036 [0,2,0,0,0,0|0,0,0]=2 1004 B11R1.16 O=C(OCC)C1=CN=CC=C1 AK-88428 [0,2,0,0,0,0|1,0,0]=3 1005 B11R1.16 O=C(OCCl)C1=CC=CC=C1 AK-86220 [0,2,0,0,0,0|2,0,0]=4 1006 B11R1.23 BrC1=CC(=NC=C1)C(=O)OC AK-24538 [0,2,0,0,0,0|1,0,0]=3 1007 B11R1.23 C1=C(C=CC=C1C(OC)=O)O AK-47384 [0,2,0,0,0,0|2,0,0]=4 1008 B11R1.23 C1=C(C=CC=C1F)C(CBr)=O AK-45729 [0,2,0,0,0,0|2,0,0]=4 1009 B11R1.23 C1=C(C=NC=C1C(OC)=O)Br AK-25229 [0,2,0,0,0,0|1,0,0]=3 1010 B11R1.23 C1=C(C=NC=C1C)C(OC)=O AK-39649 [0,2,0,0,0,0|1,0,0]=3 1011 B11R1.23 C1=C(Cl)C=CN=C1C(OC)=O AK-16616 [0,2,0,0,0,0|1,0,0]=3 1012 B11R1.23 C1=CC=C(N=C1C(OC)=O)C AK-32150 [0,2,0,0,0,0|1,0,0]=3 1013 B11R1.23 CC1=CC(C(CBr)=O)=CC=C1 AK-43564 [0,2,0,0,0,0|2,0,0]=4 1014 B11R1.23 CCC(=O)C1=CC=CC(Cl)=C1 AK101591 [0,2,0,0,0,0|2,0,0]=4 1015 B11R1.23 CCC(C1=CC=CC(F)=C1)=O AK548314 [0,2,0,0,0,0|2,0,0]=4 1016 B11R1.23 CCC(C1=CC=CC(O)=C1)=O AK-45536 [0,2,0,0,0,0|2,0,0]=4 1017 B11R1.23 CCC(C1=NC=CC(Cl)=C1)=O AK146218 [0,2,0,0,0,0|1,0,0]=3 1018 B11R1.23 COC(=O)C1=CC=CC(=O)N1 AK-64715 [0,2,0,0,0,0|1,0,1]=4 1019 B11R1.23 COC(=O)C1=CC=NC(Br)=N1 AK-76962 [0,2,0,0,0,0|2,0,0]=4 1020 B11R1.23 COC(=O)C1=NC(Br)=CC=N1 AK110267 [0,2,0,0,0,0|2,0,0]=4 1021 B11R1.23 COC(=O)C1=NC(C)=CC=N1 AK100031 [0,2,0,0,0,0|2,0,0]=4 1022 B11R1.23 COC(=O)C1=NC=CC(C)=C1 AK-58362 [0,2,0,0,0,0|1,0,0]=3 1023 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 AK-25656 [0,2,0,0,0,0|1,0,0]=3 1024 B11R1.23 COC(C1=CC=CC(=N1)Br)=O AK-27818 [0,2,0,0,0,0|1,0,0]=3 1025 B11R1.23 ClC1=CC(=CN=N1)C(=O)OC AK-32830 [0,2,0,0,0,0|2,0,0]=4 1026 B11R1.23 ClC1=CC(C(CBr)=O)=CC=C1 AK-47073 [0,2,0,0,0,0|2,0,0]=4 1027 B11R1.23 ClC1=CC=NC(=C1)C(=O)NC AK-28999 [0,2,0,0,0,0|1,0,0]=3 1028 B11R1.23 ClC1=CN=CC(=N1)C(=O)OC AK-29037 [0,2,0,0,0,0|0,0,0]=2 1029 B11R1.23 ClC1=NC=CC(=N1)C(=O)OC AK-33388 [0,2,0,0,0,0|2,0,0]=4 1030 B11R1.23 FC1=CC=CC(=C1)C(=O)OC AK-47674 [0,2,0,0,0,0|2,0,0]=4 1031 B11R1.23 NC1=CC(=CN=C1)C(=O)OC AK-28608 [0,2,0,0,0,0|1,0,0]=3 1032 B11R1.23 NC1=CN=CC(=N1)C(=O)OC AK-28731 [0,2,0,0,0,0|0,0,0]=2 1033 B11R1.23 O=C(C1=NC(Br)=CN=C1)OC AK-39151 [0,2,0,0,0,0|0,0,0]=2 1034 B11R1.23 O=C(C1=NC(C)=CN=C1)OC AK130648 [0,2,0,0,0,0|0,0,0]=2 1035 B11R1.23 O=C(C1=NC(Cl)=CC=C1)OC AK-51763 [0,2,0,0,0,0|1,0,0]=3 1036 B11R1.23 O=C(C1=NC(N)=NC=C1)OC AK-76214 [0,2,0,0,0,0|2,0,0]=4 