0 B13R2.57 BrCC1=CC=C2C=CC=CC2=C1 AK-48607 [0,0,0,0,0,0|2,0,0]=2 1 B13R2.57 BrCC1=CC=C2N=CC=CC2=C1 AK199207 [0,0,0,0,0,0|3,0,0]=3 2 B13R2.57 BrCC1=CC=C2N=CC=NC2=C1 AK136052 [0,0,0,0,0,0|4,0,0]=4 3 B13R2.57 BrCC1=NC2=CC=CC=C2C=C1 AK-35655 [0,0,0,0,0,0|3,0,0]=3 4 B13R2.57 C#CC1=CC=C2C=CC=CC2=C1 AK-48123 [0,0,0,0,0,0|1,0,1]=2 5 B13R2.57 C1=C(C=CC2=NC=CC=C12)C=O AK-25085 [0,0,0,0,0,0|3,0,0]=3 6 B13R2.57 C1=C(C=CC2=NC=CC=C12)CO AK-25097 [0,0,0,0,0,0|3,0,0]=3 7 B13R2.57 C1=C(NN)C=CC2=CC=CC=C12 AK-30555 [0,0,0,0,0,0|2,0,0]=2 8 B13R2.57 C1=C2C(=CC=C1)C=C(C=C2)CO AK-48971 [0,0,0,0,0,0|2,0,0]=2 9 B13R2.57 C1=NC(=CC2=C1C=CC=C2)C=O AK-24631 [0,0,0,0,0,0|3,0,0]=3 10 B13R2.57 C1=NC(=CC2=CC=CC=C12)CN AK-39317 [0,0,0,0,0,0|3,0,0]=3 11 B13R2.57 C1=NC(=CC2=CC=CC=C12)CO AK-24630 [0,0,0,0,0,0|3,0,0]=3 12 B13R2.57 COC1=CC2=C(C=C1)C=CN=C2 AK-35027 [0,0,0,0,0,0|1,0,0]=1 13 B13R2.57 COC1=CC2=C(C=C1)N=CC=C2 AK-39658 [0,0,0,0,0,0|1,0,0]=1 14 B13R2.57 COC1=CC2=C(C=CC=C2)C=C1 AK110812 [0,0,0,0,0,0|0,0,0]=0 15 B13R2.57 COC1=CC2=C(C=NC=C2)C=C1 AK-35505 [0,0,0,0,0,0|1,0,0]=1 16 B13R2.57 COC1=CC2=C(CCCN2)C=C1 AK-33930 [0,0,0,0,0,0|1,0,3]=4 17 B13R2.57 COC1=CC2=C(CNCC2)C=C1 AK-35691 [0,0,0,0,0,0|1,0,3]=4 18 B13R2.57 COC1=CC2=C(NCCC2)C=C1 AK-28743 [0,0,0,0,0,0|1,0,3]=4 19 B13R2.57 COC1=CC2=C(NCCN2)C=C1 AK142322 [0,0,0,0,0,0|2,0,2]=4 20 B13R2.57 COC1=CC2=CC=CC=C2N=C1 AK-39637 [0,0,0,0,0,0|1,0,0]=1 21 B13R2.57 COC1=CC=C2C(OCCN2)=C1 AK140716 [0,0,0,0,0,0|2,0,2]=4 22 B13R2.57 COC1=CC=C2C=CC=NC2=C1 AK-35323 [0,0,0,0,0,0|1,0,0]=1 23 B13R2.57 COC1=NC2=CC=CC=C2C=C1 AK-94453 [0,0,0,0,0,0|1,0,0]=1 24 B13R2.57 ClCC1=CC2=C(C=N1)C=CC=C2 AK-47007 [0,0,0,0,0,0|3,0,0]=3 25 B13R2.57 ClCC1=CC2=C(C=N1)C=CC=C2 AK-47121 [0,0,0,0,0,0|3,0,0]=3 26 B13R2.57 ClCC1=NC2=CC=CC=C2C=C1 AK-77406 [0,0,0,0,0,0|3,0,0]=3 27 B13R2.57 N#CC1=CC2=C(C=C1)C=CN=C2 AK-54885 [0,0,0,0,0,0|3,0,0]=3 28 B13R2.57 N#CC1=CC2=C(C=C1)C=NC=C2 AK-74313 [0,0,0,0,0,0|3,0,0]=3 29 B13R2.57 N#CC1=CC2=C(C=N1)C=CC=C2 AK-34461 [0,0,0,0,0,0|3,0,0]=3 30 B13R2.57 N1=CC=CC2=CC(=CC=C12)C#N AK-25091 [0,0,0,0,0,0|3,0,0]=3 31 B13R2.57 N1=CC=NC2=CC(=CC=C12)C=O AK-25353 [0,0,0,0,0,0|4,0,0]=4 32 B13R2.57 NCC1=CC2=C(C=CC=C2)C=C1 AK-33985 [0,0,0,0,0,0|2,0,0]=2 33 B13R2.57 NCC1=CC2=C(C=N1)C=CC=C2 AK162840 [0,0,0,0,0,0|3,0,0]=3 34 B13R2.57 NCC1=CC=C2C=CC=CC2=C1 AK-49046 [0,0,0,0,0,0|2,0,0]=2 35 B13R2.57 NCC1=CC=C2N=CC=CC2=C1 AK-24967 [0,0,0,0,0,0|3,0,0]=3 36 B13R2.57 NNC1=CC2=C(C=CC=C2)N=C1 AK-82067 [0,0,0,0,0,0|3,0,0]=3 37 B13R2.57 NNC1=CC=C2C=CC=NC2=C1 AK123011 [0,0,0,0,0,0|3,0,0]=3 38 B13R2.57 O=CC1=CC2=CC=CC=C2N=C1 AK-30242 [0,0,0,0,0,0|3,0,0]=3 39 B13R2.57 O=CC1=NC2=C(C=CC=C2)N=C1 AK-25470 [0,0,0,0,0,0|4,0,0]=4 40 B13R2.57 OCC1=CC2=C(C=C1)N=CC=N2 AK110758 [0,0,0,0,0,0|4,0,0]=4 41 B13R2.57 OCC1=CC2=NC=CC=C2N=C1 AK470825 [0,0,0,0,0,0|4,0,0]=4 42 B12R2.24 BrC1=CC2=C(C=NN=C2)C=C1 AK-24147 [1,0,0,0,0,0|3,0,0]=4 43 B12R2.24 BrC1=CC2=CC=CC=C2C=N1 AK-23692 [1,0,0,0,0,0|2,0,0]=3 44 B12R2.24 BrC1=CC2=CC=CC=C2N=C1 AK-27162 [1,0,0,0,0,0|2,0,0]=3 45 B12R2.24 BrC1=CC2=CC=CC=C2N=N1 AK-87992 [1,0,0,0,0,0|3,0,0]=4 46 B12R2.24 BrC1=CC2=CC=NN=C2C=C1 AK-43221 [1,0,0,0,0,0|3,0,0]=4 47 B12R2.24 BrC1=CC2=NC=CC=C2N=C1 AK-49506 [1,0,0,0,0,0|3,0,0]=4 48 B12R2.24 BrC1=CC2=NN=CC=C2C=C1 AK134736 [1,0,0,0,0,0|3,0,0]=4 49 B12R2.24 BrC1=CC=C2C(=C1)C=NC=C2 AK-26157 [1,0,0,0,0,0|2,0,0]=3 50 B12R2.24 BrC1=CC=C2C=CC=NC2=C1 AK-26028 [1,0,0,0,0,0|2,0,0]=3 51 B12R2.24 BrC1=CC=C2N=CC=NC2=C1 AK-26679 [1,0,0,0,0,0|3,0,0]=4 52 B12R2.24 BrC1=NC2=CC=CC=C2N=C1 AK-31792 [1,0,0,0,0,0|3,0,0]=4 53 B12R2.24 BrC1=NC2=CN=CC=C2C=C1 AK-78425 [1,0,0,0,0,0|3,0,0]=4 54 B12R2.24 C1=C(Br)C=CC2=C1C=CN=C2 AK-23508 [1,0,0,0,0,0|2,0,0]=3 55 B12R2.24 C1=C(Br)C=CC2=CN=CN=C12 AK-23873 [1,0,0,0,0,0|3,0,0]=4 56 B12R2.24 C1=C(Br)C=CC2=NC=NC=C12 AK-23857 [1,0,0,0,0,0|3,0,0]=4 57 B12R2.24 C1=C(C=C2C(=C1)N=CC=C2)Cl AK-26786 [1,0,0,0,0,0|2,0,0]=3 58 B12R2.24 C1=C(F)C=CC2=C1C=CC=N2 AK-30337 [1,0,0,0,0,0|2,0,0]=3 59 B12R2.24 C1=C(N)C=CC2=C1N=CC=C2 AK-23984 [1,0,0,0,0,0|2,0,0]=3 60 B12R2.24 C1=C(N)N=CC2=CC=CC=C12 AK-27774 [1,0,0,0,0,0|2,0,0]=3 61 B12R2.24 C1=C(O)C=CC2=NC=CC=C12 AK-26149 [1,0,0,0,0,0|1,0,0]=2 62 B12R2.24 C1=C2C(=CC=C1Br)C=CC=C2 AK-35732 [1,0,0,0,0,0|1,0,0]=2 63 B12R2.24 C1=C2C(=NC=C1Cl)C=CC=C2 AK-39638 [1,0,0,0,0,0|2,0,0]=3 64 B12R2.24 C1=C2C(=NC=C1O)C=CC=C2 AK-26151 [1,0,0,0,0,0|1,0,0]=2 65 B12R2.24 C1=CC(=CC2=C1C=CC=N2)Cl AK-39660 [1,0,0,0,0,0|2,0,0]=3 66 B12R2.24 C1=CC2=C(N=C1N)C=CC=C2 AK-26798 [1,0,0,0,0,0|2,0,0]=3 67 B12R2.24 C1=CC=C2C(=N1)C=CC(=C2)Br AK-26082 [1,0,0,0,0,0|2,0,0]=3 68 B12R2.24 C1=CC=CC2=CC=C(N=C12)Br AK-24234 [1,0,0,0,0,0|2,0,0]=3 69 B12R2.24 C1=CC=CC2=CC=C(N=C12)Cl AK-27768 [1,0,0,0,0,0|2,0,0]=3 70 B12R2.24 C1=NC(=NC2=C1C=CC=C2)Cl AK-27695 [1,0,0,0,0,0|3,0,0]=4 71 B12R2.24 C1=NC=CC2=CC=C(C=C12)N AK-25639 [1,0,0,0,0,0|2,0,0]=3 72 B12R2.24 CC1=CC2=CC=CC=C2N=C1 AK-72496 [1,0,0,0,0,0|1,0,0]=2 73 B12R2.24 CC1=NC2=NC=CC=C2C=C1 AK-44284 [1,0,0,0,0,0|2,0,0]=3 74 B12R2.24 ClC1=CC2=C(C=C1)C=CN=C2 AK-39352 [1,0,0,0,0,0|2,0,0]=3 75 B12R2.24 ClC1=CC2=C(C=NC=C2)C=C1 AK-35918 [1,0,0,0,0,0|2,0,0]=3 76 B12R2.24 ClC1=CC2=CC=CC=C2C=N1 AK-24474 [1,0,0,0,0,0|2,0,0]=3 77 B12R2.24 ClC1=CC=C2C=CC=NC2=N1 AK-28846 [1,0,0,0,0,0|3,0,0]=4 78 B12R2.24 ClC1=CN=C2N=CC=CC2=C1 AK-48179 [1,0,0,0,0,0|3,0,0]=4 79 B12R2.24 ClC1=NC2=CC=CC=C2N=C1 AK-47004 [1,0,0,0,0,0|3,0,0]=4 80 B12R2.24 ClC1=NC2=CC=CN=C2C=C1 AK-38087 [1,0,0,0,0,0|3,0,0]=4 81 B12R2.24 FC1=CC2=C(C=CN=C2)C=C1 AK-54877 [1,0,0,0,0,0|2,0,0]=3 82 B12R2.24 FC1=CC2=C(C=NC=C2)C=C1 AK-47714 [1,0,0,0,0,0|2,0,0]=3 83 B12R2.24 IC1=CC2=C(C=CC=C2)C=C1 AK110894 [1,0,0,0,0,0|1,0,0]=2 84 B12R2.24 IC1=CC=C2N=CC=CC2=C1 AK-28766 [1,0,0,0,0,0|2,0,0]=3 85 B12R2.24 IC1=CC=C2N=CC=NC2=C1 AK155419 [1,0,0,0,0,0|3,0,0]=4 86 B12R2.24 