0 B13R2.3683 BrC1=CC=C2C=C(Br)N=CC2=C1 D79936 [0,0,0,0,0,0|4,0,0]=4 1 B13R2.3683 BrC1=CC=C2N=C(Br)C=CC2=C1 83932 [0,0,0,0,0,0|3,0,0]=3 2 B13R2.3683 BrC1=CN=C2C=C(I)C=CC2=C1 W17827 [0,0,0,0,0,0|4,0,0]=4 3 B13R2.3683 CC1=CC2=C(C=C1)CC(=O)CC2 Y11712 [0,0,0,0,0,0|1,0,2]=3 4 B13R2.3683 CC1=CC2=C(C=C1)NC(=O)OC2 AC6638 [0,0,0,0,0,0|2,0,1]=3 5 B13R2.3683 CC1=CC2=C(C=C1)OC(=O)C=C2 AC7838 [0,0,0,0,0,0|0,0,0]=0 6 B13R2.3683 CC1=CC=C2C=C(I)C=CC2=N1 72392 [0,0,0,0,0,0|3,0,0]=3 7 B13R2.3683 CC1=CC=C2C=C(O)C=CC2=C1 O11612 [0,0,0,0,0,0|1,0,1]=2 8 B13R2.3683 CC1=CC=C2N=C(Cl)C=CC2=N1 68777 [0,0,0,0,0,0|3,0,0]=3 9 B13R2.3683 CC1=CC=C2N=C(Cl)N=CC2=C1 C71433 [0,0,0,0,0,0|3,0,0]=3 10 B13R2.3683 CC1=CC=C2N=C(N)C=CC2=C1 W10173 [0,0,0,0,0,0|2,0,0]=2 11 B13R2.3683 CC1=CN=C2C=C(Cl)C=CC2=N1 91924 [0,0,0,0,0,0|4,0,0]=4 12 B13R2.3683 CC1=NC2=CC=C(N)C=C2C=C1 30124 [0,0,0,0,0,0|3,0,0]=3 13 B13R2.3683 CC1=NC2=CC=C(N)C=C2C=N1 91917 [0,0,0,0,0,0|4,0,0]=4 14 B13R2.3683 CC1=NC=C2C=C(Cl)C=NC2=C1 P18098 [0,0,0,0,0,0|4,0,0]=4 15 B13R2.3683 CC1=NC=C2C=C(O)C=CC2=C1 W17783 [0,0,0,0,0,0|2,0,1]=3 16 B13R2.3683 ClC1=CC=C2C=C(Br)C=CC2=C1 F11291 [0,0,0,0,0,0|3,0,0]=3 17 B13R2.3683 ClC1=CC=C2C=C(Br)C=NC2=C1 80430 [0,0,0,0,0,0|4,0,0]=4 18 B13R2.3683 ClC1=CC=C2C=C(Br)C=NC2=N1 74726 [0,0,0,0,0,0|4,0,0]=4 19 B13R2.3683 ClC1=CC=C2C=C(Br)N=CC2=C1 D74439 [0,0,0,0,0,0|4,0,0]=4 20 B13R2.3683 ClC1=CC=C2C=C(I)C=CC2=N1 27702 [0,0,0,0,0,0|3,0,0]=3 21 B13R2.3683 ClC1=CC=C2N=C(Br)C=CC2=C1 83960 [0,0,0,0,0,0|3,0,0]=3 22 B13R2.3683 ClC1=CN=C2C=C(Br)C=CC2=C1 80424 [0,0,0,0,0,0|4,0,0]=4 23 B13R2.3683 ClC1=CN=C2N=C(Cl)C=CC2=C1 74531 [0,0,0,0,0,0|4,0,0]=4 24 B13R2.3683 ClC1=NC=C2C=C(Br)C=CC2=C1 24369 [0,0,0,0,0,0|4,0,0]=4 25 B13R2.3683 ClC1=NC=C2C=C(I)C=CC2=C1 96191 [0,0,0,0,0,0|4,0,0]=4 26 B13R2.3683 FC1=CC=C2N=C(Br)C=CC2=C1 83961 [0,0,0,0,0,0|3,0,0]=3 27 B13R2.3683 FC1=CC=C2N=C(Cl)N=CC2=C1 84001 [0,0,0,0,0,0|4,0,0]=4 28 B13R2.3683 NC1=CC2=C(C=C1)NC(=O)C=N2 W17152 [0,0,0,0,0,0|3,0,0]=3 29 B13R2.3683 NC1=CC=C2C=C(Br)C=CC2=C1 C76276 [0,0,0,0,0,0|3,0,0]=3 30 B13R2.3683 NC1=CC=C2C=C(Br)C=CC2=N1 82326 [0,0,0,0,0,0|3,0,0]=3 31 B13R2.3683 NC1=CC=C2C=C(Br)C=NC2=C1 33235 [0,0,0,0,0,0|4,0,0]=4 32 B13R2.3683 NC1=CC=C2C=C(Br)C=NC2=N1 27683 [0,0,0,0,0,0|4,0,0]=4 33 B13R2.3683 NC1=CC=C2C=C(Cl)C=CC2=N1 N12853 [0,0,0,0,0,0|3,0,0]=3 34 B13R2.3683 NC1=CC=C2C=C(Cl)C=NC2=C1 32795 [0,0,0,0,0,0|4,0,0]=4 35 B13R2.3683 NC1=CC=C2C=C(F)C=CC2=N1 27083 [0,0,0,0,0,0|3,0,0]=3 36 B13R2.3683 NC1=CC=C2C=C(I)C=CC2=N1 D85332 [0,0,0,0,0,0|3,0,0]=3 37 B13R2.3683 NC1=CC=C2C=C(O)C=NC2=C1 33248 [0,0,0,0,0,0|3,0,1]=4 38 B13R2.3683 NC1=CC=C2N=C(Cl)C=CC2=C1 80445 [0,0,0,0,0,0|3,0,0]=3 39 B13R2.3683 NC1=CC=C2N=C(Cl)C=NC2=C1 D79712 [0,0,0,0,0,0|4,0,0]=4 40 B13R2.3683 NC1=CC=C2N=C(N)C=CC2=C1 80386 [0,0,0,0,0,0|3,0,0]=3 41 B13R2.3683 NC1=CC=C2N=C(O)C=CC2=C1 CS1137 [0,0,0,0,0,0|2,0,1]=3 42 B13R2.3683 NC1=CN=C2C=C(Br)C=CC2=C1 80378 [0,0,0,0,0,0|4,0,0]=4 43 B13R2.3683 NC1=CN=C2C=C(Cl)C=CC2=C1 80393 [0,0,0,0,0,0|4,0,0]=4 44 B13R2.3683 NC1=CN=C2C=C(F)C=CC2=C1 80403 [0,0,0,0,0,0|4,0,0]=4 45 B13R2.3683 NC1=CN=C2C=C(O)C=CC2=C1 80447 [0,0,0,0,0,0|3,0,1]=4 46 B13R2.3683 NC1=NC=C2C=C(Br)C=CC2=C1 67326 [0,0,0,0,0,0|4,0,0]=4 47 B13R2.3683 O=C1C=C2C=CC(Cl)=CC2=CN1 O11650 [0,0,0,0,0,0|3,0,0]=3 48 B13R2.3683 O=C1C=CC2=C(C=CC(Cl)=C2)O1 AC5388 [0,0,0,0,0,0|1,0,0]=1 49 B13R2.3683 O=C1C=NC2=C(C=CC(Cl)=N2)N1 C76245 [0,0,0,0,0,0|4,0,0]=4 50 B13R2.3683 O=C1C=NC2=CC(Br)=CN=C2N1 D95159 [0,0,0,0,0,0|4,0,0]=4 51 B13R2.3683 O=C1CC2=C(C=C(Br)C=C2)CN1 55345 [0,0,0,0,0,0|3,0,1]=4 52 B13R2.3683 O=C1CC2=C(C=C(O)C=C2)CN1 AC2180 [0,0,0,0,0,0|3,0,1]=4 53 B13R2.3683 O=C1CCC2=C(C=CC(Br)=C2)O1 Y10639 [0,0,0,0,0,0|1,0,2]=3 54 B13R2.3683 O=C1CCC2=C(C=CC(Cl)=C2)N1 90198 [0,0,0,0,0,0|2,0,2]=4 55 B13R2.3683 O=C1CCC2=C(C=CC(F)=C2)C1 25475 [0,0,0,0,0,0|2,0,2]=4 56 B13R2.3683 O=C1CCC2=C(C=CC(I)=C2)N1 62820 [0,0,0,0,0,0|2,0,2]=4 57 B13R2.3683 O=C1CNC2=C(C=CC(Br)=C2)N1 AC2129 [0,0,0,0,0,0|3,0,1]=4 58 B13R2.3683 O=C1COC2=C(C=CC(I)=C2)N1 69009 [0,0,0,0,0,0|3,0,1]=4 59 B13R2.3683 O=C1NCC2=C(C=CC(Br)=C2)N1 C71976 [0,0,0,0,0,0|3,0,1]=4 60 B13R2.3683 OC1=CC=C2C=C(Cl)C=CC2=C1 N12660 [0,0,0,0,0,0|2,0,1]=3 61 B13R2.3683 OC1=CC=C2C=C(Cl)C=NC2=C1 80456 [0,0,0,0,0,0|3,0,1]=4 62 B13R2.3683 OC1=CC=C2C=C(F)C=CC2=C1 N14582 [0,0,0,0,0,0|2,0,1]=3 63 B13R2.3683 OC1=CC=C2C=C(F)C=NC2=C1 80458 [0,0,0,0,0,0|3,0,1]=4 64 B13R2.3683 OC1=CC=C2N=C(Cl)C=NC2=C1 W17777 [0,0,0,0,0,0|4,0,0]=4 65 B13R2.3683 OC1=CN=C2C=C(Br)C=CC2=C1 K10058 [0,0,0,0,0,0|3,0,1]=4 66 B13R2.3683 OC1=CN=C2C=C(F)C=CC2=C1 K10005 [0,0,0,0,0,0|3,0,1]=4 67 B12R2.24 BrC1=CC2=C(C=C1)OCC=C2 