1037 B11R1.23 O=C(C1=NC=CC(N)=C1)OC AK-36192 [0,2,0,0,0,0|1,0,0]=3 1038 B11R1.23 O=C(C1=NC=NC(Br)=C1)OC AK152485 [0,2,0,0,0,0|2,0,0]=4 1039 B11R1.23 O=C(C1=NC=NC(Cl)=C1)OC AK-64323 [0,2,0,0,0,0|2,0,0]=4 1040 B11R1.23 O=C(C=1C=CNC(N1)=O)OC AK-76285 [0,2,0,0,0,0|2,0,0]=4 1041 B11R1.23 O=C(NC)C1=CC=CC(N)=C1 AK-34399 [0,2,0,0,0,0|2,0,0]=4 1042 B11R1.23 O=C(NC)C1=NC=CC(Cl)=C1 AK-38402 [0,2,0,0,0,0|1,0,0]=3 1043 B11R1.23 O=C(NN)C1=NC(O)=CC=C1 AK467135 [0,2,0,0,0,0|2,0,0]=4 1044 B11R1.23 O=C(OC)C1=CC=CC(Br)=C1 AK-73031 [0,2,0,0,0,0|2,0,0]=4 1045 B11R1.23 O=C(OC)C1=CC=CC(Cl)=C1 AK117218 [0,2,0,0,0,0|2,0,0]=4 1046 B11R1.23 O=C(OC)C1=CC=CC(I)=C1 AK-81947 [0,2,0,0,0,0|2,0,0]=4 1047 B11R1.23 O=C(OC)C1=CC=CC(N)=C1 AK-43961 [0,2,0,0,0,0|2,0,0]=4 1048 B11R1.23 O=C(OC)C1=NC(F)=CC=C1 AK-87700 [0,2,0,0,0,0|1,0,0]=3 1049 B11R1.23 O=C(OC)C1=NC(N)=CC=C1 AK-37656 [0,2,0,0,0,0|1,0,0]=3 1050 B11R1.23 O=C(OC)C1=NC=CC(I)=C1 AK-29979 [0,2,0,0,0,0|1,0,0]=3 1051 B11R1.23 OC1=CC(=CN=C1)C(=O)OC AK-47062 [0,2,0,0,0,0|1,0,0]=3 1052 B11R1.222 BrC1=CN=CN=C1C(=O)OC AK-25053 [0,2,0,0,0,0|2,0,0]=4 1053 B11R1.222 BrC1=NC=CN=C1C(=O)OC AK-30735 [0,2,0,0,0,0|0,0,0]=2 1054 B11R1.222 C1=C(C(=O)OC)C(=NC=C1)F AK-25162 [0,2,0,0,0,0|1,0,0]=3 1055 B11R1.222 C1=CC=CC(=C1C(OC)=O)Br AK-72980 [0,2,0,0,0,0|2,0,0]=4 1056 B11R1.222 C1=CC=NC(=C1C(OC)=O)Cl AK-44999 [0,2,0,0,0,0|1,0,0]=3 1057 B11R1.222 C1=CC=NC(=C1C(OC)=O)N AK-27747 [0,2,0,0,0,0|1,0,0]=3 1058 B11R1.222 C1=CN=C(C(=N1)C(OC)=O)N AK-29912 [0,2,0,0,0,0|0,0,0]=2 1059 B11R1.222 CC1=C(C(=O)OC)C=CC=N1 AK-27990 [0,2,0,0,0,0|1,0,0]=3 1060 B11R1.222 CCC(C1=CC=CC=C1Cl)=O AK-86142 [0,2,0,0,0,0|2,0,0]=4 1061 B11R1.222 COC(=O)C1=C(C)N=CC=N1 AK-97091 [0,2,0,0,0,0|0,0,0]=2 1062 B11R1.222 COC(=O)C1=C(N)C=CC=C1 AK-41339 [0,2,0,0,0,0|2,0,0]=4 1063 B11R1.222 COC(=O)C1=CN=CN=C1O AK-26014 [0,2,0,0,0,0|2,0,0]=4 1064 B11R1.222 COC(=O)C1=NC=CC=C1C AK-61199 [0,2,0,0,0,0|1,0,0]=3 1065 B11R1.222 ClC1=C(N=CC=C1)C(=O)OC AK-23912 [0,2,0,0,0,0|1,0,0]=3 1066 B11R1.222 ClC1=NC=CN=C1C(=O)OC AK-39173 [0,2,0,0,0,0|0,0,0]=2 1067 B11R1.222 FC1=CC=CC=C1C(CF)=O AK198962 [0,2,0,0,0,0|2,0,0]=4 1068 B11R1.222 NC1=NC=NC=C1C(=O)OC AK-30806 [0,2,0,0,0,0|2,0,0]=4 1069 B11R1.222 NCC(=O)C1=C(C=CC=C1)F AK-70904 [0,2,0,0,0,0|2,0,0]=4 1070 B11R1.222 O=C(C1=CC=CNC1=O)OC