IC1=CC=C2N=CN=CC2=C1 AK-23974 [1,0,0,0,0,0|3,0,0]=4 87 B12R2.24 NC1=CC=C2C=CC=NC2=C1 AK173105 [1,0,0,0,0,0|2,0,0]=3 88 B12R2.24 NC1=CC=C2C=NC=CC2=C1 AK-27243 [1,0,0,0,0,0|2,0,0]=3 89 B12R2.24 NC1=CC=C2C=NC=NC2=C1 AK109813 [1,0,0,0,0,0|3,0,0]=4 90 B12R2.24 NC1=CC=C2N=CC=CC2=C1 AK-29433 [1,0,0,0,0,0|2,0,0]=3 91 B12R2.24 NC1=CC=C2N=CC=NC2=C1 AK-94067 [1,0,0,0,0,0|3,0,0]=4 92 B12R2.24 NC1=NC2=C(C=CC=C2)N=C1 AK-30450 [1,0,0,0,0,0|3,0,0]=4 93 B12R2.24 NC1=NC2=CC=CC=C2C=N1 AK-24681 [1,0,0,0,0,0|3,0,0]=4 94 B12R2.24 NC1=NC2=CC=CN=C2C=C1 AK-33784 [1,0,0,0,0,0|3,0,0]=4 95 B12R2.24 NC1=NC2=NC=CC=C2C=C1 AK-60468 [1,0,0,0,0,0|3,0,0]=4 96 B12R2.24 O=C1NC2=CC=CN=C2C=C1 AK-38086 [1,0,0,0,0,0|2,0,1]=4 97 B12R2.24 O=C1NC2=CN=CC=C2C=C1 AK-40195 [1,0,0,0,0,0|2,0,1]=4 98 B12R2.24 OC1=CC2=C(C=NC=C2)C=C1 AK-24368 [1,0,0,0,0,0|1,0,0]=2 99 B12R2.24 OC1=CC=C2C=CC=NC2=C1 AK-24768 [1,0,0,0,0,0|1,0,0]=2 100 B12R2.24 OC1=CC=C2N=CC=NC2=C1 AK112533 [1,0,0,0,0,0|2,0,0]=3 101 B12R2.24 OC1=NC2=C(C=CC=C2)C=C1 AK100046 [1,0,0,0,0,0|1,0,0]=2 102 B12R2.24 OC1=NC2=C(C=CC=C2)N=C1 AK-28738 [1,0,0,0,0,0|2,0,0]=3 103 B14R2.92 COC1=C(Br)C2=C(C=CC=C2)C=C1 AK-61767 [0,1,0,0,0,0|0,0,0]=1 104 B14R2.92 COC1=CC=C2C=CC=NC2=C1Br AK-39623 [0,1,0,0,0,0|1,0,0]=2 105 B14R2.92 N#CC1=CC=C2C=CC=CC2=C1N AK198913 [0,1,0,0,0,0|2,0,0]=3 106 B14R2.92 O=CC1=CC=C2C=CC=CC2=C1Br AK309830 [0,1,0,0,0,0|2,0,0]=3 107 B14R2.92 O=CC1=COC2=CC=CC=C2C1=O AK-60932 [0,1,0,0,0,0|3,0,0]=4 108 B14R2.112 C1=CC(=NC2=C1C=CC=C2)CCO AK-28366 [0,1,0,0,0,0|2,0,0]=3 109 B14R2.112 CNCC1=CC=C2C=CC=CC2=C1 AK115895 [0,1,0,0,0,0|1,0,0]=2 110 B14R2.112 NCCC1=CC=C2C=CC=CC2=C1 AK-79279 [0,1,0,0,0,0|1,0,0]=2 111 B14R2.134 CC1=CC2=C(C=N1)C=CC(OC)=C2 AK141571 [0,1,0,0,0,0|1,0,0]=2 112 B14R2.134 COC1=CC2=C(C=C1)C=NC(=O)C2 AK-89477 [0,1,0,0,0,0|1,0,1]=3 113 B14R2.134 COC1=CC=C2C=CC(C)=NC2=C1 AK101790 [0,1,0,0,0,0|1,0,0]=2 114 B14R2.134 COC1=CC=C2N=CC(Br)=CC2=C1 AK-37986 [0,1,0,0,0,0|1,0,0]=2 115 B14R2.134 COC1=NC2=CC(Br)=CC=C2C=C1 AK120135 [0,1,0,0,0,0|1,0,0]=2 116 B14R2.134 N#CC1=CC2=CC(Br)=CC=C2N=C1 AK138454 [0,1,0,0,0,0|3,0,0]=4 117 B14R2.134 N#CC1=CC=C2C=CC(O)=CC2=C1 AK-57326 [0,1,0,0,0,0|2,0,0]=3 118 B14R2.134 O=C1CC2=C(C=CC(OC)=C2)CC1 AK-25949 [0,1,0,0,0,0|0,0,3]=4 119 B14R2.134 O=C1NC2=C(C=CC(OC)=C2)CC1 AK-76141 [0,1,0,0,0,0|1,0,2]=4 120 B14R2.142 C1=C(OC)C=CC2=C1C(CCC2)=O AK-26255 [0,1,0,0,0,0|0,0,3]=4 121 B14R2.142 COC1=CC=C2N=CC=C(Cl)C2=C1 AK-25214 [0,1,0,0,0,0|1,0,0]=2 122 B14R2.142 COC1=NC2=C(Br)C=CN=C2C=C1 AK126152 [0,1,0,0,0,0|2,0,0]=3 123 B14R2.142 COC1=NC2=C(Cl)C=CN=C2C=C1 AK-39909 [0,1,0,0,0,0|2,0,0]=3 124 B14R2.142 ClC1=NC=NC2=CC=C(C=C12)OC AK-26698 [0,1,0,0,0,0|2,0,0]=3 125 B14R2.142 N#CC1=CC=C2N=CC=C(Br)C2=C1 AK-27675 [0,1,0,0,0,0|3,0,0]=4 126 B14R2.142 O=C1C=CNC2=C1C=C(OC)C=C2 AK-51079 [0,1,0,0,0,0|1,0,0]=2 127 B14R2.142 O=C1CCOC2=C1C=C(OC)C=C2 AK-50839 [0,1,0,0,0,0|1,0,2]=4 128 B14R2.142 O=C1NCCC2=C1C=C(OC)C=C2 AK-68685 [0,1,0,0,0,0|1,0,2]=4 129 B14R2.142 OC1=C2C=C(OC)C=CC2=NC=N1 AK-26701 [0,1,0,0,0,0|2,0,0]=3 130 B14R2.142 OC1=C2N=C(C=O)C=CC2=CC=C1 AK-25425 [0,1,0,0,0,0|3,0,0]=4 131 B14R2.142 OC1=CC=NC2=CC=C(OC)C=C12 AK-26934 [0,1,0,0,0,0|1,0,0]=2 132 B14R2.781 C1=C([N+](=O)[O-])C=CC2=NC=CC=C12 AK-30062 [0,1,0,0,0,0|3,0,0]=4 133 B14R2.781 C1=C([N+]([O-])=O)C=CC2=C1N=CC=C2 AK-23983 [0,1,0,0,0,0|3,0,0]=4 134 B14R2.781 C1=C2C(=CN=C1C(O)=O)C=CC=C2 AK-26235 [0,1,0,0,0,0|3,0,0]=4 135 B14R2.781 C1=CC2=C(C=C(C=C2)C(=O)O)N=C1 AK-28074 [0,1,0,0,0,0|3,0,0]=4 136 B14R2.781 C1=CC2=C(C=C1)C=C(C=C2)B(O)O AK-29150 [0,1,0,0,0,0|2,0,0]=3 137 B14R2.781 C1=CC=CC2=CC=C(N=C12)C(O)=O AK-29611 [0,1,0,0,0,0|3,0,0]=4 138 B14R2.781 CC(C1=CC=C2C=CC=CC2=C1)=O AK-41057 [0,1,0,0,0,0|1,0,0]=2 139 B14R2.781 CC(C1=CC=C2N=CC=NC2=C1)=O AK141239 [0,1,0,0,0,0|3,0,0]=4 140 B14R2.781 N=C(C1=CC2=C(C=N1)C=CC=C2)N AK133402 [0,1,0,0,0,0|3,0,0]=4 141 B14R2.781 N=C(C1=NC2=CC=CC=C2C=C1)N AK133401 [0,1,0,0,0,0|3,0,0]=4 142 B14R2.781 O=C(C1=CC2=C(C=N1)C=CC=C2)O AK-29928 [0,1,0,0,0,0|3,0,0]=4 143 B14R2.781 O=C(C1=CC2=C(C=NC=C2)C=C1)O AK-32779 [0,1,0,0,0,0|3,0,0]=4 144 B14R2.781 O=C(C1=CC2=CC=CC=C2N=C1)O AK-26223 [0,1,0,0,0,0|3,0,0]=4 145 B14R2.781 O=C(C1=CC=C2N=CC=CC2=C1)O AK-24770 [0,1,0,0,0,0|3,0,0]=4 146 B14R2.781 O=C(N)C1=CC=C2C=CC=CC2=C1 AK126301 [0,1,0,0,0,0|2,0,0]=3 147 B14R2.781 O=C(O)C1=CC=C2C=CC=CC2=C1 AK-44143 [0,1,0,0,0,0|2,0,0]=3 148 B14R2.781 OB(C1=CC2=CC=CC=C2N=C1)O AK-33891 [0,1,0,0,0,0|3,0,0]=4 149 B14R2.781 OB(C1=CC=C2N=CC=CC2=C1)O AK-25876 [0,1,0,0,0,0|3,0,0]=4 150 B14R2.1019 COC1=CC(Cl)=C2N=CC=CC2=C1 AK-31837 [0,1,0,0,0,0|1,0,0]=2 151 B14R2.1019 COC1=CC(N)=C2N=CC=CC2=C1 AK-27173 [0,1,0,0,0,0|1,0,0]=2 152 B14R2.1128 COC1=NC2=CC=CC=C2N=C1Cl AK-53465 [0,1,0,0,0,0|2,0,0]=3 153 B14R2.1128 N#CC1=NC2=CC=CC=C2C=C1C AK112476 [0,1,0,0,0,0|3,0,0]=4 154 B14R2.1128 O=CC1=CC2=CC=CC=C2N=C1Cl AK-40038 [0,1,0,0,0,0|3,0,0]=4 155 B14R2.1128 OC1=CC2=C(C=C1OC)CCN=C2 AK-29266 [0,1,0,0,0,0|1,0,2]=4 156 B14R2.1801 CC1=CC=NC2=CC(OC)=CC=C12 AK-83171 [0,1,0,0,0,0|1,0,0]=2 157 B14R2.1801 CC1=CC=NC2=CC(OC)=CC=C12 AK172810 [0,1,0,0,0,0|1,0,0]=2 158 B14R2.1801 COC1=CC2=C(C=C1)C(=O)NC=C2 AK-76130 [0,1,0,0,0,0|1,0,0]=2 159 B14R2.1801 COC1=CC2=NC=CC(Cl)=C2N=C1 AK127237 [0,1,0,0,0,0|2,0,0]=3 160 B14R2.1801 COC1=CC2=NC=NC(Cl)=C2C=C1 AK-29394 [0,1,0,0,0,0|2,0,0]=3 161 B14R2.1801 COC1=CC=C2C(=O)COCC2=C1 AK-96053 [0,1,0,0,0,0|1,0,2]=4 162 B14R2.1801 COC1=CC=C2C(Cl)=CC=NC2=C1 AK-26257 [0,1,0,0,0,0|1,0,0]=2 163 B14R2.1801 O=C1C=COC2=C1C=CC(OC)=C2 AK104798 [0,1,0,0,0,0|1,0,0]=2 164 B14R2.1801 O=C1CCCC2=C1C=CC(OC)=C2 AK-25284 [0,1,0,0,0,0|0,0,3]=4 165 B14R2.1801 O=C1CCNC2=C1C=CC(OC)=C2 AK173229 [0,1,0,0,0,0|1,0,2]=4 166 B14R2.1801 O=C1CCOC2=C1C=CC(OC)=C2 AK-46430 [0,1,0,0,0,0|1,0,2]=4 167 B14R2.1801 O=C1NCCC2=C1C=CC(OC)=C2 AK-23869 [0,1,0,0,0,0|1,0,2]=4 