Y12222 [1,0,0,0,0,0|1,0,1]=3 68 B12R2.24 BrC1=CC2=CC=CN=C2N=C1 39321 [1,0,0,0,0,0|3,0,0]=4 69 B12R2.24 BrC1=CC2=CC=NN=C2C=C1 O11557 [1,0,0,0,0,0|3,0,0]=4 70 B12R2.24 BrC1=CC2=NC=CC=C2C=C1 BL002815 [1,0,0,0,0,0|3,0,0]=4 71 B12R2.24 BrC1=NC2=CC=CC=C2C=N1 O10704 [1,0,0,0,0,0|3,0,0]=4 72 B12R2.24 BrC1=NC2=NC=CC=C2C=C1 W18658 [1,0,0,0,0,0|3,0,0]=4 73 B12R2.24 CC1=CC=C2C=NN=CC2=C1 T72939 [1,0,0,0,0,0|3,0,0]=4 74 B12R2.24 CC1=NC2=NC=CN=C2C=C1 C72942 [1,0,0,0,0,0|3,0,0]=4 75 B12R2.24 ClC1=CC2=CC=CN=C2N=C1 C74810 [1,0,0,0,0,0|3,0,0]=4 76 B12R2.24 ClC1=CC2=CN=CC=C2C=C1 24371 [1,0,0,0,0,0|3,0,0]=4 77 B12R2.24 ClC1=CC2=CN=CN=C2C=C1 83074 [1,0,0,0,0,0|3,0,0]=4 78 B12R2.24 ClC1=NC2=CC=CN=C2C=C1 68776 [1,0,0,0,0,0|3,0,0]=4 79 B12R2.24 ClC1=NC2=CN=CC=C2C=C1 38277 [1,0,0,0,0,0|3,0,0]=4 80 B12R2.24 ClC1=NC2=NC=CC=C2C=C1 F20209 [1,0,0,0,0,0|3,0,0]=4 81 B12R2.24 FC1=CC2=CC=CC=C2N=C1 F30311 [1,0,0,0,0,0|3,0,0]=4 82 B12R2.24 FC1=CC2=CN=CC=C2C=C1 90642 [1,0,0,0,0,0|3,0,0]=4 83 B12R2.24 FC1=NC2=CC=CC=C2C=C1 H10138 [1,0,0,0,0,0|2,0,0]=3 84 B12R2.24 IC1=CC2=CC=CC=C2N=C1 AB9519 [1,0,0,0,0,0|3,0,0]=4 85 B12R2.24 IC1=CC2=NC=CN=C2C=C1 81077 [1,0,0,0,0,0|3,0,0]=4 86 B12R2.24 IC1=NC2=CC=CC=C2C=C1 71122 [1,0,0,0,0,0|2,0,0]=3 87 B12R2.24 IC1=NC2=CC=CC=C2C=N1 W17116 [1,0,0,0,0,0|3,0,0]=4 88 B12R2.24 NC1=CC=C2C=CC=NC2=C1 32470 [1,0,0,0,0,0|3,0,0]=4 89 B12R2.24 NC1=CC=C2C=CN=CC2=C1 24616 [1,0,0,0,0,0|3,0,0]=4 90 B12R2.24 NC1=NC2=CC=CN=C2C=C1 C15126 [1,0,0,0,0,0|3,0,0]=4 91 B12R2.24 NC1=NC2=NC=CC=C2C=C1 26493 [1,0,0,0,0,0|3,0,0]=4 92 B12R2.24 O=C1C=C2C=CC=CC2=NN1 O11709 [1,0,0,0,0,0|3,0,0]=4 93 B12R2.24 O=C1C=CC2=CC=CN=C2N1 P11962 [1,0,0,0,0,0|2,0,0]=3 94 B12R2.24 O=C1C=CC2=NC=CN=C2N1 26897 [1,0,0,0,0,0|3,0,0]=4 95 B12R2.24 O=C1C=NC2=CC=CN=C2N1 O12061 [1,0,0,0,0,0|3,0,0]=4 96 B12R2.24 O=C1CC2=C(C=CC=C2)CN1 C15389 [1,0,0,0,0,0|2,0,1]=4 97 B12R2.24 O=C1NCC2=C(C=CC=C2)N1 C76098 [1,0,0,0,0,0|2,0,1]=4 98 B12R2.24 OC1=CC2=NC=CN=C2C=C1 W16762 [1,0,0,0,0,0|3,0,0]=4 99 B12R2.24 OC1=NC2=CC=CN=C2C=C1 68775 [1,0,0,0,0,0|2,0,1]=4 100 B12R2.24 OC1=NC2=CN=CC=C2C=C1 F30771 [1,0,0,0,0,0|2,0,1]=4 101 B12R2.24 SC1=CC2=CC=CC=C2N=C1 D83175 [1,0,0,0,0,0|2,1,0]=4 102 B12R2.24 [O-]C1=CC2=CC=CC=C2C=C1 A12912 [1,0,0,0,0,0|1,0,1]=3 103 B14R2.2332 C=CC1=CC=C2C=C(O)C=CC2=C1 C72481 [0,1,0,0,0,0|1,0,2]=4 104 B14R2.2332 CC1=CC=C2C=C(C#N)C=CC2=N1 W16109 [0,1,0,0,0,0|2,0,1]=4 105 B14R2.2332 CC1=CC=C2C=C(C=O)C=CC2=N1 27234 [0,1,0,0,0,0|2,0,0]=3 106 B14R2.2332 CC1=CC=C2N=C(C=O)C=CC2=C1 71624 [0,1,0,0,0,0|1,0,0]=2 107 B14R2.2332 CCC1=CC=C2C=C(O)C=CC2=C1 C10686 [0,1,0,0,0,0|1,0,1]=3 108 B14R2.2332 COC1=CC2=C(C=C1)NC(=O)C=C2 W10314 [0,1,0,0,0,0|1,0,0]=2 109 B14R2.2332 COC1=CC2=C(C=C1)NC(=O)CO2 C76042 [0,1,0,0,0,0|2,0,1]=4 110 B14R2.2332 COC1=CC2=C(C=C1)OC(=O)CC2 D94611 [0,1,0,0,0,0|0,0,2]=3 111 B14R2.2332 COC1=CC2=NC=C(N)C=C2C=C1 80439 [0,1,0,0,0,0|3,0,0]=4 112 B14R2.2332 COC1=CC2=NC=C(O)N=C2C=C1 C77112 [0,1,0,0,0,0|2,0,1]=4 113 B14R2.2332 COC1=CC=C2C=C(Br)C=NC2=C1 F11731 [0,1,0,0,0,0|3,0,0]=4 114 B14R2.2332 COC1=CC=C2C=C(Cl)N=CC2=C1 96203 [0,1,0,0,0,0|3,0,0]=4 115 B14R2.2332 COC1=CC=C2N=C(Br)C=CC2=C1 83962 [0,1,0,0,0,0|2,0,0]=3 116 B14R2.2332 COC1=CC=C2N=C(Cl)C=NC2=C1 O10749 [0,1,0,0,0,0|3,0,0]=4 117 B14R2.2332 COC1=CC=C2N=C(Cl)N=CC2=C1 36069 [0,1,0,0,0,0|3,0,0]=4 118 B14R2.2332 COC1=CN=C2C=C(Br)C=CC2=C1 O11634 [0,1,0,0,0,0|3,0,0]=4 119 B14R2.2332 N#CC1=CC=C2C=C(Br)C=CC2=C1 AB6429 [0,1,0,0,0,0|2,0,1]=4 120 B14R2.2332 N#CC1=CC=C2C=C(Br)C=CC2=N1 56891 [0,1,0,0,0,0|3,0,0]=4 121 B14R2.2332 N#CC1=CC=C2C=C(Cl)C=CC2=N1 50647 [0,1,0,0,0,0|3,0,0]=4 122 B14R2.2332 N#CC1=CC=C2N=C(Cl)C=CC2=C1 P16927 [0,1,0,0,0,0|2,0,1]=4 123 B14R2.2332 O=CC1=CC=C2C=C(Br)C=CC2=N1 80285 [0,1,0,0,0,0|2,0,0]=3 124 B14R2.2332 O=CC1=CC=C2C=C(Br)C=NC2=C1 27956 [0,1,0,0,0,0|3,0,0]=4 125 B14R2.2332 O=CC1=CC=C2C=C(Cl)N=CC2=C1 78615 [0,1,0,0,0,0|3,0,0]=4 126 B14R2.2332 O=CC1=CC=C2N=C(Cl)C=CC2=C1 N13262 [0,1,0,0,0,0|2,0,1]=4 127 B14R2.2332 O=CC1=CN=C2C=C(Br)C=CC2=C1 K10053 [0,1,0,0,0,0|3,0,0]=4 128 B14R2.2332 OCC1=CC=C2C=C(Br)C=CC2=C1 F10523 [0,1,0,0,0,0|2,0,0]=3 129 B14R2.4493 CC1(C)C=CC2=C(C=CC(N)=C2)O1 F50695 [0,1,0,0,0,0|2,0,1]=4 130 B14R2.8235 CC1=CC(=O)NC2=C1C=C(Cl)C=C2 27291 [0,1,0,0,0,0|2,0,0]=3 131 B14R2.8235 CC1=CC(C)=C2N=C(C)C=CC2=C1 D80121 [0,1,0,0,0,0|2,0,0]=3 132 B14R2.8235 CC1=CC2=C(C=C1)N=C(C)NC2=O AR3680 [0,1,0,0,0,0|3,0,0]=4 133 B14R2.8235 CC1=CC2=C(C=C1)NC(=O)NC2=O F14746 [0,1,0,0,0,0|2,0,0]=3 134 B14R2.8235 CC1=CC2=C(C=C1)NC(O)=CC2=O 35971 [0,1,0,0,0,0|1,0,1]=3 135 B14R2.8235 CC1=CC2=CC=C(C)N=C2C(Cl)=C1 D80148 [0,1,0,0,0,0|2,0,0]=3 136 B14R2.8235 CC1=CC=C2C=C(Br)C=C(F)C2=N1 