AK-28355 [0,2,0,0,0,0|1,0,1]=4 1071 B11R1.222 O=C(C1=NC=CC=C1Br)OC AK-28556 [0,2,0,0,0,0|1,0,0]=3 1072 B11R1.222 O=C(C1=NC=CC=C1F)OC AK-30151 [0,2,0,0,0,0|1,0,0]=3 1073 B11R1.222 O=C(C1=NC=CC=C1O)OC AK-26201 [0,2,0,0,0,0|1,0,0]=3 1074 B11R1.222 O=C(C1=NC=CN=C1I)OC AK-30597 [0,2,0,0,0,0|0,0,0]=2 1075 B11R1.222 O=C(C1=NC=CN=C1N)NN AK-30747 [0,2,0,0,0,0|1,0,0]=3 1076 B11R1.222 O=C(NC)C1=CC=CC=C1N AK-26614 [0,2,0,0,0,0|2,0,0]=4 1077 B11R1.222 O=C(OC)C1=C(O)N=CC=C1 AK-54451 [0,2,0,0,0,0|1,0,0]=3 1078 B11R1.222 O=C(OC)C1=CC=CC=C1C AK174020 [0,2,0,0,0,0|2,0,0]=4 1079 B11R1.222 O=C(OC)C1=CC=CC=C1Cl AK161838 [0,2,0,0,0,0|2,0,0]=4 1080 B11R1.222 O=C(OC)C1=CC=CC=C1I AK-76653 [0,2,0,0,0,0|2,0,0]=4 1081 B11R1.222 O=C(OC)C1=CC=CC=C1S AK554462 [0,2,0,0,0,0|2,0,0]=4 1082 B11R1.222 O=C(OC)C1=CN=CC=C1C AK-39773 [0,2,0,0,0,0|1,0,0]=3 1083 B11R1.222 O=C(OC)C1=CN=CC=C1N AK-25475 [0,2,0,0,0,0|1,0,0]=3 1084 B11R1.222 O=C(OC)C1=NC=CC=C1N AK-29219 [0,2,0,0,0,0|1,0,0]=3 1085 B11R1.222 OC1=NC=CN=C1C(=O)OC AK-39232 [0,2,0,0,0,0|0,0,0]=2 1086 B11R1.53 C1=CC=CC(=C1C#N)C(C)=O AK-50565 [0,2,0,0,0,0|2,0,0]=4 1087 B11R1.53 CC(C1=CC=CC=C1NC)=O AK135397 [0,2,0,0,0,0|2,0,0]=4 1088 B11R1.53 CCC1=C(N=CC=N1)C(C)=O AK-89658 [0,2,0,0,0,0|0,0,0]=2 1089 B11R1.53 CCC1=NC=CC=C1C(O)=O AK111206 [0,2,0,0,0,0|2,0,0]=4 1090 B11R1.53 COC1=C(N=CC=N1)C(O)=O AK102764 [0,2,0,0,0,0|1,0,0]=3 1091 B11R1.53 COC1=CC=CN=C1C(=O)O AK-63990 [0,2,0,0,0,0|2,0,0]=4 1092 B11R1.53 COC1=CC=CN=C1C(C)=O AK-80679 [0,2,0,0,0,0|1,0,0]=3 1093 B11R1.53 COC1=NC=CC=C1C(C)=O AK110016 [0,2,0,0,0,0|1,0,0]=3 1094 B11R1.53 COC1=NC=CN=C1C(C)C AK116762 [0,2,0,0,0,0|1,0,1]=4 1095 B11R1.53 O=C(O)C1=C(OC)N=CC=C1 AK-45121 [0,2,0,0,0,0|2,0,0]=4 1096 B11R1.53 O=C(O)C1=CN=CC=C1CC AK452545 [0,2,0,0,0,0|2,0,0]=4 1097 B11R1.156 C1=CN=C(C(=C1Cl)C(=O)O)Cl AK-25677 [0,2,0,0,0,0|2,0,0]=4 1098 B11R1.156 CC(=O)C1=C(C)C=CC=C1C AK110169 [0,2,0,0,0,0|2,0,0]=4 1099 B11R1.156 CC(=O)C1=C(N)C=CC=C1Br AK-99977 [0,2,0,0,0,0|2,0,0]=4 1100 B11R1.156 CC(C1=C(C)C=CC=C1O)=O AK-64408 [0,2,0,0,0,0|2,0,0]=4 1101 B11R1.156 CC(C1=C(Cl)C=CC=C1Cl)=O AK-51041 [0,2,0,0,0,0|2,0,0]=4 1102 B11R1.156 CC(C1=C(Cl)N=CN=C1Cl)=O AK125982 [0,2,0,0,0,0|2,0,0]=4 1103 B11R1.156 CC(C1=C(F)C=CC=C1Br)=O AK-31670 [0,2,0,0,0,0|2,0,0]=4 1104 B11R1.156 CC(C1=C(F)C=CC=C1Cl)=O