168 B14R2.1801 OC1=C2C=CC(OC)=CC2=CC=C1 AK-81857 [0,1,0,0,0,0|0,0,0]=1 169 B14R2.2332 C(#N)C1=CC=C2C=C(C=CC2=C1)O AK-27052 [0,1,0,0,0,0|2,0,0]=3 170 B14R2.2332 C1=C2C(=CC=C1OC)C=C(Br)C=C2 AK-35398 [0,1,0,0,0,0|0,0,0]=1 171 B14R2.2332 CCC1=CC2=C(C=C1)C=C(O)C=C2 AK-33971 [0,1,0,0,0,0|1,0,0]=2 172 B14R2.2332 COC1=CC2=C(C=C1)C=C(Br)C=N2 AK-38059 [0,1,0,0,0,0|1,0,0]=2 173 B14R2.2332 COC1=CC2=C(C=C1)N=C(C)C=C2 AK-86842 [0,1,0,0,0,0|1,0,0]=2 174 B14R2.2332 COC1=CC2=C(NC(=O)CO2)C=C1 AK110584 [0,1,0,0,0,0|2,0,1]=4 175 B14R2.2332 COC1=CC=C2N=C(Cl)C=CC2=C1 AK-33182 [0,1,0,0,0,0|1,0,0]=2 176 B14R2.2332 COC1=CC=C2N=C(Cl)C=NC2=C1 AK-37322 [0,1,0,0,0,0|2,0,0]=3 177 B14R2.2332 FC1=CC2=C(C=C1)N=C(C=O)C=C2 AK-55173 [0,1,0,0,0,0|3,0,0]=4 178 B14R2.2332 N#CC1=CC2=CC=C(Br)C=C2N=C1 AK138405 [0,1,0,0,0,0|3,0,0]=4 179 B14R2.2332 NC1=CC2=CC=C(OC)C=C2N=C1 AK-37578 [0,1,0,0,0,0|1,0,0]=2 180 B14R2.2332 O=C1NC2=C(C=C(OC)C=C2)CC1 AK-30530 [0,1,0,0,0,0|1,0,2]=4 181 B14R2.2332 O=CC1=CC=C2C=C(O)C=CC2=C1 AK-23863 [0,1,0,0,0,0|2,0,0]=3 182 B14R2.2332 O=CC1=CC=C2N=C(C)C=CC2=C1 AK-26648 [0,1,0,0,0,0|3,0,0]=4 183 B14R2.2332 O=CC1=CC=C2N=C(Cl)C=CC2=C1 AK126196 [0,1,0,0,0,0|3,0,0]=4 184 B14R2.2332 OCC1=CC2=C(C=C1)C=C(Br)C=C2 AK-41145 [0,1,0,0,0,0|2,0,0]=3 185 B12R1.27 C1=C(CCC(OC)=O)C=CC=C1 AK-41212 [0,0,1,0,0,0|1,0,2]=4 186 B12R1.27 O=C(OC)COC1=CC=CC=C1 AK139324 [0,0,1,0,0,0|2,0,1]=4 187 B12R1.27 O=C(OC)\C=C\C1=CC=CC=C1 AK-93451 [0,0,1,0,0,0|1,0,0]=2 188 B12R1.71 O=CNCC1=CC=C(OC)C=C1 AK201126 [0,0,1,0,0,0|2,0,1]=4 189 B12R1.78 O=CC1=CC(OC)=CC=C1OC AK-32329 [0,0,1,0,0,0|2,0,1]=4 190 B12R1.78 O=CC1=CC=C(OC)C=C1OC AK-44026 [0,0,1,0,0,0|2,0,1]=4 191 B12R1.371 COC(=O)CC1=C(N)C=CC=C1 AK-39324 [0,0,1,0,0,0|2,0,1]=4 192 B12R1.371 COC(=O)CC1=C(O)C=CC=C1 AK-76378 [0,0,1,0,0,0|2,0,1]=4 193 B12R1.371 O=C(OC)CC1=CC=CC=C1Br AK114701 [0,0,1,0,0,0|2,0,1]=4 194 B12R1.371 O=C(OC)CC1=CC=CC=C1Cl AK-40007 [0,0,1,0,0,0|2,0,1]=4 195 B12R1.371 O=C(OC)CC1=CC=CC=C1N AK133070 [0,0,1,0,0,0|2,0,1]=4 196 B12R2.1 C1=C(C2=C(S1)C=CC=C2)C=O AK-27012 [0,0,0,0,1,0|3,0,0]=4 197 B12R2.1 C1=CC=CC2=C1[NH]C=C2C#N AK-73136 [0,0,0,0,1,0|3,0,0]=4 198 B12R2.1 N#CC1=CSC2=C1C=CC=C2 AK-80846 [0,0,0,0,1,0|3,0,0]=4 199 B12R2.1 NCC1=CNC2=C1C=CC=C2 AK-22163 [0,0,0,0,1,0|3,0,0]=4 200 B12R2.1 O=CC1=CNC2=C1C=CC=C2 AK-49824 [0,0,0,0,1,0|3,0,0]=4 201 B12R2.1 O=CC1=COC2=C1C=CC=C2 AK-35267 [0,0,0,0,1,0|3,0,0]=4 202 B12R2.32 C1=C(C#N)SC2=C1C=CC=C2 AK-29384 [0,0,0,0,1,0|3,0,0]=4 203 B12R2.32 C1=C(OC2=C1C=CC=C2)C#N AK-23549 [0,0,0,0,1,0|3,0,0]=4 204 B12R2.32 CCC1=CC2=C(N1)C=CC=C2 AK-29204 [0,0,0,0,1,0|2,0,0]=3 205 B12R2.32 CCC1=NC2=CC=CC=C2N1 AK-31912 [0,0,0,0,1,0|3,0,0]=4 206 B12R2.32 CCC1=NC2=CC=CC=C2O1 AK551044 [0,0,0,0,1,0|3,0,0]=4 207 B12R2.32 CNC1=NC2=C(N1)C=CC=C2 AK-95284 [0,0,0,0,1,0|3,0,0]=4 208 B12R2.32 CSC1=NC2=C(S1)C=CC=C2 AK111081 [0,0,0,0,1,0|2,1,0]=4 209 B12R2.32 CSC1=NC2=CC=CC=C2O1 AK108390 [0,0,0,0,1,0|2,1,0]=4 210 B12R2.32 N#CC=1NC2=C(C1)C=CC=C2 AK123403 [0,0,0,0,1,0|3,0,0]=4 211 B12R2.32 NCC=1NC2=C(C1)C=CC=C2 AK-27799 [0,0,0,0,1,0|3,0,0]=4 212 B12R2.32 O=CC1=CC2=CC=CC=C2O1 AK-25961 [0,0,0,0,1,0|3,0,0]=4 213 B12R2.32 OCC1=CC2=CC=CC=C2S1 AK-48826 [0,0,0,0,1,0|3,0,0]=4 214 B12R2.32 OCC=1NC2=C(C1)C=CC=C2 AK-86119 [0,0,0,0,1,0|3,0,0]=4 215 B12R2.32 S1C(=CC2=C1C=CC=C2)C=O AK-42941 [0,0,0,0,1,0|3,0,0]=4 216 B12R2.44 C1=C(C#N)C=CC2=C1C=C[NH]2 AK-32216 [0,0,0,0,1,0|3,0,0]=4 217 B12R2.44 C1=C(C#N)C=CC2=C1[NH]C=C2 AK-27644 [0,0,0,0,1,0|3,0,0]=4 218 B12R2.44 C1=C(C=C2C(=C1)C=C[NH]2)OC AK-16433 [0,0,0,0,1,0|1,0,0]=2 219 B12R2.44 CNC1=CC=C2C(NC=C2)=N1 AK158150 [0,0,0,0,1,0|3,0,0]=4 220 B12R2.44 COC1=CC2=C(C=C1)CCN2 AK-29279 [0,0,0,0,1,0|1,0,2]=4 221 B12R2.44 COC1=CC2=C(CNC2)C=C1 AK-37538 [0,0,0,0,1,0|1,0,2]=4 222 B12R2.44 COC1=CC2=C(NC=C2)C=C1 AK-45962 [0,0,0,0,1,0|1,0,0]=2 223 B12R2.44 COC1=CC2=C(NC=C2)C=N1 AK165287 [0,0,0,0,1,0|2,0,0]=3 224 B12R2.44 COC1=CC2=C(NCC2)C=C1 AK-34134 [0,0,0,0,1,0|1,0,2]=4 225 B12R2.44 COC1=CC=2NC=CC2C=N1 AK-59581 [0,0,0,0,1,0|2,0,0]=3 226 B12R2.44 COC1=CC=C2C(=C1)[NH]N=C2 AK-23867 [0,0,0,0,1,0|2,0,0]=3 227 B12R2.44 COC1=CC=C2C=CCC2=C1 AK-99957 [0,0,0,0,1,0|0,0,1]=2 228 B12R2.44 COC1=CC=C2C=COC2=C1 AK103188 [0,0,0,0,1,0|1,0,0]=2 229 B12R2.44 COC1=CC=C2N=CSC2=C1 AK-24193 [0,0,0,0,1,0|2,0,0]=3 230 B12R2.44 COC1=CC=C2NN=NC2=C1 AK126169 [0,0,0,0,1,0|3,0,0]=4 231 B12R2.44 COC1=CN2C(C=C1)=NC=C2 AK-93100 [0,0,0,0,1,0|2,0,0]=3 232 B12R2.44 COC1=CN=C2[NH]C=CC2=C1 AK-24543 [0,0,0,0,1,0|2,0,0]=3 233 B12R2.44 N#CC1=CC=C2OC=CC2=C1 AK-36397 [0,0,0,0,1,0|3,0,0]=4 234 B12R2.44 O=CC1=CC2=C(C=C1)C=CN2 AK-45716 [0,0,0,0,1,0|3,0,0]=4 235 B12R2.44 O=CC1=CC2=C(NC=C2)C=C1 AK-45714 [0,0,0,0,1,0|3,0,0]=4 236 B12R2.44 O=CC1=CC=C2C=CSC2=C1 AK127851 [0,0,0,0,1,0|3,0,0]=4 237 B12R2.44 O=CC1=CC=C2OC=CC2=C1 AK-28461 [0,0,0,0,1,0|3,0,0]=4 238 B11R1.91 CC(\C=C\C1=CC=CC=C1)=O AK107621 [1,0,1,0,0,0|1,0,0]=3 239 B11R1.91 O=C(N)\C=C\C1=CC=CC=C1 AK112937 [1,0,1,0,0,0|1,0,1]=4 240 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 AK114507 [1,0,1,0,0,0|1,0,0]=3 241 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 AK-32864 [1,0,1,0,0,0|2,0,0]=4 242 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 AK-35529 [1,0,1,0,0,0|2,0,0]=4 243 B11R1.91 [O-]C(=O)C=CC1=CC=CC=C1 AK104134 [1,0,1,0,0,0|1,0,1]=4 244 B11R1.1 O=C\C=C\C1=CC=C(C)C=C1 AK101325 [1,0,1,0,0,0|1,0,0]=3 245 B11R1.1 O=C\C=C\C1=CC=C(Cl)C=C1 AK128976 [1,0,1,0,0,0|2,0,0]=4 246 B11R1.1 O=C\C=C\C1=CC=C(O)C=C1 AK131808 [1,0,1,0,0,0|1,0,0]=3 247 B11R1.1 O=C\C=C\C1=CC=C(O)C=C1 AK316818 [1,0,1,0,0,0|1,0,0]=3 248 B11R1.83 COC1=CC=C(C=CC)C=C1 AK111252 [1,0,1,0,0,0|0,0,1]=3 249 B11R1.83 C\C=C\C1=CC=C(OC)C=C1 AK-93416 [1,0,1,0,0,0|0,0,1]=3 250 B11R1.83 O=CCC1=CC=C(OC)C=C1 AK-44388 [1,0,1,0,0,0|1,0,1]=4 251 B11R1.279 BrC1=C(C=O)C=CC(=C1)OC