D80129 [0,1,0,0,0,0|3,0,0]=4 137 B14R2.8235 CC1=CC=C2C=C(F)C=C(Br)C2=N1 D80125 [0,1,0,0,0,0|3,0,0]=4 138 B14R2.8235 CC1=CC=C2N=C(C)N=C(Cl)C2=C1 53765 [0,1,0,0,0,0|3,0,0]=4 139 B14R2.8235 CC1=CC=C2N=C(C)N=C(O)C2=C1 S10127 [0,1,0,0,0,0|3,0,0]=4 140 B14R2.8235 CC1=CC=C2N=C(Cl)C=C(Cl)C2=C1 83913 [0,1,0,0,0,0|2,0,0]=3 141 B14R2.8235 ClC1=CC(Cl)=C2C=C(Br)C=CC2=N1 84484 [0,1,0,0,0,0|3,0,0]=4 142 B14R2.8235 FC1=CC(F)=C2N=C(Cl)C=CC2=C1 Y10611 [0,1,0,0,0,0|3,0,0]=4 143 B14R2.8235 NC1=C2C=C(Br)C=CC2=NC(Cl)=C1 C72032 [0,1,0,0,0,0|3,0,0]=4 144 B14R2.8235 O=C1C=C(O)C2=C(C=CC(Br)=C2)O1 T70895 [0,1,0,0,0,0|1,0,0]=2 145 B14R2.8235 O=C1C=C(O)C2=C(C=CC(Cl)=C2)O1 A12216 [0,1,0,0,0,0|1,0,0]=2 146 B14R2.8235 O=C1C=C(O)C2=C(C=CC(F)=C2)O1 C73780 [0,1,0,0,0,0|1,0,0]=2 147 B14R2.8235 O=C1C=CC2=CC(Br)=CC(F)=C2N1 C90133 [0,1,0,0,0,0|2,0,0]=3 148 B14R2.8235 O=C1N=CC2=CC(Br)=CC(F)=C2N1 F15821 [0,1,0,0,0,0|3,0,0]=4 149 B14R2.8235 O=C1NC(=O)C2=C(C=CC(Cl)=C2)N1 11641 [0,1,0,0,0,0|3,0,0]=4 150 B14R2.8235 O=C1NC(=O)C2=C(C=CC(I)=C2)N1 VT1417 [0,1,0,0,0,0|3,0,0]=4 151 B14R2.8235 O=C1NC(=O)C2=C(C=CC(O)=C2)N1 69879 [0,1,0,0,0,0|3,0,0]=4 152 B14R2.8235 OC1=CC(O)=C2C=C(F)C=CC2=N1 F19188 [0,1,0,0,0,0|2,0,1]=4 153 B14R2.8239 CC1=C(N)N=C2C=CC(Br)=CC2=C1 P20647 [0,1,0,0,0,0|3,0,0]=4 154 B14R2.8239 CC1=CC2=C(C=C(O)C=C2)OC1=O C90473 [0,1,0,0,0,0|2,0,1]=4 155 B14R2.8239 CC1=CC=C2C=C(Cl)C(F)=CC2=N1 P18114 [0,1,0,0,0,0|3,0,0]=4 156 B14R2.8239 CN1CC2=C(C=CC(Br)=C2)OC1=O D83433 [0,1,0,0,0,0|2,0,1]=4 157 B14R2.8239 NC1=CC2=C(C=C1)NC(=O)C(=O)N2 C16248 [0,1,0,0,0,0|3,0,0]=4 158 B14R2.8239 O=C1C=CC2=CC(Br)=C(F)C=C2N1 AC4537 [0,1,0,0,0,0|2,0,0]=3 159 B14R2.8239 OC1=CC=C2C=C(Br)C(O)=CC2=C1 D82884 [0,1,0,0,0,0|2,0,1]=4 160 B14R2.29369 NC1=C2C=CC(Cl)=NC2=CC=C1Cl 27775 [0,1,0,0,0,0|3,0,0]=4 161 B14R2.29369 O=C1N=CC2=C(C=CC(Br)=C2F)N1 F15814 [0,1,0,0,0,0|3,0,0]=4 162 B14R2.29369 OC1=CC=C2C=C(Br)C=CC2=C1F C75195 [0,1,0,0,0,0|2,0,1]=4 163 B12R1.49 C=CC(=O)NC1=CC=C(N)C=C1 A10042 [0,0,1,0,0,0|2,0,0]=3 164 B12R1.49 CC1=CC=C(CC(=O)NN)C=C1 W18215 [0,0,1,0,0,0|3,0,0]=4 165 B12R1.49 CCC(=O)CC1=CC=C(C)C=C1 N12572 [0,0,1,0,0,0|1,0,2]=4 166 B12R1.49 CCC(=O)OC1=CC=C(O)C=C1 C11963 [0,0,1,0,0,0|1,0,2]=4 167 B12R1.226 CC1=CC(CCC(=O)O)=CN=C1 72580 [0,0,1,0,0,0|1,0,2]=4 168 B12R1.226 CC1=CC=CC(CCC(=O)O)=N1 71538 [0,0,1,0,0,0|1,0,2]=4 169 B12R1.226 CC1=CC=CC(\C=C\C(=O)O)=N1 W18216 [0,0,1,0,0,0|1,0,0]=2 170 B12R1.226 CC1=NC=CC(CCC(=O)O)=C1 72670 [0,0,1,0,0,0|1,0,2]=4 171 B12R1.226 NC1=CC=CC(\C=C\C(=O)O)=C1 AT20412 [0,0,1,0,0,0|1,0,0]=2 172 B12R1.226 O=C(O)C#CC1=CC=CC(F)=C1 W19721 [0,0,1,0,0,0|1,0,2]=4 173 B12R1.226 O=C(O)\C=C\C1=CC=CC(I)=C1 C75087 [0,0,1,0,0,0|1,0,0]=2 174 B12R1.226 O=[N+]([O-])\C=C\C1=CC=CC(F)=C1 C76251 [0,0,1,0,0,0|2,0,1]=4 175 B12R1.233 CC(=O)NC1=C(O)C=C(C)C=C1 D96026 [0,0,1,0,0,0|2,0,1]=4 176 B12R2.606 CC1=CC2=C(C=C(Cl)C=C2)N1 27371 [0,0,0,0,1,0|3,0,0]=4 177 B12R2.606 CC1=CC2=C(C=C(F)C=C2)N1 33909 [0,0,0,0,1,0|3,0,0]=4 178 B12R2.606 CC1=CC2=C(C=C(I)C=C2)N1 P15438 [0,0,0,0,1,0|3,0,0]=4 179 B12R2.606 CC1=CC2=C(C=C(N)C=C2)N1 P11525 [0,0,0,0,1,0|3,0,0]=4 180 B12R2.606 CC1=CC2=C(C=C(O)C=C2)O1 F21500 [0,0,0,0,1,0|2,0,1]=4 181 B12R2.606 CC1=CC2=C(C=C1)N=C(Br)S2 71677 [0,0,0,0,1,0|3,0,0]=4 182 B12R2.606 CC1=CC2=C(C=C1)N=C(Cl)S2 W10452 [0,0,0,0,1,0|3,0,0]=4 183 B12R2.606 CC1=CC2=C(C=C1)N=C(N)O2 52985 [0,0,0,0,1,0|3,0,0]=4 184 B12R2.606 CC1=CC2=C(C=C1)N=C(S)O2 T72123 [0,0,0,0,1,0|2,1,0]=4 185 B12R2.606 CC1=CC2=C(C=C1)N=C(S)S2 W17074 [0,0,0,0,1,0|2,1,0]=4 186 B12R2.606 CC1=CC2=C(C=C1)NC(=O)S2 F15190 [0,0,0,0,1,0|2,0,0]=3 187 B12R2.606 CC1=CC2=C(C=C1)SC(Br)=N2 W10487 [0,0,0,0,1,0|2,1,0]=4 188 B12R2.606 CC1=CC2=C(C=C1)SC(Cl)=N2 C15674 [0,0,0,0,1,0|2,1,0]=4 189 B12R2.606 CC1=CC2=C(C=C1)SC(N)=N2 W10174 [0,0,0,0,1,0|2,1,0]=4 190 B12R2.606 CC1=CC2=C(C=CC(C)=N2)N1 I10966 [0,0,0,0,1,0|3,0,0]=4 191 B12R2.606 CC1=CC2=C(C=CC(Cl)=N2)N1 P12291 [0,0,0,0,1,0|3,0,0]=4 192 B12R2.606 CC1=CC2=C(CC(=O)N2)N=C1 D97288 [0,0,0,0,1,0|3,0,0]=4 193 B12R2.606 CC1=CC2=C(N=C(C)C=C2)N1 61972 [0,0,0,0,1,0|3,0,0]=4 194 B12R2.606 CC1=CC2=C(N=C1)NC(I)=C2 P18374 [0,0,0,0,1,0|3,0,0]=4 195 B12R2.606 CC1=CN2C=C(Br)N=C2C=C1 W13277 [0,0,0,0,1,0|3,0,0]=4 196 B12R2.606 CC1=NC2=C(C=CC(N)=C2)O1 78609 [0,0,0,0,1,0|3,0,0]=4 197 B12R2.606 CC1=NC2=C(C=CC(O)=C2)O1 I10199 [0,0,0,0,1,0|3,0,0]=4 198 B12R2.606 ClC1=CC2=C(C=C1)NC(I)=C2 S10265 [0,0,0,0,1,0|3,0,0]=4 199 B12R2.606 ClC1=NC2=C(C=CC(Br)=C2)O1 36068 [0,0,0,0,1,0|3,0,0]=4 200 B12R2.606 FC1=CC2=C(C=C1)OC(Cl)=N2 F30138 [0,0,0,0,1,0|3,0,0]=4 201 B12R2.606 NC1=CC2=C(C=C1)CC(=O)C2 88115 [0,0,0,0,1,0|2,0,1]=4 202 B12R2.606 