AK-77336 [0,2,0,0,0,0|2,0,0]=4 1105 B11R1.156 CC(C1=C(F)C=CC=C1F)=O AK-33179 [0,2,0,0,0,0|2,0,0]=4 1106 B11R1.156 CC(C1=C(F)C=CC=C1N)=O AK145194 [0,2,0,0,0,0|2,0,0]=4 1107 B11R1.156 CC(C1=C(O)C=CC=C1Br)=O AK-31671 [0,2,0,0,0,0|2,0,0]=4 1108 B11R1.156 CC(C1=C(O)C=CC=C1Cl)=O AK-29397 [0,2,0,0,0,0|2,0,0]=4 1109 B11R1.156 CC(C1=C(O)C=CC=C1F)=O AK-86499 [0,2,0,0,0,0|2,0,0]=4 1110 B11R1.156 CC(C1=C(O)C=CC=C1O)=O AK-47368 [0,2,0,0,0,0|2,0,0]=4 1111 B11R1.156 FC1=C(C(=O)O)C(=CC=N1)I AK-30567 [0,2,0,0,0,0|2,0,0]=4 1112 B11R1.156 NC1=NC=CC(Cl)=C1C(O)=O AK-54996 [0,2,0,0,0,0|2,0,0]=4 1113 B11R1.156 O=C(O)C1=C(Cl)N=CC=C1F AK130207 [0,2,0,0,0,0|2,0,0]=4 1114 B11R1.156 O=C(O)C1=C(O)N=CC=C1F AK280470 [0,2,0,0,0,0|2,0,0]=4 1115 B11R1.159 BrC1=CC=CC(=C1F)C(C)=O AK-33547 [0,2,0,0,0,0|2,0,0]=4 1116 B11R1.159 CC(C1=CC=CC(Br)=C1O)=O AK-33819 [0,2,0,0,0,0|2,0,0]=4 1117 B11R1.159 CC(C1=CC=CC(C)=C1F)=O AK327202 [0,2,0,0,0,0|2,0,0]=4 1118 B11R1.159 CC(C1=CC=CC(Cl)=C1Cl)=O AK-75733 [0,2,0,0,0,0|2,0,0]=4 1119 B11R1.159 CC(C1=CC=CC(Cl)=C1O)=O AK-34682 [0,2,0,0,0,0|2,0,0]=4 1120 B11R1.159 CC(C1=CC=CC(F)=C1Br)=O AK145989 [0,2,0,0,0,0|2,0,0]=4 1121 B11R1.159 CC(C1=CC=CC(F)=C1Cl)=O AK-94336 [0,2,0,0,0,0|2,0,0]=4 1122 B11R1.159 CC(C1=CC=CC(N)=C1O)=O AK-26283 [0,2,0,0,0,0|2,0,0]=4 1123 B11R1.159 CC(C1=CC=CC(O)=C1N)=O AK-80116 [0,2,0,0,0,0|2,0,0]=4 1124 B11R1.159 CC(C1=CC=CC(O)=C1O)=O AK-33157 [0,2,0,0,0,0|2,0,0]=4 1125 B11R1.159 O=C(O)C1=CN=CC(Br)=C1Br AK127033 [0,2,0,0,0,0|2,0,0]=4 1126 B11R1.159 O=C(O)C1=CN=CC(Br)=C1Cl AK144516 [0,2,0,0,0,0|2,0,0]=4 1127 B11R1.159 O=C(O)C1=CN=CC(Br)=C1N AK112514 [0,2,0,0,0,0|2,0,0]=4 1128 B11R1.159 O=C(O)C1=CN=CC(Br)=C1O AK-84818 [0,2,0,0,0,0|2,0,0]=4 1129 B11R1.167 BrC1=C(C(=O)O)C=C(C=N1)Br AK-34554 [0,2,0,0,0,0|2,0,0]=4 1130 B11R1.167 BrC1=CC(=C(N=C1)Cl)C(=O)O AK-23807 [0,2,0,0,0,0|2,0,0]=4 1131 B11R1.167 BrC1=CC(=C(N=C1)F)C(=O)O AK-26870 [0,2,0,0,0,0|2,0,0]=4 1132 B11R1.167 BrC1=NC=C(N=C1C(=O)O)Br AK-31824 [0,2,0,0,0,0|1,0,0]=3 1133 B11R1.167 C1=C(Br)C=CC(=C1C(=O)C)O AK-47862 [0,2,0,0,0,0|2,0,0]=4 1134 B11R1.167 C1=C(C(=NC=C1Br)N)C(=O)O AK-23512 [0,2,0,0,0,0|2,0,0]=4 1135 B11R1.167 C1=C(Cl)C=CC(=C1C(C)=O)Cl AK-73074 [0,2,0,0,0,0|2,0,0]=4 1136 B11R1.167 C1=CC(=NC(=C1Cl)C(O)=O)Cl AK-25485 [0,2,0,0,0,0|2,0,0]=4 1137 B11R1.167 