AK-35147 [1,0,1,0,0,0|2,0,0]=4 252 B11R1.279 C1=C(C(=CC=C1OC)C=O)C AK-35468 [1,0,1,0,0,0|1,0,1]=4 253 B11R1.279 C1=C(C=CC(=C1F)C=O)OC AK-27171 [1,0,1,0,0,0|2,0,0]=4 254 B11R1.279 C1=C(C=CC(=C1O)C=O)OC AK-26247 [1,0,1,0,0,0|2,0,0]=4 255 B11R1.279 ClC1=C(C=O)C=CC(=C1)OC AK-64556 [1,0,1,0,0,0|2,0,0]=4 256 B11R1.280 O=CC1=CC(OC)=CC=C1Br AK-28118 [1,0,1,0,0,0|2,0,0]=4 257 B11R1.280 O=CC1=CC(OC)=CC=C1Cl AK114432 [1,0,1,0,0,0|2,0,0]=4 258 B11R1.280 O=CC1=CC(OC)=CC=C1O AK-87163 [1,0,1,0,0,0|2,0,0]=4 259 B11R1.40 C=CC(NC1=CC=CC=C1)=O AK122185 [1,0,1,0,0,0|1,0,1]=4 260 B11R1.40 O=C(OC)CC1=CC=CC=C1 AK163377 [1,0,1,0,0,0|1,0,1]=4 261 B11R1.40 O=C(OC)OC1=CC=CC=C1 AK600729 [1,0,1,0,0,0|2,0,0]=4 262 B11R2.20 C12=CC=NC=C1N=CC=C2 AK-65141 [2,0,0,0,0,0|2,0,0]=4 263 B11R2.20 C12=CN=CC=C1N=CC=C2 AK-47050 [2,0,0,0,0,0|2,0,0]=4 264 B11R2.20 C12=NC=CC=C1N=CC=C2 AK-39624 [2,0,0,0,0,0|2,0,0]=4 265 B11R2.20 C1=C2C(=NC=C1)N=CC=C2 AK-34374 [2,0,0,0,0,0|2,0,0]=4 266 B11R2.20 C1=C2C(=NC=N1)C=CC=C2 AK-46565 [2,0,0,0,0,0|2,0,0]=4 267 B11R2.20 C1=CC=C2N=NC=CC2=C1 AK-64450 [2,0,0,0,0,0|2,0,0]=4 268 B11R2.20 C1=CC=CC2=NC=CN=C12 AK-51744 [2,0,0,0,0,0|2,0,0]=4 269 B13R1.14 COC(=O)/C=C/C1=CC=C(O)C=C1 AK109487 [0,1,1,0,0,0|1,0,0]=3 270 B13R1.14 O=C(OC)\C=C\C1=CC=C(Br)C=C1 AK117162 [0,1,1,0,0,0|1,0,0]=3 271 B13R1.14 O=C(OC)\C=C\C1=CC=C(O)C=C1 AK-49067 [0,1,1,0,0,0|1,0,0]=3 272 B13R1.42 CCOC(=O)C=CC1=CC=NC=C1 AK-49599 [0,1,1,0,0,0|2,0,0]=4 273 B13R1.3 COC1=CC=C(C=CC(O)=O)C=C1 AK-98686 [0,1,1,0,0,0|1,0,0]=3 274 B13R1.3 O=C(O)\C=C\C1=CC=C(SC)C=C1 AK305277 [0,1,1,0,0,0|1,1,0]=4 275 B13R1.3 O=[N+](\C=C\C1=CC=C(OC)C=C1)[O-] AK677721 [0,1,1,0,0,0|2,0,0]=4 276 B13R1.696 O=C(OC)C(C1=CC=CC=C1Br)=O AK143704 [0,1,1,0,0,0|2,0,0]=4 277 B13R2.32 BrC1=C(Br)N=CC2=C1C=CC=C2 AK-49733 [1,1,0,0,0,0|2,0,0]=4 278 B13R2.32 CC1=C(N)C2=C(C=CC=C2)C=C1 AK-81542 [1,1,0,0,0,0|0,0,0]=2 279 B13R2.32 CC1=C(O)C2=C(C=CC=C2)C=C1 AK-45771 [1,1,0,0,0,0|0,0,0]=2 280 B13R2.32 CC1=C2N=CC=CC2=CC=C1Br AK-93916 [1,1,0,0,0,0|2,0,0]=4 281 B13R2.32 CC1=C2N=CC=CC2=CC=C1Cl AK-39413 [1,1,0,0,0,0|2,0,0]=4 282 B13R2.32 ClC1=C(Br)C=NC2=C1C=CC=C2 AK-36273 [1,1,0,0,0,0|2,0,0]=4 283 B13R2.32 ClC1=C(C2=CC=CC=C2C=N1)N AK-24958 [1,1,0,0,0,0|2,0,0]=4 284 B13R2.32 ClC1=CC=C2N=CC=CC2=C1N AK-26814 [1,1,0,0,0,0|2,0,0]=4 285 B13R2.32 IC1=C(Cl)C2=CC=CC=C2N=C1 AK114474 [1,1,0,0,0,0|2,0,0]=4 286 B13R2.32 NC1=C(Br)C2=C(C=NC=C2)C=C1 AK123412 [1,1,0,0,0,0|2,0,0]=4 287 B13R2.32 NC1=C(C=NC2=CC=CC=C12)Br AK-23731 [1,1,0,0,0,0|2,0,0]=4 288 B13R2.32 NC1=C(Cl)C2=C(C=NC=C2)C=C1 AK123372 [1,1,0,0,0,0|2,0,0]=4 289 B13R2.32 NC1=C(Cl)C2=CC=CC=C2N=C1 AK156251 [1,1,0,0,0,0|2,0,0]=4 290 B13R2.32 NC1=C(N=CC2=CC=CC=C12)Br AK-24957 [1,1,0,0,0,0|2,0,0]=4 291 B13R2.32 O=C1N(C)C=CC2=C1C=CC=C2 AK118859 [1,1,0,0,0,0|1,0,0]=3 292 B13R2.32 OC1=C(Br)C2=C(C=C1)C=CN=C2 AK456342 [1,1,0,0,0,0|1,0,0]=3 293 B13R2.32 OC1=C(Br)C=CC2=C1C=CC=C2 AK-32485 [1,1,0,0,0,0|1,0,0]=3 294 B13R2.32 OC1=C(C)C2=CC=CC=C2N=C1 AK131001 [1,1,0,0,0,0|1,0,0]=3 295 B13R2.32 OC1=C(F)C=CC2=C1N=CC=C2 AK-89047 [1,1,0,0,0,0|2,0,0]=4 296 B13R2.32 OC1=C(I)C=NC2=CC=CC=C12 AK146195 [1,1,0,0,0,0|2,0,0]=4 297 B13R2.32 OC1=C2N=CC=CC2=CC=C1Br AK-57321 [1,1,0,0,0,0|2,0,0]=4 298 B13R2.32 OC1=CC=C2C=CC=CC2=C1Br AK-75886 [1,1,0,0,0,0|0,0,0]=2 299 B13R2.32 OC1=CC=C2C=CC=CC2=C1Cl AK405288 [1,1,0,0,0,0|0,0,0]=2 300 B13R2.32 OC1=CC=C2C=CC=NC2=C1Br AK-39661 [1,1,0,0,0,0|1,0,0]=3 301 B13R2.32 OC1=CC=C2N=CC=CC2=C1F AK162742 [1,1,0,0,0,0|1,0,0]=3 302 B13R2.155 BrC1=CC2=CC(=CC=C2C=C1)Br AK-30563 [1,1,0,0,0,0|1,0,0]=3 303 B13R2.155 BrC1=CC=C2C(=C1)C=C(C=C2)O AK-25309 [1,1,0,0,0,0|0,0,0]=2 304 B13R2.155 C1=C(Cl)C=CC2=C1NC(=O)C=C2 AK-29018 [1,1,0,0,0,0|1,0,1]=4 305 B13R2.155 C1=CC(=CC2=C1C=CC(O2)=O)O AK-26455 [1,1,0,0,0,0|1,0,0]=3 306 B13R2.155 CC1=NC2=C(C=CC(Br)=C2)C=C1 AK111212 [1,1,0,0,0,0|1,0,0]=3 307 B13R2.155 CC1=NC2=CC(Br)=CC=C2C=N1 AK-42108 [1,1,0,0,0,0|2,0,0]=4 308 B13R2.155 CC1=NC2=CC(Cl)=CC=C2C=C1 AK-23874 [1,1,0,0,0,0|1,0,0]=3 309 B13R2.155 ClC1=CC2=C(C=N1)C=CC(Br)=C2 AK-40954 [1,1,0,0,0,0|2,0,0]=4 310 B13R2.155 ClC1=NC2=C(C=CC(Br)=C2)C=C1 AK-37014 [1,1,0,0,0,0|2,0,0]=4 311 B13R2.155 ClC1=NC2=CC(=CC=C2N=C1)C AK-26907 [1,1,0,0,0,0|2,0,0]=4 312 B13R2.155 FC1=CC2=C(C=NC(Cl)=C2)C=C1 AK310526 [1,1,0,0,0,0|2,0,0]=4 313 B13R2.155 IC1=CC=C2N=CC(Br)=CC2=C1 AK127010 [1,1,0,0,0,0|2,0,0]=4 314 B13R2.155 NC1=CC2=C(C=CC(Br)=C2)C=N1 AK-27230 [1,1,0,0,0,0|2,0,0]=4 315 B13R2.155 NC1=CC=C2N=CC(Br)=CC2=C1 AK105869 [1,1,0,0,0,0|2,0,0]=4 316 B13R2.155 NC1=NC2=CC(Br)=CC=C2C=C1 AK126950 [1,1,0,0,0,0|2,0,0]=4 317 B13R2.155 O=C1NC2=C(C=CC(Br)=C2)C=C1 AK-50291 [1,1,0,0,0,0|1,0,1]=4 318 B13R2.155 O=C1NC2=C(C=CC(N)=C2)C=C1 AK-35741 [1,1,0,0,0,0|1,0,1]=4 319 B13R2.155 O=C1NC2=C(C=CC(O)=C2)C=C1 AK-75874 [1,1,0,0,0,0|1,0,0]=3 320 B13R2.155 OC1=CC2=C(C=C1)N=CC(Br)=C2 AK-89992 [1,1,0,0,0,0|1,0,0]=3 321 B13R2.155 OC1=CC2=CC(Br)=CC=C2N=C1 AK-43231 [1,1,0,0,0,0|1,0,0]=3 322 B13R2.155 OC1=CC2=CC(O)=CC=C2C=C1 AK-45590 [1,1,0,0,0,0|0,0,0]=2 323 B13R2.155 OC1=CC=C2C=CC(N)=CC2=C1 AK470324 [1,1,0,0,0,0|0,0,0]=2 324 B13R2.155 OC1=CC=C2N=CC(I)=CC2=C1 AK138167 [1,1,0,0,0,0|1,0,0]=3 325 B13R2.155 OC1=NC2=CC(=CC=C2C=C1)O AK-26280 [1,1,0,0,0,0|1,0,0]=3 326 B13R2.155 SC1=CC=C2C=CC(S)=CC2=C1 AK325416 [1,1,0,0,0,0|0,1,0]=3 327 B13R2.162 BrC1=CC2=C(C=N1)C=CC=C2N AK-28566 [1,1,0,0,0,0|2,0,0]=4 328 B13R2.162 BrC1=CC=C2C(=C1)C(=NC=C2)N AK-27156 [1,1,0,0,0,0|2,0,0]=4 329 B13R2.162 BrC1=CC=C2N=CC=C(Br)C2=C1 AK-27673 [1,1,0,0,0,0|2,0,0]=4 330 B13R2.162 BrC1=CC=C2N=CC=C(N)C2=C1 AK-23733 [1,1,0,0,0,0|2,0,0]=4 331 B13R2.162 BrC1=CC=CC2=C1OC(C=C2)=O AK-24668 [1,1,0,0,0,0|1,0,1]=4 332 B13R2.162 BrC1=NC2=C(C=CC=C2Br)C=C1 AK103449 [1,1,0,0,0,0|2,0,0]=4 333 B13R2.162 C1=C(Br)C=CC2=C1C(=CC=N2)Cl AK-26791 [1,1,0,0,0,0|2,0,0]=4 334 B13R2.162 