NC1=CC2=C(C=C1)OC(=O)C2 D82169 [0,0,0,0,1,0|1,0,1]=3 203 B12R2.606 NC1=CC2=C(C=CC(Br)=C2)S1 37561 [0,0,0,0,1,0|2,1,0]=4 204 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)C1 26376 [0,0,0,0,1,0|2,0,1]=4 205 B12R2.606 O=C1CC2=C(C=C(F)C=C2)C1 53683 [0,0,0,0,1,0|2,0,1]=4 206 B12R2.606 O=C1CC2=C(C=C(I)C=C2)N1 F30698 [0,0,0,0,1,0|3,0,0]=4 207 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)O1 D78722 [0,0,0,0,1,0|1,0,1]=3 208 B12R2.606 O=C1NC2=C(C=C(F)C=C2)N1 24744 [0,0,0,0,1,0|3,0,0]=4 209 B12R2.606 O=C1NC2=C(C=C(I)C=C2)N1 A12501 [0,0,0,0,1,0|3,0,0]=4 210 B12R2.606 O=C1NC2=C(C=CC(Br)=C2)S1 27037 [0,0,0,0,1,0|2,1,0]=4 211 B12R2.606 O=C1NC2=C(C=CC(Br)=N2)O1 AC2056 [0,0,0,0,1,0|3,0,0]=4 212 B12R2.606 O=C1NC2=C(C=CC(O)=C2)O1 D83229 [0,0,0,0,1,0|2,0,0]=3 213 B12R2.606 O=C1OC2=C(C=CC(O)=C2)S1 C75325 [0,0,0,0,1,0|2,1,0]=4 214 B12R2.612 CC1=CC2=C(C=C1)C(=O)OC2 78098 [0,0,0,0,1,0|1,0,1]=3 215 B12R2.612 CC1=CC2=C(C=C1)C(O)=NO2 O11611 [0,0,0,0,1,0|2,0,1]=4 216 B12R2.612 CC1=CC2=C(C=N1)C(=O)CC2 66309 [0,0,0,0,1,0|1,0,2]=4 217 B12R2.612 CC1=CNC2=C1C=CC(Br)=C2 50641 [0,0,0,0,1,0|3,0,0]=4 218 B12R2.612 CC1=CNC2=C1C=CC(Cl)=C2 82345 [0,0,0,0,1,0|3,0,0]=4 219 B12R2.612 CC1=CNC2=C1C=CC(Cl)=N2 38225 [0,0,0,0,1,0|3,0,0]=4 220 B12R2.612 CC1=CNC2=C1C=CC(F)=C2 D97643 [0,0,0,0,1,0|3,0,0]=4 221 B12R2.612 CC1=CNC2=C1C=CC(N)=C2 P11526 [0,0,0,0,1,0|3,0,0]=4 222 B12R2.612 CC1=NC2=C(C=C1)C(Br)=CN2 I10826 [0,0,0,0,1,0|3,0,0]=4 223 B12R2.612 CC1=NC2=C(C=C1)C(I)=CN2 C71004 [0,0,0,0,1,0|3,0,0]=4 224 B12R2.612 CN1C=CC2=C1C=CC(Cl)=C2 A10102 [0,0,0,0,1,0|3,0,0]=4 225 B12R2.612 CN1C=CC2=C1C=CC(O)=C2 F14443 [0,0,0,0,1,0|2,0,1]=4 226 B12R2.612 ClC1=CC2=C(C=C1)C(Cl)=CS2 D87906 [0,0,0,0,1,0|3,0,0]=4 227 B12R2.612 FC1=CC2=C(C=C1)C(I)=CN2 98354 [0,0,0,0,1,0|3,0,0]=4 228 B12R2.612 NC1=CC2=C(C=C1)C(=O)NN2 20323 [0,0,0,0,1,0|3,0,0]=4 229 B12R2.612 O=C1CCC2=C1C=CC(I)=C2 78363 [0,0,0,0,1,0|1,0,2]=4 230 B12R2.612 O=C1COC2=C1C=CC(Br)=C2 67306 [0,0,0,0,1,0|2,0,1]=4 231 B12R2.612 O=C1NCC2=C1C=CC(Cl)=C2 83087 [0,0,0,0,1,0|2,0,1]=4 232 B12R2.612 O=C1NOC2=C1C=CC(F)=C2 26667 [0,0,0,0,1,0|3,0,0]=4 233 B12R2.612 O=C1NSC2=C1C=CC(F)=C2 S10563 [0,0,0,0,1,0|3,0,0]=4 234 B11R1.40 CNC(=O)OC1=CC=CC=C1 C10489 [1,0,1,0,0,0|1,0,1]=4 235 B11R1.40 NNC(=O)OC1=CC=CC=C1 Y11606 [1,0,1,0,0,0|2,0,0]=4 236 B11R1.37 CC1=CC(C#N)=C(C=O)C=C1 W17085 [1,0,1,0,0,0|1,0,1]=4 237 B11R1.37 O=CC1=C(C=O)C=C(Br)C=C1 F13695 [1,0,1,0,0,0|2,0,0]=4 238 B11R1.81 CC1=CC(C)=C(NC=O)C=C1 E70411 [1,0,1,0,0,0|1,0,1]=4 239 B11R1.91 O=C(O)\C=C\C1=NC=CC=N1 P18972 [1,0,1,0,0,0|2,0,0]=4 240 B11R1.91 O=C(O)\C=C\C1=NC=CN=C1 W18616 [1,0,1,0,0,0|2,0,0]=4 241 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 D70623 [1,0,1,0,0,0|1,0,1]=4 242 B11R1.17 O=C\C=C\C1=C(F)C=CC=C1 24137 [1,0,1,0,0,0|1,0,0]=3 243 B11R1.182 C=CCC1=C(O)C=CC(C)=C1 D96076 [1,0,1,0,0,0|0,0,1]=3 244 B11R2.20 C1=CC2=C(C=C1)OCC=C2 N13096 [2,0,0,0,0,0|0,0,1]=3 245 B11R2.20 C1=CC2=CC=NC=C2N=C1 50496 [2,0,0,0,0,0|2,0,0]=4 246 B11R2.20 C1=CC2=CN=CC=C2N=C1 SC3611 [2,0,0,0,0,0|2,0,0]=4 247 B11R2.20 C1=CC=C2N=NC=CC2=C1 76492 [2,0,0,0,0,0|2,0,0]=4 248 B11R2.20 C1=CC=C2N=NC=CC2=C1 Y10640 [2,0,0,0,0,0|2,0,0]=4 249 B13R1.5 C=CC(=O)OC1=CC=C(CC)C=C1 Y14655 [0,1,1,0,0,0|0,0,0]=2 250 B13R1.15 COC(=O)\C=C\C1=CC(C)=CC=C1 W11679 [0,1,1,0,0,0|0,0,0]=2 251 B13R1.15 COC(=O)\C=C\C1=CC(F)=CN=C1 W16643 [0,1,1,0,0,0|2,0,0]=4 252 B13R1.15 COC(=O)\C=C\C1=CC(O)=CC=C1 A11407 [0,1,1,0,0,0|1,0,0]=3 253 B13R1.147 CC1=CC=CC([C@@H](N)CC(=O)O)=C1 Y13375 [0,1,1,0,0,0|0,0,2]=4 254 B13R1.148 O=C(O)C(=O)CC1=CC(O)=CC=C1 C15825 [0,1,1,0,0,0|1,0,1]=4 255 B13R1.150 O=C(O)\C=C\C1=CC=CC(Cl)=C1F F16447 [0,1,1,0,0,0|1,0,0]=3 256 B13R1.511 CC(=O)\C=C\C1=CC(O)=C(O)C=C1 D95842 [0,1,1,0,0,0|2,0,0]=4 257 B13R1.511 CC1=C(F)C=CC(CCC(=O)O)=C1 F52891 [0,1,1,0,0,0|0,0,2]=4 258 B13R1.511 CC1=C(O)C=CC(CCC(=O)O)=C1 F52916 [0,1,1,0,0,0|0,0,2]=4 259 B13R1.643 COC1=CC=CC(C#CC(=O)O)=C1 D86459 [0,1,1,0,0,0|0,0,2]=4 260 B13R1.643 N#CC1=CC=CC(\C=C\C(=O)O)=C1 C80051 [0,1,1,0,0,0|0,0,1]=3 261 B13R1.893 O=C(O)\C=C\C1=C(O)C=CC(O)=C1 A11070 [0,1,1,0,0,0|1,0,0]=3 262 B13R1.3420 O=C(O)\C=C\C1=CC(O)=CC(O)=C1 D81623 [0,1,1,0,0,0|1,0,0]=3 263 B13R2.32 CC1=C(Br)C2=CC=CN=C2C=C1 F52037 [1,1,0,0,0,0|1,0,0]=3 264 B13R2.32 CC1=C(Br)C2=CC=NC=C2C=C1 20251 [1,1,0,0,0,0|2,0,0]=4 265 B13R2.32 CC1=C(Br)C=CC2=NC=CC=C21 F19194 [1,1,0,0,0,0|2,0,0]=4 266 B13R2.32 CC1=C(O)C2=CC=CC=C2N=C1 AC6544 [1,1,0,0,0,0|2,0,0]=4 267 B13R2.32 CC1=C(O)C2=CC=CN=C2C=C1 F20274 [1,1,0,0,0,0|1,0,0]=3 268 B13R2.32 FC1=C(Br)C=CC2=NC=CC=C21 95703 [1,1,0,0,0,0|2,0,0]=4 269 B13R2.32 NC1=C(Br)C=CC2=CC=CC=C21 F13404 [1,1,0,0,0,0|2,0,0]=4 