CC(=O)C1=C(F)C=CC(N)=C1 AK-68014 [0,2,0,0,0,0|2,0,0]=4 1138 B11R1.167 CC(=O)C1=C(N)C=CC(Cl)=C1 AK-28102 [0,2,0,0,0,0|2,0,0]=4 1139 B11R1.167 CC(=O)C1=C(N)C=CC(F)=C1 AK109676 [0,2,0,0,0,0|2,0,0]=4 1140 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 AK-30761 [0,2,0,0,0,0|2,0,0]=4 1141 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 AK-30762 [0,2,0,0,0,0|2,0,0]=4 1142 B11R1.167 CC(C1=C(C=CC(=C1)F)Cl)=O AK-48949 [0,2,0,0,0,0|2,0,0]=4 1143 B11R1.167 CC(C1=CC(Br)=CC=C1C)=O AK147547 [0,2,0,0,0,0|2,0,0]=4 1144 B11R1.167 CC(C1=CC(Br)=CC=C1Cl)=O AK109534 [0,2,0,0,0,0|2,0,0]=4 1145 B11R1.167 CC(C1=CC(Br)=CC=C1F)=O AK-28059 [0,2,0,0,0,0|2,0,0]=4 1146 B11R1.167 CC(C1=CC(Br)=CC=C1N)=O AK-28616 [0,2,0,0,0,0|2,0,0]=4 1147 B11R1.167 CC(C1=CC(Br)=CN=C1F)=O AK-30697 [0,2,0,0,0,0|1,0,0]=3 1148 B11R1.167 CC(C1=CC(Cl)=CC=C1Br)=O AK-51654 [0,2,0,0,0,0|2,0,0]=4 1149 B11R1.167 CC(C1=CC(Cl)=CC=C1F)=O AK-76691 [0,2,0,0,0,0|2,0,0]=4 1150 B11R1.167 CC(C1=CC(F)=CC=C1Br)=O AK-45663 [0,2,0,0,0,0|2,0,0]=4 1151 B11R1.167 CC(C1=CC(F)=CC=C1I)=O AK136027 [0,2,0,0,0,0|2,0,0]=4 1152 B11R1.167 CC(C1=CC(F)=CC=C1O)=O AK-45396 [0,2,0,0,0,0|2,0,0]=4 1153 B11R1.167 CC(C1=CC(N)=CC=C1O)=O AK116395 [0,2,0,0,0,0|2,0,0]=4 1154 B11R1.167 CC(C1=CC(O)=CC=C1O)=O AK-51301 [0,2,0,0,0,0|2,0,0]=4 1155 B11R1.167 CC(C1=NC(Br)=CC=C1F)=O AK372267 [0,2,0,0,0,0|1,0,0]=3 1156 B11R1.167 CC(C1=NC(Cl)=NC=C1C)=O AK-92912 [0,2,0,0,0,0|2,0,0]=4 1157 B11R1.167 CC1=CC=C(C)C(=N1)C(O)=O AK-76881 [0,2,0,0,0,0|2,0,0]=4 1158 B11R1.167 CC1=NC(C(O)=O)=C(C)N=C1 AK-80652 [0,2,0,0,0,0|1,0,0]=3 1159 B11R1.167 ClC1=C(C(=O)O)C=C(C=N1)Cl AK-27047 [0,2,0,0,0,0|2,0,0]=4 1160 B11R1.167 ClC1=NC=C(C=C1C(=O)O)C AK-39746 [0,2,0,0,0,0|2,0,0]=4 1161 B11R1.167 NC(=O)C1=C(N)N=CC(Br)=N1 AK-39093 [0,2,0,0,0,0|1,0,0]=3 1162 B11R1.167 NC(=O)C1=C(O)N=CC(Br)=N1 AK-76974 [0,2,0,0,0,0|1,0,0]=3 1163 B11R1.167 NC1=CC=C(Cl)N=C1C(O)=O AK-39553 [0,2,0,0,0,0|2,0,0]=4 1164 B11R1.167 NC1=NC=C(C=C1C(=O)O)Cl AK-50594 [0,2,0,0,0,0|2,0,0]=4 1165 B11R1.167 NC1=NC=C(N=C1C(=O)O)Br AK-21914 [0,2,0,0,0,0|1,0,0]=3 1166 B11R1.167 NC1=NC=C(N=C1C(=O)O)Cl AK-30466 [0,2,0,0,0,0|1,0,0]=3 1167 B11R1.167 NC1=NC=C(N=C1N(C)C)Br AK-23954 [0,2,0,0,0,0|2,0,0]=4 1168 B11R1.167 O=C(C1=CC(Cl)=CN=C1C)O AK-41038 [0,2,0,0,0,0|2,0,0]=4 1169 B11R1.167 