C1=C(F)C=CC2=C1C(=CC=N2)Cl AK-34982 [1,1,0,0,0,0|2,0,0]=4 335 B13R2.162 C1=C2C(=CC=C1Br)NC=CC2=O AK-23851 [1,1,0,0,0,0|2,0,0]=4 336 B13R2.162 C1=C2C(=NC(=C1)C)C(=CC=C2)O AK-28678 [1,1,0,0,0,0|1,0,0]=3 337 B13R2.162 C1=CC2=C(NC(C=C2)=O)C(=C1)O AK-33447 [1,1,0,0,0,0|1,0,1]=4 338 B13R2.162 C1=CC2=CC=CC(=C2N=C1C)N AK-28486 [1,1,0,0,0,0|1,0,0]=3 339 B13R2.162 CC1=C2N=C(Cl)C=CC2=CC=C1 AK-93928 [1,1,0,0,0,0|2,0,0]=4 340 B13R2.162 CC1=CC2=C(C=C1)N=CC=C2O AK-37001 [1,1,0,0,0,0|1,0,0]=3 341 B13R2.162 CC1=CC2=C(C=CN=C2Cl)C=C1 AK-49595 [1,1,0,0,0,0|1,0,0]=3 342 B13R2.162 CC1=CC2=C(Cl)N=CN=C2C=C1 AK-32508 [1,1,0,0,0,0|2,0,0]=4 343 B13R2.162 CC1=CC=C2N=CN=C(O)C2=C1 AK-89062 [1,1,0,0,0,0|2,0,0]=4 344 B13R2.162 CC1=CC=NC2=C1C=C(Br)C=C2 AK-26620 [1,1,0,0,0,0|2,0,0]=4 345 B13R2.162 CC1=NC2=C(Br)C=CC=C2C=C1 AK-31867 [1,1,0,0,0,0|1,0,0]=3 346 B13R2.162 CC1=NC2=C(C=CC=C2C)C=C1 AK111198 [1,1,0,0,0,0|1,0,0]=3 347 B13R2.162 ClC1=C2N=C(Cl)C=CC2=CC=C1 AK-54989 [1,1,0,0,0,0|2,0,0]=4 348 B13R2.162 ClC1=CC2=C(C=C1)C=CN=C2Cl AK-27155 [1,1,0,0,0,0|2,0,0]=4 349 B13R2.162 ClC1=CC=NC2=C1C=C(I)C=C2 AK-30375 [1,1,0,0,0,0|2,0,0]=4 350 B13R2.162 ClC1=NC2=C(Br)C=CC=C2C=C1 AK-33570 [1,1,0,0,0,0|2,0,0]=4 351 B13R2.162 ClC1=NC=CC2=C1C=C(Br)C=C2 AK-26804 [1,1,0,0,0,0|2,0,0]=4 352 B13R2.162 IC1=CC=C2N=CC=C(O)C2=C1 AK-25798 [1,1,0,0,0,0|2,0,0]=4 353 B13R2.162 IC1=CC=NC2=CC=C(Br)C=C12 AK-31900 [1,1,0,0,0,0|2,0,0]=4 354 B13R2.162 NC1=C2C=C(C)C=CC2=CC=C1 AK150342 [1,1,0,0,0,0|0,0,0]=2 355 B13R2.162 NC1=CC=CC2=C1C=C(Cl)N=C2 AK-24676 [1,1,0,0,0,0|2,0,0]=4 356 B13R2.162 NC1=NC2=C(Br)C=CC=C2C=C1 AK164599 [1,1,0,0,0,0|2,0,0]=4 357 B13R2.162 O=C1C=CNC2=C1C=C(Br)C=C2 AK-88673 [1,1,0,0,0,0|2,0,0]=4 358 B13R2.162 O=C1NC2=C(C=CC=C2F)C=C1 AK-94444 [1,1,0,0,0,0|1,0,1]=4 359 B13R2.162 OC1=C2C=C(Br)C=NC2=CC=C1 AK-65356 [1,1,0,0,0,0|2,0,0]=4 360 B13R2.162 OC1=C2C=C(F)C=CC2=CC=C1 AK542365 [1,1,0,0,0,0|1,0,0]=3 361 B13R2.162 OC1=C2C=C(F)C=NC2=CC=C1 AK164644 [1,1,0,0,0,0|2,0,0]=4 362 B13R2.162 OC1=C2N=C(Br)C=CC2=CC=C1 AK145826 [1,1,0,0,0,0|2,0,0]=4 363 B13R2.162 OC1=C2N=C(Cl)C=CC2=CC=C1 AK112608 [1,1,0,0,0,0|2,0,0]=4 364 B13R2.162 OC1=CC2=C(C=CC=C2F)C=C1 AK-39811 [1,1,0,0,0,0|0,0,0]=2 365 B13R2.162 OC1=CC2=C(C=CN=C2Cl)C=C1 AK105080 [1,1,0,0,0,0|1,0,0]=3 366 B13R2.162 OC1=CC=C2N=CC=C(Cl)C2=C1 AK-37757 [1,1,0,0,0,0|1,0,0]=3 367 B13R2.162 OC1=CC=NC2=CC=C(Cl)C=C12 AK-25633 [1,1,0,0,0,0|2,0,0]=4 368 B13R2.162 OC1=CN=CC2=C1C=C(Br)C=C2 AK123454 [1,1,0,0,0,0|2,0,0]=4 369 B13R2.162 OC1=NC2=C(Cl)C=CC=C2C=C1 AK-32524 [1,1,0,0,0,0|1,0,0]=3 370 B13R2.162 OC1=NC=CC2=C1C=C(Cl)C=C2 AK-27154 [1,1,0,0,0,0|2,0,0]=4 371 B13R2.328 BrC1=CC(Br)=C2C=CC=NC2=C1 AK128731 [1,1,0,0,0,0|2,0,0]=4 372 B13R2.328 BrC1=NC(=CC2=CC=CC=C12)Br AK-24473 [1,1,0,0,0,0|2,0,0]=4 373 B13R2.328 BrC1=NC2=C(C=CC=C2)C(Br)=C1 AK-72566 [1,1,0,0,0,0|2,0,0]=4 374 B13R2.328 BrC1=NC2=CC=CC=C2C(N)=C1 AK-31026 [1,1,0,0,0,0|2,0,0]=4 375 B13R2.328 C1=CC=CC2=C1N=C(N=C2C)C AK-46661 [1,1,0,0,0,0|2,0,0]=4 376 B13R2.328 CC1=CC(Br)=C2C=CC=CC2=C1 AK127805 [1,1,0,0,0,0|0,0,0]=2 377 B13R2.328 CC1=CC(Br)=NC2=CC=CC=C12 AK143362 [1,1,0,0,0,0|2,0,0]=4 378 B13R2.328 CC1=CC(C)=NC2=CC=CC=C12 AK-54599 [1,1,0,0,0,0|1,0,0]=3 379 B13R2.328 CC1=CC(Cl)=C2N=CC=CC2=C1 AK101791 [1,1,0,0,0,0|1,0,0]=3 380 B13R2.328 CC1=CC(Cl)=NC2=C1C=CC=C2 AK-74209 [1,1,0,0,0,0|2,0,0]=4 381 B13R2.328 CC1=NC2=CC=CC=C2C(Br)=C1 AK-94090 [1,1,0,0,0,0|1,0,0]=3 382 B13R2.328 ClC1=C2N=CC=CC2=CC(Br)=C1 AK-93902 [1,1,0,0,0,0|2,0,0]=4 383 B13R2.328 ClC1=CC(Cl)=C2C=CC=NC2=C1 AK-93797 [1,1,0,0,0,0|2,0,0]=4 384 B13R2.328 ClC1=CC2=C(C(Cl)=N1)C=CC=C2 AK-28004 [1,1,0,0,0,0|2,0,0]=4 385 B13R2.328 ClC1=NC(=NC2=CC=CC=C12)C AK-30091 [1,1,0,0,0,0|2,0,0]=4 386 B13R2.328 ClC1=NC2=C(C=CC=C2)C(Cl)=C1 AK-36160 [1,1,0,0,0,0|2,0,0]=4 387 B13R2.328 FC1=C2N=CC=CC2=CC(Br)=C1 AK-93909 [1,1,0,0,0,0|2,0,0]=4 388 B13R2.328 IC1=CC(Cl)=C2N=CC=CC2=C1 AK101760 [1,1,0,0,0,0|2,0,0]=4 389 B13R2.328 NC1=C2N=CC=CC2=CC(Cl)=C1 AK-31839 [1,1,0,0,0,0|2,0,0]=4 390 B13R2.328 NC1=CC(C)=NC2=CC=CC=C12 AK-32600 [1,1,0,0,0,0|1,0,0]=3 391 B13R2.328 NC1=CC(Cl)=NC2=C1C=CC=C2 AK-31025 [1,1,0,0,0,0|2,0,0]=4 392 B13R2.328 NC1=CC(NC2=CC=CC=C12)=O AK-26697 [1,1,0,0,0,0|1,0,1]=4 393 B13R2.328 NC1=NC(Cl)=CC2=C1C=CC=C2 AK147558 [1,1,0,0,0,0|2,0,0]=4 394 B13R2.328 NC1=NC2=CC=CC=C2C(Br)=C1 AK151251 [1,1,0,0,0,0|2,0,0]=4 395 B13R2.328 O=C1NC2=C(C=CC=C2)C(Br)=C1 AK-36929 [1,1,0,0,0,0|1,0,1]=4 396 B13R2.328 O=C1OC2=C(C=CC=C2)C(O)=C1 AK-49238 [1,1,0,0,0,0|1,0,1]=4 397 B13R2.328 OC1=C2C=CC=CC2=NC(C)=N1 AK-47027 [1,1,0,0,0,0|2,0,0]=4 398 B13R2.328 OC1=C2N=CC=CC2=CC(C)=C1 AK149934 [1,1,0,0,0,0|1,0,0]=3 399 B13R2.328 OC1=C2N=CC=CC2=CC(F)=C1 AK119593 [1,1,0,0,0,0|2,0,0]=4 400 B13R2.328 OC1=CC(C)=NC2=CC=CC=C12 AK499556 [1,1,0,0,0,0|1,0,0]=3 401 B13R2.328 OC1=NC(N)=C2C=CC=CC2=N1 AK-24683 [1,1,0,0,0,0|2,0,0]=4 402 B13R2.328 OC1=NC2=CC=CC=C2C(C)=C1 AK-38350 [1,1,0,0,0,0|1,0,0]=3 403 B13R2.369 BrC1=C(Br)C=C2C=CC=CC2=C1 AK-57803 [1,1,0,0,0,0|1,0,0]=3 404 B13R2.369 BrC1=NC2=CC=CC=C2C=C1Br AK-39851 [1,1,0,0,0,0|2,0,0]=4 405 B13R2.369 CC1=C(Br)C=C2C=CC=NC2=C1 AK101770 [1,1,0,0,0,0|1,0,0]=3 406 B13R2.369 CC1=NC2=CC=CC=C2C=C1N AK-30794 [1,1,0,0,0,0|1,0,0]=3 407 B13R2.369 ClC1=CC2=C(C=NC=C2)C=C1Br AK341312 [1,1,0,0,0,0|2,0,0]=4 408 B13R2.369 ClC1=CC2=CC=CC=C2N=C1Cl AK-79092 [1,1,0,0,0,0|2,0,0]=4 409 B13R2.369 FC1=C(Br)C=C2C=CC=NC2=C1 AK-41440 [1,1,0,0,0,0|2,0,0]=4 410 B13R2.369 NC1=C(C)C=C2C=CC=NC2=C1 AK435742 [1,1,0,0,0,0|1,0,0]=3 411 B13R2.369 NC1=CC2=C(C=CC=C2)C=C1N AK-50115 [1,1,0,0,0,0|1,0,0]=3 412 B13R2.369 NC1=CC2=C(C=CC=C2)C=C1O AK-96652 [1,1,0,0,0,0|0,0,0]=2 413 B13R2.369 NC1=NC2=CC=CC=C2C=C1Br AK-75962 [1,1,0,0,0,0|2,0,0]=4 414 B13R2.369 OC1=CC2=C(C=CC=C2)N=C1Cl AK-82046 [1,1,0,0,0,0|1,0,0]=3 415 B13R2.3683 BrC1=CC2=C(C=C1)C=C(Br)C=C2 