270 B13R2.32 NC1=C(O)C2=CC=CC=C2C=C1 A12509 [1,1,0,0,0,0|2,0,0]=4 271 B13R2.32 NC1=C(O)C=CC2=NC=CC=C21 95715 [1,1,0,0,0,0|2,0,0]=4 272 B13R2.32 O=C1NC=C2C=CC=CC2=C1Br P20049 [1,1,0,0,0,0|2,0,0]=4 273 B13R2.32 OC1=C(Br)C2=CC=CN=C2C=C1 95714 [1,1,0,0,0,0|2,0,0]=4 274 B13R2.32 OC1=C(F)C2=CC=CN=C2C=C1 33740 [1,1,0,0,0,0|2,0,0]=4 275 B13R2.32 OC1=C(I)C2=CC=CC=C2C=C1 34754 [1,1,0,0,0,0|1,0,1]=4 276 B13R2.32 OC1=C(O)C2=CC=CC=C2C=C1 T71079 [1,1,0,0,0,0|1,0,1]=4 277 B13R2.57 BrCC1=CC2=CC=CN=C2C=C1 O11502 [1,1,0,0,0,0|1,0,0]=3 278 B13R2.57 BrCC1=CC2=CC=NC=C2C=C1 78906 [1,1,0,0,0,0|2,0,0]=4 279 B13R2.57 BrCC1=CC2=NC=CN=C2C=C1 36024 [1,1,0,0,0,0|2,0,0]=4 280 B13R2.57 C#CC1=CC=C2N=CC=CC2=C1 C76516 [1,1,0,0,0,0|1,0,1]=4 281 B13R2.57 C=CC1=NC2=CC=CC=C2C=C1 80295 [1,1,0,0,0,0|2,0,0]=4 282 B13R2.57 COC1=CC2=NC=CC=C2C=C1 31891 [1,1,0,0,0,0|2,0,0]=4 283 B13R2.57 COC1=NC2=CC=CC=C2C=C1 W11244 [1,1,0,0,0,0|1,0,1]=4 284 B13R2.57 ClCC1=CC2=CC=CC=C2C=N1 C72814 [1,1,0,0,0,0|2,0,0]=4 285 B13R2.57 ClCC1=CC2=CC=CN=C2C=C1 70964 [1,1,0,0,0,0|1,0,0]=3 286 B13R2.57 ClCC1=NC2=CC=CC=C2C=C1 S11826 [1,1,0,0,0,0|2,0,0]=4 287 B13R2.57 NCC1=CC2=CC=CC=C2C=N1 27594 [1,1,0,0,0,0|2,0,0]=4 288 B13R2.57 NCC1=CC2=CC=CC=C2C=N1 C73130 [1,1,0,0,0,0|2,0,0]=4 289 B13R2.57 NCC1=CC2=CC=CC=C2N=C1 C15569 [1,1,0,0,0,0|2,0,0]=4 290 B13R2.57 NCC1=CC=C2C=CC=NC2=C1 78919 [1,1,0,0,0,0|2,0,0]=4 291 B13R2.57 NCC1=CC=C2C=NC=CC2=C1 79154 [1,1,0,0,0,0|2,0,0]=4 292 B13R2.57 NCC1=CC=C2N=CC=NC2=C1 24418 [1,1,0,0,0,0|2,0,0]=4 293 B13R2.57 NCC1=NC2=CC=CC=C2C=C1 78918 [1,1,0,0,0,0|2,0,0]=4 294 B13R2.57 O=CC1=CC2=CC=NC=C2C=C1 AT15535 [1,1,0,0,0,0|2,0,0]=4 295 B13R2.57 O=CC1=CC2=CN=CC=C2C=C1 26625 [1,1,0,0,0,0|2,0,0]=4 296 B13R2.57 O=CC1=CC2=NC=CC=C2C=C1 24417 [1,1,0,0,0,0|2,0,0]=4 297 B13R2.57 OCC1=CC2=CC=NC=C2C=C1 24141 [1,1,0,0,0,0|2,0,0]=4 298 B13R2.57 OCC1=NC2=CC=CC=C2C=C1 BL002914 [1,1,0,0,0,0|1,0,1]=4 299 B13R2.155 BrC1=CC=C2C=CC(Br)=NC2=C1 78703 [1,1,0,0,0,0|2,0,0]=4 300 B13R2.155 BrC1=CN=C2C=CC(I)=CC2=C1 C73886 [1,1,0,0,0,0|2,0,0]=4 301 B13R2.155 CC1=CC=C2C=CC(C)=CC2=C1 71004 [1,1,0,0,0,0|1,0,0]=3 302 B13R2.155 CC1=CC=C2C=CC(C)=NC2=C1 I11455 [1,1,0,0,0,0|2,0,0]=4 303 B13R2.155 CC1=CC=C2C=CC(Cl)=NC2=C1 97613 [1,1,0,0,0,0|2,0,0]=4 304 B13R2.155 CC1=CC=C2C=CC(O)=CC2=C1 N12964 [1,1,0,0,0,0|1,0,0]=3 305 B13R2.155 CC1=CC=C2C=CC(O)=CC2=N1 AC4651 [1,1,0,0,0,0|2,0,0]=4 306 B13R2.155 CC1=CC=C2N=CC(Cl)=NC2=C1 26998 [1,1,0,0,0,0|2,0,0]=4 307 B13R2.155 CC1=CN=C2C=CC(Br)=CC2=C1 AC8709 [1,1,0,0,0,0|2,0,0]=4 308 B13R2.155 CC1=NC=C2C=CC(Cl)=CC2=C1 C72624 [1,1,0,0,0,0|2,0,0]=4 309 B13R2.155 ClC1=CC=C2C=CC(Br)=CC2=C1 74553 [1,1,0,0,0,0|2,0,0]=4 310 B13R2.155 ClC1=CC=C2N=CC(Br)=CC2=C1 80390 [1,1,0,0,0,0|2,0,0]=4 311 B13R2.155 ClC1=CN=C2C=CC(Br)=CC2=C1 80407 [1,1,0,0,0,0|2,0,0]=4 312 B13R2.155 FC1=CC=C2C=CC(Br)=NC2=C1 D71006 [1,1,0,0,0,0|2,0,0]=4 313 B13R2.155 FC1=CC=C2N=CC(Br)=CC2=C1 80396 [1,1,0,0,0,0|2,0,0]=4 314 B13R2.155 NC1=CC2=C(C=CC(=O)N2)C=C1 65843 [1,1,0,0,0,0|1,0,0]=3 315 B13R2.155 NC1=CC2=C(C=CC(=O)N2)C=N1 F51321 [1,1,0,0,0,0|2,0,0]=4 316 B13R2.155 NC1=CC=C2C=CC(Br)=CC2=N1 82402 [1,1,0,0,0,0|2,0,0]=4 317 B13R2.155 NC1=CC=C2C=CC(Cl)=CC2=N1 72244 [1,1,0,0,0,0|2,0,0]=4 318 B13R2.155 NC1=CC=C2C=CC(N)=CC2=C1 D82402 [1,1,0,0,0,0|2,0,0]=4 319 B13R2.155 NC1=CC=C2C=CC(O)=CC2=C1 C75426 [1,1,0,0,0,0|1,0,1]=4 320 B13R2.155 NC1=CC=C2N=CC(Cl)=CC2=C1 33243 [1,1,0,0,0,0|2,0,0]=4 321 B13R2.155 NC1=CC=C2N=CC(F)=CC2=C1 86894 [1,1,0,0,0,0|2,0,0]=4 322 B13R2.155 NC1=CN=C2C=CC(Br)=CC2=C1 80351 [1,1,0,0,0,0|2,0,0]=4 323 B13R2.155 NC1=CN=C2C=CC(Cl)=CC2=C1 80340 [1,1,0,0,0,0|2,0,0]=4 324 B13R2.155 NC1=CN=C2C=CC(F)=CC2=C1 68616 [1,1,0,0,0,0|2,0,0]=4 325 B13R2.155 NC1=CN=C2C=CC(O)=CC2=C1 80347 [1,1,0,0,0,0|2,0,0]=4 326 B13R2.155 O=C1C=C2C=C(Cl)C=CC2=CN1 C75412 [1,1,0,0,0,0|2,0,0]=4 327 B13R2.155 O=C1C=CC2=C(C=C(Cl)C=C2)O1 AC2173 [1,1,0,0,0,0|0,0,0]=2 328 B13R2.155 O=C1C=CC2=C(C=C(F)C=C2)N1 P11961 [1,1,0,0,0,0|1,0,0]=3 329 B13R2.155 O=C1C=CC2=NC=C(Br)C=C2N1 F15615 [1,1,0,0,0,0|2,0,0]=4 330 B13R2.155 O=C1C=CC2=NC=C(Cl)C=C2N1 91721 [1,1,0,0,0,0|2,0,0]=4 331 B13R2.155 O=C1C=CC2=NC=C(F)C=C2N1 F31204 [1,1,0,0,0,0|2,0,0]=4 332 B13R2.155 O=C1C=NC2=C(C=C(Br)C=C2)N1 52463 [1,1,0,0,0,0|2,0,0]=4 333 B13R2.155 O=C1C=NC2=C(C=C(Cl)C=C2)N1 57586 [1,1,0,0,0,0|2,0,0]=4 334 B13R2.155 O=C1C=NC2=C(C=C(F)C=C2)N1 D85368 [1,1,0,0,0,0|2,0,0]=4 335 B13R2.155 OC1=CC=C2C=CC(Cl)=CC2=C1 N14581 [1,1,0,0,0,0|1,0,1]=4 336 B13R2.155 OC1=CC=C2C=CC(Cl)=NC2=C1 W16896 [1,1,0,0,0,0|2,0,0]=4 337 B13R2.155 OC1=CC=C2N=CC(Br)=CC2=C1 80395 [1,1,0,0,0,0|2,0,0]=4 338 B13R2.155 OC1=CC=C2N=CC(F)=CC2=C1 80397 [1,1,0,0,0,0|2,0,0]=4 339 B13R2.155 OC1=CC=C2N=CC(I)=CC2=C1 C76988 [1,1,0,0,0,0|2,0,0]=4 340 B13R2.155 OC1=CN=C2C=CC(Br)=CC2=C1 83287 [1,1,0,0,0,0|2,0,0]=4 341 B13R2.155 OC1=CN=C2C=CC(Cl)=CC2=C1 33286 [1,1,0,0,0,0|2,0,0]=4 342 B13R2.155 OC1=CN=C2C=CC(F)=CC2=C1 33295 [1,1,0,0,0,0|2,0,0]=4 343 B13R2.162 BrC1=CC=C2N=CC=C(Br)C2=C1 C77176 [1,1,0,0,0,0|2,0,0]=4 344 B13R2.162 BrC1=NC2=C(Br)C=CC=C2C=C1 AR3599 [1,1,0,0,0,0|2,0,0]=4 345 B13R2.162 CC1=C2C=C(Br)C=CC2=CC=C1 97755 [1,1,0,0,0,0|2,0,0]=4 346 B13R2.162 CC1=C2C=C(I)C=CC2=NC=C1 C75712 [1,1,0,0,0,0|2,0,0]=4 347 B13R2.162 CC1=CC2=C(C=C1)OC=CC2=O D76209 [1,1,0,0,0,0|0,0,0]=2 348 B13R2.162 CC1=CC2=C(C=CNC2=O)C=C1 F30995 [1,1,0,0,0,0|2,0,0]=4 349 B13R2.162 CC1=CC2=C(N)C=CC=C2C=N1 96525 [1,1,0,0,0,0|2,0,0]=4 350 B13R2.162 CC1=CC=C2C=CC=C(Cl)C2=C1 P16840 [1,1,0,0,0,0|1,0,0]=3 351 B13R2.162 CC1=CC=C2C=CN=C(O)C2=C1 32391 [1,1,0,0,0,0|2,0,0]=4 352 B13R2.162 CC1=CC=C2C=NC=C(Br)C2=C1 Y10378 [1,1,0,0,0,0|2,0,0]=4 353 B13R2.162 CC1=CC=C2N=CC=C(Cl)C2=C1 27969 [1,1,0,0,0,0|1,0,0]=3 354 B13R2.162 CC1=CC=C2N=CC=C(O)C2=C1 C74209 [1,1,0,0,0,0|1,0,0]=3 355 B13R2.162 CC1=CN=C2C=CC=C(Br)C2=C1 C15736 [1,1,0,0,0,0|2,0,0]=4 356 B13R2.162 CC1=NC2=C(C)C=CC=C2C=C1 F12427 [1,1,0,0,0,0|2,0,0]=4 357 B13R2.162 CC1=NC=C2C=CC=C(Br)C2=C1 78671 [1,1,0,0,0,0|2,0,0]=4 358 B13R2.162 ClC1=C2C=C(Br)C=CC2=CC=C1 A10733 [1,1,0,0,0,0|2,0,0]=4 359 B13R2.162 ClC1=C2C=C(I)C=CC2=NC=C1 52947 [1,1,0,0,0,0|2,0,0]=4 360 B13R2.162 ClC1=CC=C2N=CC=C(Br)C2=C1 82809 [1,1,0,0,0,0|2,0,0]=4 361 B13R2.162 FC1=C2C=C(Br)C=CC2=NC=C1 F51276 [1,1,0,0,0,0|2,0,0]=4 362 B13R2.162 FC1=CC=C2N=CC=C(Br)C2=C1 82808 [1,1,0,0,0,0|2,0,0]=4 363 B13R2.162 NC1=C2C=C(Br)C=CC2=CC=C1 D93765 [1,1,0,0,0,0|2,0,0]=4 364 B13R2.162 NC1=C2C=C(Br)C=CC2=CC=C1 W18066 [1,1,0,0,0,0|2,0,0]=4 365 B13R2.162 NC1=C2C=C(Br)C=CC2=NC=C1 AB1038 [1,1,0,0,0,0|2,0,0]=4 366 B13R2.162 NC1=CC=C2C=CC=C(Br)C2=N1 80380 [1,1,0,0,0,0|2,0,0]=4 367 B13R2.162 NC1=CC=C2C=CC=C(Cl)C2=N1 80212 [1,1,0,0,0,0|2,0,0]=4 368 B13R2.162 NC1=CC=C2C=CC=C(F)C2=N1 80374 [1,1,0,0,0,0|2,0,0]=4 369 B13R2.162 NC1=CC=C2C=CC=C(O)C2=C1 Y11357 [1,1,0,0,0,0|2,0,0]=4 370 B13R2.162 NC1=CC=C2C=CC=C(O)C2=N1 F11664 [1,1,0,0,0,0|2,0,0]=4 371 B13R2.162 NC1=CC=C2N=CC=C(Br)C2=C1 80373 [1,1,0,0,0,0|2,0,0]=4 372 B13R2.162 NC1=CC=C2N=CC=C(Cl)C2=C1 80372 [1,1,0,0,0,0|2,0,0]=4 373 B13R2.162 O=C1C=CC2=CC=CC(F)=C2N1 C76281 [1,1,0,0,0,0|1,0,0]=3 374 B13R2.162 O=C1C=CC2=CC=CC(O)=C2O1 F19924 [1,1,0,0,0,0|0,0,0]=2 375 B13R2.162 O=C1C=CNC2=C1C=C(I)C=C2 P11687 [1,1,0,0,0,0|2,0,0]=4 376 B13R2.162 O=C1C=NC2=CC=CC(Br)=C2N1 76432 [1,1,0,0,0,0|2,0,0]=4 377 B13R2.162 OC1=C2C=C(Cl)C=CC2=CC=C1 W18102 [1,1,0,0,0,0|2,0,0]=4 378 B13R2.162 OC1=C2C=C(F)C=CC2=CC=C1 S10318 [1,1,0,0,0,0|2,0,0]=4 379 B13R2.162 OC1=C2N=C(Cl)C=CC2=CC=C1 F30117 [1,1,0,0,0,0|2,0,0]=4 380 B13R2.162 OC1=CC=C2C=CC=C(Br)C2=C1 N12565 [1,1,0,0,0,0|1,0,1]=4 381 B13R2.162 OC1=CC=C2C=CC=C(Cl)C2=C1 Y11367 [1,1,0,0,0,0|1,0,1]=4 382 B13R2.162 OC1=CC=C2C=CC=C(F)C2=C1 83450 [1,1,0,0,0,0|1,0,1]=4 383 B13R2.162 OC1=CC=C2N=CC=C(Br)C2=C1 F53413 [1,1,0,0,0,0|2,0,0]=4 384 B13R2.162 OC1=CC=C2N=CC=C(Cl)C2=C1 C72816 [1,1,0,0,0,0|2,0,0]=4 385 B13R2.222 CC1(C)C=CC2=C(C=CC=C2)O1 D78717 [1,1,0,0,0,0|1,0,1]=4 386 B13R2.222 O=S1(=O)N=CC2=C(C=CC=C2)O1 W19517 [1,1,0,0,0,0|2,0,0]=4 387 B13R2.328 C=C1OC(=O)NC2=C1C=CC=C2 A10123 [1,1,0,0,0,0|2,0,0]=4 388 B13R2.328 CC1=CC(=O)NC2=NC=CC=C12 33279 [1,1,0,0,0,0|2,0,0]=4 389 B13R2.328 CC1=CC(=O)OC2=C1C=CC=C2 63779 [1,1,0,0,0,0|0,0,0]=2 390 B13R2.328 CC1=CC(Br)=NC2=CC=CC=C12 94407 [1,1,0,0,0,0|2,0,0]=4 391 B13R2.328 CC1=CC(N)=NC2=CC=CC=C12 88227 [1,1,0,0,0,0|2,0,0]=4 392 B13R2.328 CC1=CC2=C(C=CC=C2)C(=O)N1 F13592 [1,1,0,0,0,0|2,0,0]=4 393 B13R2.328 CC1=CC2=CC=CC=C2C(Br)=C1 N10649 [1,1,0,0,0,0|1,0,0]=3 394 B13R2.328 CC1=CC2=CC=CC=C2C(Cl)=N1 58010 [1,1,0,0,0,0|2,0,0]=4 395 B13R2.328 CC1=CC2=CC=CC=C2C(N)=C1 N13183 [1,1,0,0,0,0|1,0,0]=3 396 B13R2.328 CC1=CC2=CC=CN=C2C(Cl)=C1 27754 [1,1,0,0,0,0|1,0,0]=3 397 B13R2.328 CC1=CC2=CC=CN=C2C(O)=C1 C73976 [1,1,0,0,0,0|1,0,0]=3 398 B13R2.328 CC1=NC2=CC=CC=C2C(Br)=C1 35493 [1,1,0,0,0,0|2,0,0]=4 399 B13R2.328 CC1=NC2=CC=CC=C2C(I)=C1 P17848 [1,1,0,0,0,0|2,0,0]=4 400 B13R2.328 ClC1=CC(I)=CC2=CC=CN=C12 C71381 [1,1,0,0,0,0|2,0,0]=4 401 B13R2.328 ClC1=CC2=CC=CN=C2C(Br)=C1 84590 [1,1,0,0,0,0|2,0,0]=4 402 B13R2.328 NC1=CC(=O)NC2=C1C=CC=C2 35478 [1,1,0,0,0,0|1,0,0]=3 403 B13R2.328 NC1=CC(Br)=CC2=CC=CN=C12 C75683 [1,1,0,0,0,0|2,0,0]=4 404 B13R2.328 NC1=CC(Br)=NC2=CC=CC=C12 C74900 [1,1,0,0,0,0|2,0,0]=4 405 B13R2.328 NC1=CC(Cl)=CC2=CC=CN=C12 Y10968 [1,1,0,0,0,0|2,0,0]=4 406 B13R2.328 