O=C(C1=NC(Br)=CN=C1O)O AK-93166 [0,2,0,0,0,0|1,0,0]=3 1170 B11R1.167 O=C(C1=NC(Cl)=CC=C1Br)O AK-39554 [0,2,0,0,0,0|2,0,0]=4 1171 B11R1.167 O=C(C1=NC(Cl)=CN=C1Br)O AK-31823 [0,2,0,0,0,0|1,0,0]=3 1172 B11R1.167 O=C(C1=NC(Cl)=CN=C1Cl)N AK134683 [0,2,0,0,0,0|1,0,0]=3 1173 B11R1.167 O=C(C1=NC(Cl)=CN=C1Cl)O AK128606 [0,2,0,0,0,0|1,0,0]=3 1174 B11R1.167 O=C(C1=NC(Cl)=CN=C1O)N AK-76972 [0,2,0,0,0,0|1,0,0]=3 1175 B11R1.167 O=C(O)C1=C(Br)N=CC(Cl)=C1 AK-36007 [0,2,0,0,0,0|2,0,0]=4 1176 B11R1.167 O=C(O)C1=C(Cl)N=CC(F)=C1 AK-25888 [0,2,0,0,0,0|2,0,0]=4 1177 B11R1.167 O=C(O)C1=C(Cl)N=CC(O)=C1 AK112903 [0,2,0,0,0,0|2,0,0]=4 1178 B11R1.167 O=C(O)C1=C(F)N=CC(C)=C1 AK-61406 [0,2,0,0,0,0|2,0,0]=4 1179 B11R1.167 O=C(O)C1=C(N)N=CC(C)=C1 AK-29345 [0,2,0,0,0,0|2,0,0]=4 1180 B11R1.167 O=C(O)C1=C(N)N=CC(I)=C1 AK-68339 [0,2,0,0,0,0|2,0,0]=4 1181 B11R1.167 O=C(O)C1=NC(Br)=CC=C1Br AK-92200 [0,2,0,0,0,0|2,0,0]=4 1182 B11R1.167 O=C(O)C1=NC(C)=CC=C1O AK123475 [0,2,0,0,0,0|2,0,0]=4 1183 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1C AK-47252 [0,2,0,0,0,0|2,0,0]=4 1184 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1F AK113170 [0,2,0,0,0,0|2,0,0]=4 1185 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1N AK157328 [0,2,0,0,0,0|2,0,0]=4 1186 B11R1.167 O=C(O)C1=NC(F)=CC=C1Br AK-89900 [0,2,0,0,0,0|2,0,0]=4 1187 B11R1.167 O=C(O)C1=NC(O)=CC=C1C AK-68364 [0,2,0,0,0,0|2,0,0]=4 1188 B11R1.167 O=C(O)C1=NC(O)=CC=C1Cl AK101774 [0,2,0,0,0,0|2,0,0]=4 1189 B11R1.74 CC(=O)C1=CC(Br)=CC(Cl)=C1 AK-88050 [0,2,0,0,0,0|2,0,0]=4 1190 B11R1.74 CC(=O)C1=CC(C)=CC(C)=C1 AK-43858 [0,2,0,0,0,0|2,0,0]=4 1191 B11R1.74 CC(C1=CC(Br)=CC(Br)=C1)=O AK-87691 [0,2,0,0,0,0|2,0,0]=4 1192 B11R1.74 CC(C1=CC(C)=CC(Br)=C1)=O AK143673 [0,2,0,0,0,0|2,0,0]=4 1193 B11R1.74 CC(C1=CC(Cl)=CC(Cl)=C1)=O AK-86403 [0,2,0,0,0,0|2,0,0]=4 1194 B11R1.74 CC(C1=CC(F)=CC(F)=C1)=O AK-44507 [0,2,0,0,0,0|2,0,0]=4 1195 B11R1.74 CC(C1=CC(O)=CC(O)=C1)=O AK-45934 [0,2,0,0,0,0|2,0,0]=4 1196 B11R1.74 ClC1=CC(=CC(=N1)C(=O)O)C AK-23860 [0,2,0,0,0,0|2,0,0]=4 1197 B11R1.74 ClC1=CC(=NC(=C1)C(=O)O)Cl AK-32490 [0,2,0,0,0,0|2,0,0]=4 1198 B11R1.74 O=C(O)C1=NC(C)=CC(C)=C1 AK-33798 [0,2,0,0,0,0|2,0,0]=4 1199 B11R1.74 O=C(O)C1=NC(C)=CC(Cl)=C1 AK174217 [0,2,0,0,0,0|2,0,0]=4 1200 B11R1.266 CC(C1=CC=CC(CCl)=C1)=O AK-86175 [0,2,0,0,0,0|2,0,0]=4 