AK-33188 [1,1,0,0,0,0|1,0,0]=3 416 B13R2.3683 BrC1=CC=C2C(=C1)C=NC(=C2)N AK-24946 [1,1,0,0,0,0|2,0,0]=4 417 B13R2.3683 BrC1=CC=C2N=C(C=NC2=C1)O AK-27835 [1,1,0,0,0,0|2,0,0]=4 418 B13R2.3683 C1=C(Br)C=CC2=C1C=CC(O2)=O AK-26888 [1,1,0,0,0,0|1,0,1]=4 419 B13R2.3683 C1=C(C)C=CC2=C1C=CC(O2)=O AK-47577 [1,1,0,0,0,0|1,0,0]=3 420 B13R2.3683 C1=C(C=CC2=C1C=CC(=C2)Br)O AK-46757 [1,1,0,0,0,0|0,0,0]=2 421 B13R2.3683 CC1=CC2=CN=C(Cl)N=C2C=C1 AK126963 [1,1,0,0,0,0|2,0,0]=4 422 B13R2.3683 CC1=CC=C2N=C(Br)C=CC2=C1 AK-34594 [1,1,0,0,0,0|1,0,0]=3 423 B13R2.3683 CC1=NC2=C(C=C1)C=C(F)C=C2 AK-27111 [1,1,0,0,0,0|1,0,0]=3 424 B13R2.3683 CC1=NC2=CC=C(Br)C=C2C=C1 AK-26649 [1,1,0,0,0,0|1,0,0]=3 425 B13R2.3683 ClC1=CC2=C(C=C(Br)C=C2)N=C1 AK102533 [1,1,0,0,0,0|2,0,0]=4 426 B13R2.3683 ClC1=CC=C2N=C(Cl)C=CC2=C1 AK-39625 [1,1,0,0,0,0|2,0,0]=4 427 B13R2.3683 ClC1=NC2=CC=C(Br)C=C2C=C1 AK-27465 [1,1,0,0,0,0|2,0,0]=4 428 B13R2.3683 FC1=CC=C2N=C(Cl)C=CC2=C1 AK-93820 [1,1,0,0,0,0|2,0,0]=4 429 B13R2.3683 NC1=CC2=C(C=C(Cl)C=C2)N=C1 AK-49305 [1,1,0,0,0,0|2,0,0]=4 430 B13R2.3683 NC1=CC2=CC=C(Br)C=C2N=C1 AK122789 [1,1,0,0,0,0|2,0,0]=4 431 B13R2.3683 NC1=CC=C2C=C(Br)C=CC2=C1 AK-36293 [1,1,0,0,0,0|1,0,0]=3 432 B13R2.3683 NC1=CC=C2C=C(Br)C=CC2=C1 AK128775 [1,1,0,0,0,0|1,0,0]=3 433 B13R2.3683 NC1=CC=C2C=C(F)C=CC2=C1 AK128776 [1,1,0,0,0,0|1,0,0]=3 434 B13R2.3683 NC1=NC2=CC=C(F)C=C2C=C1 AK135326 [1,1,0,0,0,0|2,0,0]=4 435 B13R2.3683 O=C1NC2=C(C=C(Br)C=C2)C=C1 AK-27469 [1,1,0,0,0,0|1,0,1]=4 436 B13R2.3683 O=C1NC2=C(C=C(O)C=C2)C=C1 AK-33910 [1,1,0,0,0,0|1,0,0]=3 437 B13R2.3683 OC1=CC2=C(C=C1)C=C(O)C=C2 AK-50622 [1,1,0,0,0,0|0,0,0]=2 438 B13R2.3683 OC1=CC=C2N=C(Cl)C=CC2=C1 AK-89425 [1,1,0,0,0,0|1,0,0]=3 439 B13R2.3683 OC1=NC2=CC=C(I)C=C2C=C1 AK-51648 [1,1,0,0,0,0|1,0,0]=3 440 B13R2.3683 OC1=NC2=NC=C(Br)C=C2C=C1 AK-36230 [1,1,0,0,0,0|2,0,0]=4 441 B13R2.5179 BrC1=CC2=C(C=C1)C(Br)=CC=N2 AK111218 [1,1,0,0,0,0|2,0,0]=4 442 B13R2.5179 BrC1=CC2=CC=CC(Br)=C2C=C1 AK165083 [1,1,0,0,0,0|1,0,0]=3 443 B13R2.5179 BrC1=CC=C2C(=C1)N=CC=C2Cl AK-24980 [1,1,0,0,0,0|2,0,0]=4 444 B13R2.5179 BrC1=CC=C2C(=NC=CC2=C1)Cl AK-23848 [1,1,0,0,0,0|2,0,0]=4 445 B13R2.5179 BrC1=CC=C2C(=NC=CC2=C1)N AK-23856 [1,1,0,0,0,0|2,0,0]=4 446 B13R2.5179 BrC1=CC=C2C(NC=CC2=C1)=O AK-24813 [1,1,0,0,0,0|2,0,0]=4 447 B13R2.5179 BrC1=CC=NC2=CC(=CC=C12)Cl AK-27672 [1,1,0,0,0,0|2,0,0]=4 448 B13R2.5179 C1=CC(=CC2=CC=CC(=C12)O)O AK-47629 [1,1,0,0,0,0|0,0,0]=2 449 B13R2.5179 CC1=CC=C2C(Cl)=NC=NC2=C1 AK-76087 [1,1,0,0,0,0|2,0,0]=4 450 B13R2.5179 CC1=CC=NC2=C1C=CC(Br)=C2 AK-50401 [1,1,0,0,0,0|2,0,0]=4 451 B13R2.5179 CC1=CC=NC2=C1C=CC(N)=C2 AK-48720 [1,1,0,0,0,0|2,0,0]=4 452 B13R2.5179 CC1=NC2=C(C=C1)C(Cl)=CC=C2 AK111211 [1,1,0,0,0,0|1,0,0]=3 453 B13R2.5179 ClC1=C2C=CC(Cl)=NC2=CC=C1 AK123291 [1,1,0,0,0,0|2,0,0]=4 454 B13R2.5179 ClC1=CC2=C(C(Cl)=NC=C2)C=C1 AK-26744 [1,1,0,0,0,0|2,0,0]=4 455 B13R2.5179 ClC1=CC=NC2=CC(I)=CC=C12 AK-34183 [1,1,0,0,0,0|2,0,0]=4 456 B13R2.5179 FC1=CC2=C(C(Cl)=NC=C2)C=C1 AK311367 [1,1,0,0,0,0|2,0,0]=4 457 B13R2.5179 FC1=CC2=CC=CC(Br)=C2N=C1 AK164694 [1,1,0,0,0,0|2,0,0]=4 458 B13R2.5179 IC1=CC2=CC=CC(Cl)=C2N=C1 AK471124 [1,1,0,0,0,0|2,0,0]=4 459 B13R2.5179 NC1=C2C=CC(C)=CC2=CC=C1 AK150347 [1,1,0,0,0,0|0,0,0]=2 460 B13R2.5179 NC1=C2C=CC(C)=NC2=CC=C1 AK-81688 [1,1,0,0,0,0|1,0,0]=3 461 B13R2.5179 NC1=C2N=CC(Br)=CC2=CC=C1 AK103131 [1,1,0,0,0,0|2,0,0]=4 462 B13R2.5179 NC1=NC2=CC=CC(Cl)=C2C=C1 AK156291 [1,1,0,0,0,0|2,0,0]=4 463 B13R2.5179 O=C1C=COC2=C1C=CC(Br)=C2 AK103138 [1,1,0,0,0,0|2,0,0]=4 464 B13R2.5179 O=C1NC2=C(C(O)=CC=C2)C=C1 AK-77739 [1,1,0,0,0,0|1,0,1]=4 465 B13R2.5179 O=C1NC=CC2=C1C=CC(Cl)=C2 AK164757 [1,1,0,0,0,0|2,0,0]=4 466 B13R2.5179 O=C1NC=CC2=C1C=CC(O)=C2 AK120908 [1,1,0,0,0,0|1,0,0]=3 467 B13R2.5179 OC1=C2C=CC(F)=CC2=CC=C1 AK341304 [1,1,0,0,0,0|1,0,0]=3 468 B13R2.5179 OC1=CC2=C(C(Cl)=NC=C2)C=C1 AK315073 [1,1,0,0,0,0|1,0,0]=3 469 B13R2.5179 OC1=CC=C2C(C)=CC=NC2=C1 AK149937 [1,1,0,0,0,0|1,0,0]=3 470 B13R2.5179 OC1=CC=C2C(Cl)=CC=NC2=C1 AK-47960 [1,1,0,0,0,0|1,0,0]=3 471 B13R2.5179 OC1=CC=CC2=C1C=CC(Br)=C2 AK104878 [1,1,0,0,0,0|1,0,0]=3 472 B13R2.1 NCCC1=COC2=CC=CC=C12 AK-32065 [0,1,0,0,1,0|2,0,0]=4 473 B13R2.72 C1=CC=CC2=C1C(=C[NH]2)C(C)=O AK-47338 [0,1,0,0,1,0|2,0,0]=4 474 B13R2.135 CC=1N(CC)C2=C(C1)C=CC=C2 AK-87148 [0,1,0,0,1,0|2,0,0]=4 475 B13R2.662 CCN1C=CC2=C1C=CC(Br)=C2 AK134167 [0,1,0,0,1,0|2,0,0]=4 476 B13R2.662 COC1=NNC2=CC(Br)=CC=C12 AK100493 [0,1,0,0,1,0|2,0,0]=4 477 B13R2.2091 COC1=NNC2=CC=CC(Br)=C12 AK100492 [0,1,0,0,1,0|2,0,0]=4 478 B13R2.43 NC1=CC=C2C=C(CC)OC2=C1 AK445388 [0,1,0,0,1,0|2,0,0]=4 479 B13R2.435 C1=C(C(C)=O)SC2=C1C=CC=C2 AK-47399 [0,1,0,0,1,0|2,0,0]=4 480 B13R2.435 O=C(C=1NC2=C(C1)C=CC=C2)C AK-45604 [0,1,0,0,1,0|2,0,0]=4 481 B13R2.84 COC1=C(Br)C2=C(NC=C2)C=C1 AK144751 [0,1,0,0,1,0|1,0,0]=3 482 B13R2.84 COC1=C(Br)C=2NC=CC2C=N1 AK-59547 [0,1,0,0,1,0|2,0,0]=4 483 B13R2.430 CC(C1=CC2=C(NC=C2)C=C1)=O AK105161 [0,1,0,0,1,0|2,0,0]=4 484 B13R2.449 C1=C(C=C2C(=C1)C=C[NH]2)OCC AK-39304 [0,1,0,0,1,0|1,0,0]=3 485 B13R2.449 CCOC1=CC2=C(NC=C2)C=C1 AK-21810 [0,1,0,0,1,0|1,0,0]=3 486 B13R2.599 CC1=CC2=C(NC=C2)C=C1OC AK119790 [0,1,0,0,1,0|1,0,0]=3 487 B13R2.599 COC1=C(Br)C=C2C(NC=C2)=N1 AK-59557 [0,1,0,0,1,0|2,0,0]=4 488 B13R2.599 COC1=C(Br)C=C2C(NC=N2)=C1 AK-92884 [0,1,0,0,1,0|2,0,0]=4 489 B13R2.599 COC1=C(Br)C=C2NN=CC2=C1 AK-37717 [0,1,0,0,1,0|2,0,0]=4 490 B13R2.599 COC1=CC2=C(C=C1Br)C=NN2 AK-33422 [0,1,0,0,1,0|2,0,0]=4 491 B13R2.599 COC1=CC2=C(C=C1Cl)C=NN2 AK141100 [0,1,0,0,1,0|2,0,0]=4 492 B13R2.599 COC1=CC2=C(C=CN2)C=C1F AK-88353 [0,1,0,0,1,0|1,0,0]=3 493 B13R2.599 COC1=CC2=C(NC=C2)C=C1Br AK-61193 [0,1,0,0,1,0|1,0,0]=3 494 B13R2.599 COC1=CC2=C(NC=C2)C=C1Cl AK111540 [0,1,0,0,1,0|1,0,0]=3 495 B13R2.599 NC1=CC2=C(NN=C2)C=C1OC AK119766 [0,1,0,0,1,0|2,0,0]=4 