1201 B11R1.266 CCC1=CC=CC(=N1)C(O)=O AK-65227 [0,2,0,0,0,0|2,0,0]=4 1202 B11R1.266 COC1=CC(=CN=C1)C(=O)O AK-40655 [0,2,0,0,0,0|2,0,0]=4 1203 B11R1.266 COC1=CC=CC(=N1)C(C)=O AK-27739 [0,2,0,0,0,0|1,0,0]=3 1204 B11R1.266 COC1=NC(=CN=C1)C(O)=O AK-66990 [0,2,0,0,0,0|1,0,0]=3 1205 B11R1.266 N#CC1=CC=NC(C(C)=O)=C1 AK126179 [0,2,0,0,0,0|1,0,0]=3 1206 B11R1.266 O=C(C1=NC(CO)=CC=C1)O AK-40085 [0,2,0,0,0,0|2,0,0]=4 1207 B11R1.266 O=C(C1=NC(NC)=CN=C1)O AK-35586 [0,2,0,0,0,0|1,0,0]=3 1208 B11R1.266 O=C(N)C1=NC(C#N)=CC=C1 AK150478 [0,2,0,0,0,0|2,0,0]=4 1209 B11R1.266 O=C(O)C1=NC(C=O)=CC=C1 AK145136 [0,2,0,0,0,0|2,0,0]=4 1210 B11R1.266 O=C(O)C1=NC(CN)=CC=C1 AK152008 [0,2,0,0,0,0|2,0,0]=4 1211 B11R1.266 O=C(O)C1=NC(OC)=CC=C1 AK-29968 [0,2,0,0,0,0|2,0,0]=4 1212 B11R1.266 O=C(O)C1=NC=CC(OC)=C1 AK-29096 [0,2,0,0,0,0|2,0,0]=4 1213 B11R1.266 OC(=O)C1=NC(=CC=C1)C#N AK-68141 [0,2,0,0,0,0|2,0,0]=4 1214 B11R2.10 C1=CC=NC2=C1OC(N2)=O AK-28047 [0,0,0,1,0,1|2,0,0]=4 1215 B11R2.10 CC1=CC2=CC=CN=C2N1 AK-25051 [0,0,0,1,0,1|2,0,0]=4 1216 B11R2.10 CC1=NC2=NC=CC=C2N1 AK-39947 [0,0,0,1,0,1|2,0,0]=4 1217 B11R2.10 CC1=NC2=NC=CC=C2O1 AK-30675 [0,0,0,1,0,1|1,0,1]=4 1218 B11R2.10 N1C2=CC=CN=C2NC1=O AK-24800 [0,0,0,1,0,1|2,0,0]=4 1219 B11R2.10 N1C2=NC=CC=C2CC1=O AK-23546 [0,0,0,1,0,1|1,0,0]=3 1220 B11R2.10 O=C1CC2=NC=CC=C2N1 AK-39930 [0,0,0,1,0,1|1,0,0]=3 1221 B11R2.10 O=C1N=C2C=CC=CN2C1 AK-80162 [0,0,0,1,0,1|1,0,1]=4 1222 B11R2.10 O=C1NC2=C(C1)C=CN=C2 AK-90208 [0,0,0,1,0,1|1,0,0]=3 1223 B11R2.10 O=C1NC2=C(C=CC=C2)C1 AK-49964 [0,0,0,1,0,1|2,0,0]=4 1224 B11R2.10 O=C1NC2=C(N1)C=NC=C2 AK161520 [0,0,0,1,0,1|2,0,0]=4 1225 B11R2.10 O=C1OC2=CC=CC=C2C1 AK-77806 [0,0,0,1,0,1|2,0,0]=4 1226 B11R2.10 O=C1SC2=CC=CN=C2N1 AK438250 [0,0,0,1,0,1|2,0,0]=4 1227 B11R2.1 BrC1=CSC2=NC=CN=C12 AK-30777 [0,1,0,1,0,0|1,0,1]=4 1228 B11R2.1 BrC1=C[NH]C2=NC=CN=C12 AK-23683 [0,1,0,1,0,0|1,0,1]=4 1229 B11R2.1 BrC1=NSC2=NC=CN=C12 AK-30773 [0,1,0,1,0,0|1,1,0]=4 1230 B11R2.1 C1=CC=CC2=C1C(CC2)=O AK-44115 [0,1,0,1,0,0|2,0,0]=4 1231 B11R2.1 C1=CC=CC2=C1C(CO2)=O AK-45365 [0,1,0,1,0,0|2,0,0]=4 1232 B11R2.1 C1=NC2=N[NH]C(=C2N=C1)N AK-24164 [0,1,0,1,0,0|2,0,0]=4 1233 B11R2.1 CC1=C2C=CC=NC2=N[NH]1 AK-28223 [0,1,0,1,0,0|2,0,0]=4 1234 B11R2.1 CC1=CNC2=C1C=CC=N2 AK-49155 [0,1,0,1,0,0|2,0,0]=4 1235 B11R2.1 CC1=NNC2=CC=CN=C21 AK-30702 [0,1,0,1,0,0|2,0,0]=4 1236 B11R2.1 CC1CCC2=NC=CN=C21 AK116760 [0,1,0,1,0,0|1,0,1]=4 1237 B11R2.1 NC1=NOC2=NC=CN=C21 AK-24600 [0,1,0,1,0,0|1,0,1]=4 1238 B11R2.1 O=C1C2=CC=CC=C2SC1 AK-29817 [0,1,0,1,0,0|2,0,0]=4 1239 B11R2.1 O=C1CCC2=CC=CN=C21 AK-29125 [0,1,0,1,0,0|1,0,0]=3 1240 B11R2.1 O=C1NCC2=C1C=CC=C2 AK-68456 [0,1,0,1,0,0|2,0,0]=4 1241 B11R2.1 O=C1NCC2=C1C=CC=N2 AK103949 [0,1,0,1,0,0|1,0,0]=3 1242 B11R2.1 O=C1NNC2=C1C=CC=N2 AK-30879 [0,1,0,1,0,0|2,0,0]=4 1243 B11R2.1 O=C1OCC2=C1C=CC=C2 AK-78719 [0,1,0,1,0,0|2,0,0]=4 1244 B11R2.1 O=C1OCC2=NC=CC=C12 AK-45766 [0,1,0,1,0,0|1,0,0]=3 1245 B7R1.1 C1=C(N=CS1)C=O AK-23930 [1,0,0,0,1,0|1,0,0]=3 1246 B7R1.1 C1=C(SC=C1)C=O AK-26482 [1,0,0,0,1,0|1,0,0]=3 1247 B7R1.1 C1=C([NH]C=N1)C=O AK-41612 [1,0,0,0,1,0|0,0,1]=3 1248 B7R1.1 C1=CN=C(C=O)[NH]1 AK-49186 [1,0,0,0,1,0|0,0,1]=3 1249 B7R1.1 C1=CSC(=N1)C=O AK-46309 [1,0,0,0,1,0|1,0,0]=3 1250 B7R1.1 C=CC1=NC=CS1 AK251551 [1,0,0,0,1,0|1,0,1]=4 1251 B7R1.1 CCC1=CC=CS1 AK-76635 [1,0,0,0,1,0|1,0,1]=4 1252 B7R1.1 CCC1=NC=CN1 AK161825 [1,0,0,0,1,0|0,0,2]=4 1253 B7R1.1 CCC1=NNC=N1 AK124531 [1,0,0,0,1,0|1,0,1]=4 1254 B7R1.1 CCN1C=CN=C1 AK-47598 [1,0,0,0,1,0|1,0,1]=4 1255 B7R1.1 CCN1N=CC=C1 AK-39994 [1,0,0,0,1,0|1,0,1]=4 1256 B7R1.1 CNC1=NC=CS1 AK-32595 [1,0,0,0,1,0|2,0,0]=4 1257 B7R1.1 COC1=CC=CS1 AK-60885 [1,0,0,0,1,0|2,0,0]=4 1258 B7R1.1 COC1=CNN=C1 AK200730 [1,0,0,0,1,0|2,0,0]=4 1259 B7R1.1 COC1=CSC=C1 AK-60944 [1,0,0,0,1,0|2,0,0]=4 1260 B7R1.1 COC1=NC=CS1 AK-46322 [1,0,0,0,1,0|2,0,0]=4 1261 B7R1.1 O=CC1=CC=CN1 AK-25235 [1,0,0,0,1,0|0,0,1]=3 1262 B7R1.1 O=CC1=CN=CS1 AK-39378 [1,0,0,0,1,0|1,0,0]=3 1263 B7R1.1 O=CC1=CNC=C1 AK-36182 [1,0,0,0,1,0|0,0,1]=3 1264 B7R1.1 O=CC1=CNN=C1 AK-25836 [1,0,0,0,1,0|1,0,0]=3 1265 B7R1.1 O=CC1=CNN=C1 AK158761 [1,0,0,0,1,0|1,0,0]=3 1266 B7R1.1 O=CC1=CSC=C1 AK-42964 [1,0,0,0,1,0|1,0,0]=3 1267 B7R1.1 [NH]1C=CC(=N1)C=O AK-25900 [1,0,0,0,1,0|1,0,0]=3 1268 B11R1.91 CC(NCC1=CN=CN=C1)=O AK147247 [0,0,0,0,0,2|2,0,0]=4 1269 B11R1.91 CC(\C=C\C1=CC=CC=C1)=O AK107621 [0,0,0,0,0,2|2,0,0]=4 1270 B11R1.91 O=C(O)CNC1=CC=CN=C1 AK449228 [0,0,0,0,0,2|2,0,0]=4 1271 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 AK-32864 [0,0,0,0,0,2|2,0,0]=4 1272 B11R1.91 OC(=O)COC1=NC=CC=C1 AK-78666 [0,0,0,0,0,2|2,0,0]=4