496 B13R2.654 COC1=CC(Br)=C2C(NC=C2)=N1 AK553936 [0,1,0,0,1,0|2,0,0]=4 497 B13R2.654 COC1=CC(Br)=C2C=NNC2=C1 AK-99959 [0,1,0,0,1,0|2,0,0]=4 498 B13R2.654 COC1=CC(Cl)=C2C(NC=C2)=N1 AK150821 [0,1,0,0,1,0|2,0,0]=4 499 B13R2.654 COC1=CC2=C(C(Br)=C1)C=CN2 AK109107 [0,1,0,0,1,0|1,0,0]=3 500 B13R2.654 COC1=CC2=C(C=CN2)C(Cl)=C1 AK-48599 [0,1,0,0,1,0|1,0,0]=3 501 B13R2.654 COC1=CC2=C(NN=C2)C(Br)=C1 AK147775 [0,1,0,0,1,0|2,0,0]=4 502 B13R2.654 COC1=NC2=C(SC=C2)C(Cl)=C1 AK-87378 [0,1,0,0,1,0|2,0,0]=4 503 B13R2.654 NC1=CC(OC)=CC2=C1NC=C2 AK-58871 [0,1,0,0,1,0|1,0,0]=3 504 B13R2.669 C1=C(OC)C=CC2=C1C(CC2)=O AK-28784 [0,1,0,0,1,0|0,0,2]=4 505 B13R2.669 CC1=CNC2=CC=C(OC)N=C21 AK136123 [0,1,0,0,1,0|2,0,0]=4 506 B13R2.669 COC1=CC2=C(NC=C2Br)C=N1 AK119911 [0,1,0,0,1,0|2,0,0]=4 507 B13R2.669 COC1=CN=C2NC=C(Br)C2=C1 AK-50460 [0,1,0,0,1,0|2,0,0]=4 508 B13R2.669 O=C1COC2=CC=C(OC)C=C12 AK-44662 [0,1,0,0,1,0|1,0,1]=4 509 B13R2.669 O=C1NCC2=C1C=C(OC)C=C2 AK-51123 [0,1,0,0,1,0|1,0,1]=4 510 B13R2.2121 BrC1=NC2=C(S1)C=C(C=C2)OC AK-23615 [0,1,0,0,1,0|2,0,0]=4 511 B13R2.2121 C1=CC(=CC2=C1N=C(N)S2)OC AK-26975 [0,1,0,0,1,0|2,0,0]=4 512 B13R2.2121 CC=1NC2=C(C1)C=C(C=C2)OC AK-32805 [0,1,0,0,1,0|1,0,0]=3 513 B13R2.2121 CN1N=C2C=CC(OC)=CC2=C1 AK270401 [0,1,0,0,1,0|2,0,0]=4 514 B13R2.2121 COC1=CC2=C(C=N1)C=C(C)N2 AK476359 [0,1,0,0,1,0|2,0,0]=4 515 B13R2.2121 COC1=CC2=C(NC(N)=N2)C=C1 AK-35886 [0,1,0,0,1,0|2,0,0]=4 516 B13R2.2121 COC1=CC2=C(NC(S)=N2)C=C1 AK101104 [0,1,0,0,1,0|2,0,0]=4 517 B13R2.2121 COC1=CC2=C(NC(S2)=O)C=C1 AK-24360 [0,1,0,0,1,0|2,0,0]=4 518 B13R2.2121 COC1=CC2=C(SC(S)=N2)C=C1 AK-35637 [0,1,0,0,1,0|2,0,0]=4 519 B13R2.2121 COC1=CC=C2N=C(Cl)SC2=C1 AK-23628 [0,1,0,0,1,0|2,0,0]=4 520 B13R2.2121 COC1=CC=C2NC(CC2=C1)=O AK-36343 [0,1,0,0,1,0|1,0,1]=4 521 B13R2.2121 S=C1SC2=CC(OC)=CC=C2N1 AK110513 [0,1,0,0,1,0|2,0,0]=4 522 B13R2.2130 C1=CC(=CC2=C1C(CC2)=O)OC AK-29324 [0,1,0,0,1,0|0,0,2]=4 523 B13R2.2130 CC1=NNC2=C1C=CC(OC)=C2 AK-24406 [0,1,0,0,1,0|2,0,0]=4 524 B13R2.2130 CN1C=NC2=CC(OC)=CC=C12 AK140192 [0,1,0,0,1,0|2,0,0]=4 525 B13R2.2130 COC1=CC2=C(C=C1)C(=O)N=C2 AK-89608 [0,1,0,0,1,0|1,0,0]=3 526 B13R2.2130 COC1=CN=C2C(Br)=CNC2=C1 AK475955 [0,1,0,0,1,0|2,0,0]=4 527 B13R2.2130 IC1=N[NH]C2=CC(=CC=C12)OC AK-23704 [0,1,0,0,1,0|2,0,0]=4 528 B13R2.2130 O=C1C=CC2=C1C=CC(OC)=C2 AK103210 [0,1,0,0,1,0|0,0,0]=2 529 B13R2.2130 O=C1OCC2=C1C=CC(OC)=C2 AK340709 [0,1,0,0,1,0|1,0,1]=4 530 B15R2.627 NC1=C2C=CC=CC2=CC=C1C(O)=O AK102038 [0,2,0,0,0,0|2,0,0]=4 531 B15R2.627 OC(=O)C1=C(Br)C2=C(C=CC=C2)C=C1 AK-25577 [0,2,0,0,0,0|2,0,0]=4 532 B15R2.627 OC1=C2C=CC=CC2=CC=C1[N+]([O-])=O AK-30048 [0,2,0,0,0,0|2,0,0]=4 533 B15R2.2115 O=CC1=C2C=CC=CC2=CC=C1OC AK116707 [0,2,0,0,0,0|0,0,0]=2 534 B15R2.1282 C(C)OC1=CC=C2C(=C1)C=C(C=C2)O AK-28273 [0,2,0,0,0,0|0,0,0]=2 535 B15R2.1601 C1=C(C=CC2=CC=CC=C12)C(=O)C=O AK-10003 [0,2,0,0,0,0|1,0,1]=4 536 B15R2.1601 CC[C@@H](C1=CC=C2C=CC=CC2=C1)N AK172717 [0,2,0,0,0,0|1,0,0]=3 537 B15R2.1601 CC[C@H](C1=CC=C2C=CC=CC2=C1)N AK172719 [0,2,0,0,0,0|1,0,0]=3 538 B15R2.1601 COC(=O)C1=CC=C2N=NC=CC2=C1 AK100180 [0,2,0,0,0,0|2,0,0]=4 539 B15R2.1601 COC(=O)C1=NC2=C(C=CC=C2)C=C1 AK-49531 [0,2,0,0,0,0|1,0,0]=3 540 B15R2.1601 COC(=O)C1=NC2=C(C=CC=C2)N=C1 AK104908 [0,2,0,0,0,0|2,0,0]=4 541 B15R2.1601 N[C@H](C1=CC=C2C=CC=CC2=C1)CO AK544217 [0,2,0,0,0,0|1,0,0]=3 542 B15R2.1601 O=C(C1=CC2=C(C=N1)C=CC=C2)OC AK-29972 [0,2,0,0,0,0|1,0,0]=3 543 B15R2.1601 O=C(C1=CC2=CC=CC=C2N=C1)OC AK130436 [0,2,0,0,0,0|1,0,0]=3 544 B15R2.1601 O=C(C1=CC=C2N=CC=CC2=C1)OC AK-39659 [0,2,0,0,0,0|1,0,0]=3 545 B15R2.1601 O=C(OC)C1=CC=C2C=CC=CC2=C1 AK309188 [0,2,0,0,0,0|0,0,0]=2 546 B15R2.1668 CC(NC1=CC=C2N=CC=CC2=C1)=O AK162745 [0,2,0,0,0,0|2,0,0]=4 547 B15R2.1668 FC(F)OC1=CC=C2C=CC=CC2=C1 AK-62201 [0,2,0,0,0,0|0,0,0]=2 548 B15R2.1668 O=C(O)CC1=CC=C2C=CC=CC2=C1 AK-88438 [0,2,0,0,0,0|1,0,1]=4 549 B15R2.4776 COC1=CC2=CC(OC)=CC=C2C=C1 AK114043 [0,2,0,0,0,0|0,0,0]=2 550 B15R2.7174 CC(=O)C1=CC2=C(C=C1)N=CC(Br)=C2 AK109658 [0,2,0,0,0,0|2,0,0]=4 551 B15R2.21336 COC1=CC2=C(C=C1)N=C(Cl)C(Cl)=N2 AK-51211 [0,2,0,0,0,0|2,0,0]=4 552 B15R2.89396 COC1=CC=C2C(=O)NC(Cl)=NC2=C1 AK109422 [0,2,0,0,0,0|2,0,0]=4 553 B15R2.89396 ClC1=NC2=CC(=CC=C2C(=N1)Cl)OC AK-37632 [0,2,0,0,0,0|2,0,0]=4 554 B15R2.89396 NC1=C2C=CC(OC)=CC2=NC(Cl)=N1 AK145409 [0,2,0,0,0,0|2,0,0]=4 555 B15R2.89396 O=C1NC2=C(C=CC(OC)=C2)C(O)=C1 AK-25688 [0,2,0,0,0,0|1,0,0]=3 556 B15R2.89396 OC1=NC(O)=C2C=CC(OC)=CC2=N1 AK-79520 [0,2,0,0,0,0|2,0,0]=4 557 B15R2.2393 CC1=C(OC)C=C2C(Br)=CC=NC2=C1 AK-54383 [0,2,0,0,0,0|1,0,0]=3 558 B15R2.2393 O=C1N=CNC2=C1C=C(OC)C(O)=C2 AK-41450 [0,2,0,0,0,0|2,0,0]=4 559 B15R2.2393 OC1=C(OC)C=C2C(Cl)=CC=NC2=C1 AK-48014 [0,2,0,0,0,0|1,0,0]=3 560 B15R2.4846 COC1=CC2=C(C=C1)N=CC=C2C=O AK-28679 [0,2,0,0,0,0|1,0,0]=3 561 B15R2.21329 CC1=NC(Cl)=C2C=C(OC)C=CC2=N1 AK145814 [0,2,0,0,0,0|2,0,0]=4 562 B15R2.21329 COC1=CC2=C(Cl)N=C(Cl)N=C2C=C1 AK-37634 [0,2,0,0,0,0|2,0,0]=4 563 B15R2.21329 COC1=CC=C2N=C(Cl)C=C(Cl)C2=C1 AK-88535 [0,2,0,0,0,0|1,0,0]=3 564 B15R2.21329 O=C1NC2=CC=C(OC)C=C2C(O1)=O AK-48202 [0,2,0,0,0,0|2,0,0]=4 565 B15R2.21329 OC1=NC2=CC=C(C=C2C(=C1)O)OC AK-29855 [0,2,0,0,0,0|1,0,0]=3 566 B15R2.984 C1=C2C(=CC(=C1C(O)=O)O)C=CC=C2 AK-73003 [0,2,0,0,0,0|2,0,0]=4 567 B15R2.984 NC1=CC2=C(C=CC=C2)C=C1C(O)=O AK-35789 [0,2,0,0,0,0|2,0,0]=4 568 B15R2.7180 CC(C1=CC=C2C=C(Br)C=CC2=C1)=O AK157917 [0,2,0,0,0,0|1,0,0]=3 569 B15R2.7180 CN(C)C1=CC2=C(C=C1)N=C(C)C=C2 AK111037 [0,2,0,0,0,0|2,0,0]=4 570 B15R2.7180 N=C(N)C1=CC=C2C=C(O)C=CC2=C1 AK-39286 [0,2,0,0,0,0|2,0,0]=4 571 B15R2.7180 NC1=CC=C2C=C([N+]([O-])=O)C=CC2=C1 AK140736 [0,2,0,0,0,0|2,0,0]=4 572 B15R2.7180 O=C(O)C1=CC=C2C=C(Br)C=CC2=C1 AK-86916 [0,2,0,0,0,0|2,0,0]=4 573 B15R2.7180 O=C(O)C1=CC=C2C=C(Cl)C=CC2=C1 AK146040 [0,2,0,0,0,0|2,0,0]=4 574 B15R2.7180 O=C(O)C1=CC=C2C=C(O)C=CC2=C1 AK-62829 [0,2,0,0,0,0|2,0,0]=4 575 B15R2.7180 OC1=CC2=CC=C(B(O)O)C=C2C=C1 AK-62697 [0,2,0,0,0,0|2,0,0]=4 576 B15R2.13598 O=C(O)C1=CC=C2C(Br)=CC=CC2=C1 AK-28350 [0,2,0,0,0,0|2,0,0]=4 577 B15R2.13598 O=C(O)C1=CC=C2C(Cl)=CC=CC2=C1 AK160462 [0,2,0,0,0,0|2,0,0]=4 578 B15R2.83901 O=C1NC=NC2=C1C(F)=CC(OC)=C2 AK341443 [0,2,0,0,0,0|2,0,0]=4 579 B15R2.117 COC1=NC2=CC=CC=C2N=C1OC AK-26212 [0,2,0,0,0,0|2,0,0]=4 580 B15R2.2039 COC1=C(Br)C=C2C(Cl)=CC=NC2=C1 AK173838 [0,2,0,0,0,0|1,0,0]=3 581 B15R2.2039 O=C1N=CNC2=C1C=C(O)C(OC)=C2 AK-33785 [0,2,0,0,0,0|2,0,0]=4 582 B15R2.2310 COC1=CC2=CC=CC(OC)=C2C=C1 AK162492 [0,2,0,0,0,0|0,0,0]=2 583 B15R2.4780 BrCC1=CC2=CC=C(CBr)C=C2C=C1 AK133130 [0,2,0,0,0,0|2,0,0]=4 584 B15R2.4780 C1=C(C=O)C=CC2=C1C=CC(=C2)OC AK-25814 [0,2,0,0,0,0|0,0,0]=2 585 B15R2.4780 COC1=CC2=CC=C(OC)C=C2C=C1 AK114046 [0,2,0,0,0,0|0,0,0]=2 586 B13R2.10 ClC1=CC(C2=CC=CC=C2)=NO1 AK142366 [0,0,1,1,0,0|2,0,0]=4 587 B13R2.10 NC1=CC(C2=CC=CC=C2)=NO1 AK-98958 [0,0,1,1,0,0|2,0,0]=4 588 B13R2.573 O=CC1=CC=CC2=C1C=CN2C AK-58188 [0,0,1,1,0,0|2,0,0]=4 589 B13R2.611 COC1=CC=C(Br)C2=C1NC=C2 AK-51000 [0,0,1,1,0,0|2,0,0]=4 590 B11R1.222 C1=CC=CC(=C1C(OC)=O)Br AK-72980 [0,0,1,0,1,0|2,0,0]=4 591 B11R1.222 COC(=O)C1=C(N)C=CC=C1 AK-41339 [0,0,1,0,1,0|2,0,0]=4 592 B11R1.222 O=C(OC)C1=CC=CC=C1C AK174020 [0,0,1,0,1,0|1,0,1]=4 593 B11R1.222 O=C(OC)C1=CC=CC=C1Cl AK161838 [0,0,1,0,1,0|2,0,0]=4 594 B11R1.222 O=C(OC)C1=CC=CC=C1I AK-76653 [0,0,1,0,1,0|2,0,0]=4 595 B11R1.222 O=C(OC)C1=CC=CC=C1S AK554462 [0,0,1,0,1,0|2,0,0]=4 596 B11R2.1 BrC1=COC2=C1C=CC=C2 AK-90311 [1,0,0,0,1,0|2,0,0]=4 597 B11R2.1 BrC1=CSC2=C1C=CC=C2 AK-27164 [1,0,0,0,1,0|2,0,0]=4 598 B11R2.1 C1=C(C2=CC=CC=C2[NH]1)C AK-68243 [1,0,0,0,1,0|1,0,0]=3 599 B11R2.1 CC1=CCC2=CC=CC=C12 AK-79878 [1,0,0,0,1,0|0,0,1]=3 600 B11R2.1 CC1=CNC2=C1C=CC=N2 AK-49155 [1,0,0,0,1,0|2,0,0]=4 601 B11R2.1 CC1=N[NH]C2=CC=CC=C12 AK-24403 [1,0,0,0,1,0|2,0,0]=4 602 B11R2.1 CN1C=CC2=C1C=CC=C2 AK-84423 [1,0,0,0,1,0|1,0,0]=3 603 B11R2.1 CN1C=NC2=C1C=CC=C2 AK-51670 [1,0,0,0,1,0|2,0,0]=4 604 B11R2.1 C[N]1C2=NC=CC=C2C=C1 AK-24546 [1,0,0,0,1,0|2,0,0]=4 605 B11R2.1 NN1C=CC2=C1C=CC=C2 AK-49867 [1,0,0,0,1,0|2,0,0]=4 606 B11R2.1 OC1=NNC2=C1C=CC=C2 AK136349 [1,0,0,0,1,0|2,0,0]=4 607 B11R2.1 S1C=C(C2=C1C=CC=C2)N AK-28603 [1,0,0,0,1,0|2,0,0]=4 608 B11R2.10 BrC1=CC2=C(S1)C=CC=C2 AK-35557 [1,0,0,0,1,0|2,0,0]=4 609 B11R2.10 C1=C([NH]C2=CC=CC=C12)C AK-44448 [1,0,0,0,1,0|1,0,0]=3 610 B11R2.10 C1=CC=CC2=C1C=C(Br)C2 AK-47275 [1,0,0,0,1,0|1,0,1]=4 611 B11R2.10 CC1=CC2=C(S1)C=CC=C2 AK110745 [1,0,0,0,1,0|1,0,0]=3 612 B11R2.10 CC1=CC2=CC=CC=C2C1 AK-79371 [1,0,0,0,1,0|0,0,1]=3 613 B11R2.10 CC1=CC2=CC=CN=C2N1 AK-25051 [1,0,0,0,1,0|2,0,0]=4 614 B11R2.10 CC1=NC2=C(S1)C=CC=C2 AK-45781 [1,0,0,0,1,0|2,0,0]=4 615 B11R2.10 CC1=NC2=CC=CC=C2N1 AK-44028 [1,0,0,0,1,0|2,0,0]=4 616 B11R2.10 CC1=NC2=CC=CC=C2O1 AK161761 [1,0,0,0,1,0|2,0,0]=4 617 B11R2.10 ClC=1NC2=C(C1)C=CC=C2 AK-48803 [1,0,0,0,1,0|2,0,0]=4 618 B11R2.10 IC1=CC2=C(N1)C=CC=C2 AK110346 [1,0,0,0,1,0|2,0,0]=4 619 B11R2.10 NC1=CC2=C(S1)C=CC=C2 AK-51344 [1,0,0,0,1,0|2,0,0]=4 620 B11R2.10 OC1=CC2=C(N1)N=CC=C2 AK103904 [1,0,0,0,1,0|2,0,0]=4 621 B11R2.10 OC1=CN2C=CC=CC2=N1 AK-88442 [1,0,0,0,1,0|2,0,0]=4 622 B11R2.10 OC1=NC2=CC=CC=C2O1 AK-35787 [1,0,0,0,1,0|2,0,0]=4 623 B11R2.36 BrC1=CC2=C(C=C1)C=CC2 AK113550 [1,0,0,0,1,0|1,0,1]=4 624 B11R2.36 BrC1=CC2=C(C=C1)SC=C2 AK-26768 [1,0,0,0,1,0|2,0,0]=4 625 B11R2.36 BrC1=CC2=C(C=CS2)C=C1 AK-27128 [1,0,0,0,1,0|2,0,0]=4 626 B11R2.36 BrC1=CC=C2C=COC2=C1 AK113765 [1,0,0,0,1,0|2,0,0]=4 627 B11R2.36 BrC1=CC=C2CC=CC2=C1 AK-36299 [1,0,0,0,1,0|1,0,1]=4 628 B11R2.36 BrC1=CC=C2OC=CC2=C1 AK-32378 [1,0,0,0,1,0|2,0,0]=4 629 B11R2.36 C1=C(C=C2C(=C1)[NH]N=C2)O AK-23554 [1,0,0,0,1,0|2,0,0]=4 630 B11R2.36 C1=C(O)C=CC2=C1SC=N2 AK-23865 [1,0,0,0,1,0|2,0,0]=4 631 B11R2.36 C1=C2C(=CC=C1C)[NH]C=C2 AK-30411 [1,0,0,0,1,0|1,0,0]=3 632 B11R2.36 C1=CC(=CC2=C1[NH]C=C2)Br AK-31145 [1,0,0,0,1,0|2,0,0]=4 633 B11R2.36 C1=CC(=CC2=C1[NH]C=C2)Cl AK-32262 [1,0,0,0,1,0|2,0,0]=4 634 B11R2.36 C1=CC2=C([NH]1)C=CC(=C2)O AK-39838 [1,0,0,0,1,0|1,0,0]=3 635 B11R2.36 C1=C[NH]C2=C1C=CC(=C2)Br AK-24752 [1,0,0,0,1,0|2,0,0]=4 636 B11R2.36 CC1=CC2=C(C=C1)C=CN2 AK-16454 [1,0,0,0,1,0|1,0,0]=3 637 B11R2.36 CC1=CC2=C(C=CN2)C=N1 AK-59568 [1,0,0,0,1,0|2,0,0]=4 638 B11R2.36 CC1=CC=C2C(NC=C2)=N1 AK-59582 [1,0,0,0,1,0|2,0,0]=4 639 B11R2.36 CC1=CC=C2C=CSC2=C1 AK-61037 [1,0,0,0,1,0|1,0,0]=3 640 B11R2.36 CC1=CC=C2C=NNC2=C1 AK-50052 [1,0,0,0,1,0|2,0,0]=4 641 B11R2.36 CC1=CC=C2NC=NC2=C1 AK-87161 [1,0,0,0,1,0|2,0,0]=4 642 B11R2.36 CC1=CC=C2[NH]N=CC2=C1 AK-22235 [1,0,0,0,1,0|2,0,0]=4 643 B11R2.36 CC1=CN=C2NC=CC2=C1 AK-40671 [1,0,0,0,1,0|2,0,0]=4 644 B11R2.36 ClC1=CC2=C(C=C1)C=CN2 AK-27245 [1,0,0,0,1,0|2,0,0]=4 645 B11R2.36 ClC1=CC2=C(C=C1)SC=C2 AK-25573 [1,0,0,0,1,0|2,0,0]=4 646 B11R2.36 ClC1=CC2=C(CC=C2)C=C1 AK115909 [1,0,0,0,1,0|1,0,1]=4 647 B11R2.36 FC1=CC2=C(C=C1)C=CN2 AK-26628 [1,0,0,0,1,0|2,0,0]=4 648 B11R2.36 FC1=CC2=C(NC=C2)C=C1 AK-30363 [1,0,0,0,1,0|2,0,0]=4 649 B11R2.36 FC1=CC2=C(OC=C2)C=C1 AK-81560 [1,0,0,0,1,0|2,0,0]=4 650 B11R2.36 IC1=CC2=C(C=CN2)C=C1 AK-31785 [1,0,0,0,1,0|2,0,0]=4 651 B11R2.36 NC1=CC2=C(NC=C2)C=C1 AK-35447 [1,0,0,0,1,0|2,0,0]=4 652 B11R2.36 OC1=CC2=C(C=NO2)C=C1 AK-24400 [1,0,0,0,1,0|2,0,0]=4 653 B11R2.36 OC1=CC2=C(NC=C2)N=C1 AK-29643 [1,0,0,0,1,0|2,0,0]=4 654 B11R2.36 OC1=CC2=C(SC=N2)C=C1 AK-40507 [1,0,0,0,1,0|2,0,0]=4 655 B11R2.36 OC1=CC2=NC=CN2C=C1 AK104038 [1,0,0,0,1,0|2,0,0]=4 656 B11R2.36 OC1=CC=C2NC=NC2=C1 AK-45322 [1,0,0,0,1,0|2,0,0]=4 657 B11R2.36 OC1=CN=C2C=CSC2=C1 AK-38475 [1,0,0,0,1,0|2,0,0]=4 658 B11R2.36 [NH]1C2=NC(=CC=C2C=C1)O AK-26805 [1,0,0,0,1,0|2,0,0]=4 659 B11R2.190 OCC1=CC=C2C=CC2=C1 AK163274 [0,0,0,0,2,0|2,0,0]=4