NC1=CC(F)=CC2=CC=CN=C12 A50072 [1,1,0,0,0,0|2,0,0]=4 407 B13R2.328 NC1=CC(O)=CC2=CC=CN=C12 D70468 [1,1,0,0,0,0|2,0,0]=4 408 B13R2.328 NC1=CC2=CC=CC=C2C(Br)=C1 O11192 [1,1,0,0,0,0|2,0,0]=4 409 B13R2.328 NC1=CC2=CC=CN=C2C(Cl)=C1 O11673 [1,1,0,0,0,0|2,0,0]=4 410 B13R2.328 NC1=CC2=CC=CN=C2C(F)=C1 D83276 [1,1,0,0,0,0|2,0,0]=4 411 B13R2.328 NC1=NC2=CC=CC=C2C(Br)=C1 C74899 [1,1,0,0,0,0|2,0,0]=4 412 B13R2.328 O=C1C=C(Br)C2=C(C=CC=C2)N1 F52101 [1,1,0,0,0,0|1,0,0]=3 413 B13R2.328 O=C1C=C(Cl)C2=C(C=CC=C2)N1 51680 [1,1,0,0,0,0|1,0,0]=3 414 B13R2.328 O=C1CC2=C(C=CC=C2)C(=O)N1 Y10382 [1,1,0,0,0,0|2,0,0]=4 415 B13R2.328 OC1=CC(Br)=CC2=CC=CC=C12 F19625 [1,1,0,0,0,0|2,0,0]=4 416 B13R2.328 OC1=CC(Br)=CC2=CC=CN=C12 F52175 [1,1,0,0,0,0|2,0,0]=4 417 B13R2.328 OC1=CC(Cl)=CC2=CC=CN=C12 71757 [1,1,0,0,0,0|2,0,0]=4 418 B13R2.328 OC1=CC(Cl)=NC2=CC=CC=C12 27588 [1,1,0,0,0,0|2,0,0]=4 419 B13R2.328 OC1=CC(F)=CC2=CC=CN=C12 27630 [1,1,0,0,0,0|2,0,0]=4 420 B13R2.328 OC1=CC2=CC=CN=C2C(Br)=C1 87935 [1,1,0,0,0,0|2,0,0]=4 421 B13R2.328 OC1=CC2=CC=CN=C2C(F)=C1 K10191 [1,1,0,0,0,0|2,0,0]=4 422 B13R2.369 CC1=CC2=CC=CC=C2C=C1C A12662 [1,1,0,0,0,0|1,0,0]=3 423 B13R2.369 CC1=CC2=NC=CN=C2C=C1Br D95157 [1,1,0,0,0,0|2,0,0]=4 424 B13R2.369 CC1=NC2=CC=CC=C2C=C1N 84046 [1,1,0,0,0,0|2,0,0]=4 425 B13R2.369 FC1=CC2=CC=CN=C2C=C1F D94475 [1,1,0,0,0,0|2,0,0]=4 426 B13R2.369 NC1=CC2=C(C=CC=C2)OC1=O 79239 [1,1,0,0,0,0|0,0,0]=2 427 B13R2.369 NC1=CC2=CC=CC=C2C=C1Br F13558 [1,1,0,0,0,0|2,0,0]=4 428 B13R2.369 NC1=CC2=CC=CC=C2C=C1I 68062 [1,1,0,0,0,0|2,0,0]=4 429 B13R2.369 NC1=CC2=CC=CC=C2N=C1Cl AC1585 [1,1,0,0,0,0|2,0,0]=4 430 B13R2.369 NC1=CC2=CC=CN=C2C=C1F 95701 [1,1,0,0,0,0|2,0,0]=4 431 B13R2.369 NC1=NC2=CC=CC=C2C=C1Br 25602 [1,1,0,0,0,0|2,0,0]=4 432 B13R2.369 O=C1NC2=C(C=CC=C2)C=C1Br F10206 [1,1,0,0,0,0|1,0,0]=3 433 B13R2.369 O=C1NC2=C(C=CC=C2)C=C1O 67380 [1,1,0,0,0,0|1,0,0]=3 434 B13R2.369 O=C1NC2=C(C=CC=C2)N=C1Cl 38522 [1,1,0,0,0,0|2,0,0]=4 435 B13R2.369 O=C1OC2=C(C=CC=C2)C=C1Br 57054 [1,1,0,0,0,0|0,0,0]=2 436 B13R2.369 O=C1OC2=C(C=CC=C2)N=C1Cl W10453 [1,1,0,0,0,0|1,0,0]=3 437 B13R2.369 O=C1OC2=C(C=CC=C2)N=C1O 98636 [1,1,0,0,0,0|1,0,0]=3 438 B13R2.369 OC1=CC2=CC=CC=C2C=C1Br T70735 [1,1,0,0,0,0|1,0,1]=4 439 B13R2.369 OC1=CC2=CC=CC=C2C=C1O AC2509 [1,1,0,0,0,0|1,0,1]=4 440 B13R2.369 OC1=CC2=CC=CC=C2N=C1Cl 87954 [1,1,0,0,0,0|2,0,0]=4 441 B13R2.5179 CC1=CC2=C(C=C1)C(=O)NC=C2 W11384 [1,1,0,0,0,0|2,0,0]=4 442 B13R2.5179 CC1=CC2=CC=CC(N)=C2N=C1 D72054 [1,1,0,0,0,0|2,0,0]=4 443 B13R2.5179 CC1=CC=C2C(Br)=CC=CC2=N1 AC2042 [1,1,0,0,0,0|2,0,0]=4 444 B13R2.5179 CC1=CC=C2C(Cl)=CC=CC2=N1 H10153 [1,1,0,0,0,0|2,0,0]=4 445 B13R2.5179 CC1=CC=C2C(N)=CC=CC2=C1 C71537 [1,1,0,0,0,0|1,0,0]=3 446 B13R2.5179 CC1=CC=CC2=NC(=O)C=CN12 T71871 [1,1,0,0,0,0|2,0,0]=4 447 B13R2.5179 CC1=CN=C2C(O)=CC=CC2=C1 D82795 [1,1,0,0,0,0|2,0,0]=4 448 B13R2.5179 CC1=NC2=CC=CC(N)=C2C=C1 76214 [1,1,0,0,0,0|2,0,0]=4 449 B13R2.5179 CC1=NC=C2C(Br)=CC=CC2=C1 D79826 [1,1,0,0,0,0|2,0,0]=4 450 B13R2.5179 ClC1=CC=C2C(Br)=CC=CC2=N1 82180 [1,1,0,0,0,0|2,0,0]=4 451 B13R2.5179 ClC1=NC2=CC=CC(Cl)=C2C=C1 80783 [1,1,0,0,0,0|2,0,0]=4 452 B13R2.5179 FC1=C2C=CC(Cl)=NC2=CC=C1 CL1043 [1,1,0,0,0,0|2,0,0]=4 453 B13R2.5179 NC1=CC=C2C(Br)=CC=CC2=N1 82208 [1,1,0,0,0,0|2,0,0]=4 454 B13R2.5179 NC1=CC=C2C(Cl)=CC=CC2=N1 C76155 [1,1,0,0,0,0|2,0,0]=4 455 B13R2.5179 NC1=CC=C2C(O)=CC=CC2=C1 A51054 [1,1,0,0,0,0|2,0,0]=4 456 B13R2.5179 NC1=CC=CC2=C1C=CC(=O)N2 69226 [1,1,0,0,0,0|1,0,0]=3 457 B13R2.5179 NC1=CC=CC2=C1N=CC(=O)N2 D82625 [1,1,0,0,0,0|2,0,0]=4 458 B13R2.5179 O=C1C=CC2=C(Br)C=CC=C2N1 69227 [1,1,0,0,0,0|1,0,0]=3 459 B13R2.5179 O=C1C=CC2=C(C=CC=C2O)N1 30613 [1,1,0,0,0,0|1,0,0]=3 460 B13R2.5179 O=C1C=CC2=C(O)C=CN=C2N1 59621 [1,1,0,0,0,0|2,0,0]=4 461 B13R2.5179 O=C1N=CC2=C(Cl)C=CC=C2N1 F15806 [1,1,0,0,0,0|2,0,0]=4 462 B13R2.5179 OC1=C2C=CC(Br)=CC2=CC=C1 21067 [1,1,0,0,0,0|2,0,0]=4 463 B13R2.5179 OC1=C2C=CC(Cl)=CC2=CC=C1 53844 [1,1,0,0,0,0|2,0,0]=4 464 B13R2.5179 OC1=C2C=CC(F)=CC2=CC=C1 53843 [1,1,0,0,0,0|2,0,0]=4 465 B13R2.5179 OC1=CC=C2C(Br)=CC=CC2=C1 N14953 [1,1,0,0,0,0|1,0,1]=4 466 B13R2.5179 OC1=CC=C2C(F)=CC=CC2=C1 N14954 [1,1,0,0,0,0|1,0,1]=4 467 B13R2.43 CC1=CC2=C(C=C1)NC(C#N)=C2 A12085 [0,1,0,0,1,0|2,0,0]=4 468 B13R2.43 CCC1=CC2=C(C=CC(Br)=C2)O1 O11365 [0,1,0,0,1,0|2,0,0]=4 469 B13R2.43 O=CC1=CC2=C(C=CC(Br)=C2)N1 25706 [0,1,0,0,1,0|2,0,0]=4 470 B13R2.43 O=CC1=CC2=C(C=CC(Br)=C2)S1 D75718 [0,1,0,0,1,0|1,1,0]=4 471 B13R2.2121 CC1=NC2=C(C=CC(CO)=C2)O1 C72464 [0,1,0,0,1,0|2,0,0]=4 472 B13R2.2121 COC1=CC2=C(C=C1)NC(=O)S2 25963 [0,1,0,0,1,0|2,0,0]=4 473 B13R2.2121 COC1=CC2=C(C=C1)OC(Cl)=N2 F50763 [0,1,0,0,1,0|2,0,0]=4 474 B13R2.2121 COC1=CC2=C(C=C1)SC(=O)N2 36536 [0,1,0,0,1,0|1,1,0]=4 475 B13R2.2121 NCC1=CC2=C(C=C1)NC(=O)C2 D80888 [0,1,0,0,1,0|1,0,1]=4 476 B13R2.2121 O=C1CC2=C(C=CC(CO)=C2)N1 P12642 [0,1,0,0,1,0|1,0,1]=4 477 B13R2.3028 CC1=CC2=C(C=C1)OC(=O)N2C W16975 [0,1,0,0,1,0|1,0,0]=3 478 B13R2.3028 CN1C(=O)OC2=C1C=C(Br)C=C2 53498 [0,1,0,0,1,0|2,0,0]=4 479 B13R2.5190 CC1=CC2=C(C=C1)C(=O)C(=O)N2 30937 [0,1,0,0,1,0|2,0,0]=4 480 B13R2.5397 CC1=CC2=C(NC(=O)C2)C(C)=C1 C76321 [0,1,0,0,1,0|1,0,1]=4 481 B13R2.5397 NC1=CC(F)=C2OC(=O)NC2=C1 79371 [0,1,0,0,1,0|2,0,0]=4 482 B13R2.13083 CC1=CC2=C(C=C1O)CC(=O)N2 85915 [0,1,0,0,1,0|2,0,0]=4 483 B13R2.13083 O=C1NC2=CC(Cl)=C(Br)C=C2O1 O11552 [0,1,0,0,1,0|2,0,0]=4 484 B13R2.2130 CN1C=CC2=C1C=CC(CN)=C2 71794 [0,1,0,0,1,0|2,0,0]=4 485 B13R2.2130 COC1=CC2=C(C=C1)C(=O)C=C2 N13246 [0,1,0,0,1,0|0,0,0]=2 486 B13R2.2130 COC1=CC2=C(C=C1)C(=O)CO2 88998 [0,1,0,0,1,0|1,0,1]=4 487 B13R2.2130 COC1=CC2=C(C=C1)C(=O)OC2 Y10227 [0,1,0,0,1,0|1,0,1]=4 488 B13R2.2130 COC1=CC2=C(C=C1)C(=O)ON2 W13527 [0,1,0,0,1,0|2,0,0]=4 489 B13R2.2130 COC1=CC2=C(C=C1)C(C)=CN2 D86192 [0,1,0,0,1,0|2,0,0]=4 490 B13R2.2130 COC1=CC2=C(C=C1)C(C)=CO2 D82922 [0,1,0,0,1,0|2,0,0]=4 491 B13R2.5180 CC1=C(Br)C2=C(C=C1)C(=O)CC2 Y10955 [0,1,0,0,1,0|0,0,2]=4 492 B13R2.5180 CC1=C(Cl)C2=C(C=C1)C(=O)CC2 F52800 [0,1,0,0,1,0|0,0,2]=4 493 B13R2.5180 CC1=C(O)C2=C(C=C1)C(=O)CC2 Y12597 [0,1,0,0,1,0|0,0,2]=4 494 B13R2.5187 O=C1NC(=O)C2=C1C=CC(O)=C2 C75379 [0,1,0,0,1,0|2,0,0]=4 495 B13R2.5187 O=C1OC(=O)C2=C1C=CC(O)=C2 C10538 [0,1,0,0,1,0|2,0,0]=4 496 B13R2.11634 CC1=C(Br)C=C2C(=O)CCC2=C1 N10659 [0,1,0,0,1,0|0,0,2]=4 497 B13R2.11634 CC1=C(Cl)C=C2C(=O)CCC2=C1 N10623 [0,1,0,0,1,0|0,0,2]=4 498 B13R2.11642 CC1=CC(C)=C2C(=O)CCC2=C1 Y10959 [0,1,0,0,1,0|0,0,2]=4 499 B15R2.1754 COC1=CC2=C(C=C1O)OC(=O)C=C2 TD8126 [0,2,0,0,0,0|0,0,0]=2 500 B15R2.4778 COC1=C(Br)C2=CC=C(Br)C=C2C=C1 AB10336 [0,2,0,0,0,0|2,0,0]=4 501 B15R2.4780 C=CC1=CC=C2C=C(OC)C=CC2=C1 C16129 [0,2,0,0,0,0|2,0,0]=4 502 B15R2.4780 CCC1=CC=C2C=C(OC)C=CC2=C1 A12271 [0,2,0,0,0,0|1,0,1]=4 503 B15R2.4780 O=CC1=CC=C2C=C(C=O)C=CC2=C1 D84080 [0,2,0,0,0,0|1,0,1]=4 504 B15R2.7180 CC(=O)C1=CC2=CC=C(N)C=C2C=C1 81652 [0,2,0,0,0,0|2,0,0]=4 505 B15R2.7180 CC(=O)C1=CC=C2C=C(Br)C=CC2=C1 11591 [0,2,0,0,0,0|2,0,0]=4 506 B15R2.7180 CC(=O)C1=CC=C2C=C(F)C=CC2=C1 D83927 [0,2,0,0,0,0|2,0,0]=4 507 B15R2.7180 CC1=CC=C2N=C(C(=O)O)C=CC2=C1 72196 [0,2,0,0,0,0|1,0,0]=3 508 B15R2.7180 CN(C)C1=CC=C2C=C(Br)C=CC2=C1 AC7990 [0,2,0,0,0,0|2,0,0]=4 509 B15R2.7180 NC(=O)C1=CC=C2C=C(Br)C=CC2=C1 AB10406 [0,2,0,0,0,0|2,0,0]=4 510 B15R2.7180 NC1=CC=C2C=C([N+](=O)[O-])C=CC2=C1 C15577 [0,2,0,0,0,0|2,0,0]=4 511 B15R2.7180 O=C(O)C1=CC=C2C=C(Br)C=CC2=N1 54791 [0,2,0,0,0,0|2,0,0]=4 512 B15R2.7180 O=C(O)C1=CC=C2C=C(Cl)C=CC2=N1 50648 [0,2,0,0,0,0|2,0,0]=4 513 B15R2.7180 O=C(O)C1=CC=C2C=C(F)C=CC2=C1 78117 [0,2,0,0,0,0|2,0,0]=4 514 B15R2.7180 O=C(O)C1=CC=C2C=C(F)C=CC2=N1 80317 [0,2,0,0,0,0|2,0,0]=4 515 B15R2.7180 O=C(O)C1=NC2=CC=C(O)C=C2C=C1 72248 [0,2,0,0,0,0|2,0,0]=4 516 B15R2.10252 CCOC1=CC2=CC=C(N)C=C2C=C1 F17462 [0,2,0,0,0,0|2,0,0]=4 517 B15R2.21329 COC1=CC=C2N=C(Cl)C=C(Cl)C2=C1 83912 [0,2,0,0,0,0|2,0,0]=4 518 B15R2.21336 COC1=CC=C2N=C(Cl)C(C)=CC2=C1 71372 [0,2,0,0,0,0|2,0,0]=4 519 B15R2.1007 CC1=CC=C2N=C(C)C(C)=C(O)C2=C1 C90402 [0,2,0,0,0,0|2,0,0]=4 520 B15R2.89950 CC1=CC2=C(C=C1)OC(=O)C=C2CCl D96048 [0,2,0,0,0,0|0,0,0]=2 521 B15R2.1824 N#CC1=CC2=C(C=CC(Br)=C2)NC1=O W10476 [0,2,0,0,0,0|2,0,0]=4 522 B15R2.63924 CC1=CC=C2C(Br)=C(C)C=CC2=C1Br 60620 [0,2,0,0,0,0|2,0,0]=4 523 B13R2.371 CC1=CC=C(Br)C2=CC=CN=C12 31113 [0,0,1,1,0,0|2,0,0]=4 524 B13R2.371 CC1=CC=C(N)C2=CC=CC=C12 C10182 [0,0,1,1,0,0|2,0,0]=4 525 B13R2.371 CC1=CC=C(O)C2=NC=CC=C12 AB1120 [0,0,1,1,0,0|2,0,0]=4 526 B13R2.371 OC1=CC=C(Cl)C2=NC=CC=C12 33820 [0,0,1,1,0,0|2,0,0]=4 527 B13R2.342 CC1=C2C=CN=C(Cl)C2=CC=C1 Y10371 [0,0,1,1,0,0|2,0,0]=4 528 B13R2.342 CC1=NC=CC2=C(C)C=CC=C12 F30682 [0,0,1,1,0,0|2,0,0]=4 529 B13R2.342 O=C1NC=CC2=C(Cl)C=CC=C12 69136 [0,0,1,1,0,0|2,0,0]=4 530 B13R2.342 O=C1OC=CC2=C(Br)C=CC=C12 32120 [0,0,1,1,0,0|1,0,0]=3 531 B11R1.22 C=CC(=O)C1=CC=C(F)C=C1 AB9399 [0,0,1,0,1,0|1,0,0]=3 532 B11R1.22 CC1=CC=C(C(=O)CCl)C=C1 D93745 [0,0,1,0,1,0|1,0,1]=4 533 B11R1.75 CC1=CC(\C=C\C(=O)O)=NO1 W18280 [0,0,1,0,1,0|2,0,0]=4 534 B11R1.157 CC1=CC(CC(=O)O)=CN=C1 D80704 [0,0,1,0,1,0|1,0,1]=4 535 B11R1.157 CC1=CC(CC(=O)O)=CN=C1 P17359 [0,0,1,0,1,0|1,0,1]=4 536 B11R1.157 CC1=CC(CC(=O)O)=NC=C1 S10096 [0,0,1,0,1,0|1,0,1]=4 537 B11R1.157 CC1=CC=CC(CC(=O)O)=N1 26369 [0,0,1,0,1,0|1,0,1]=4 538 B11R1.166 CC(=O)C1=C(Br)C=C(C)C=C1 77817 [0,0,1,0,1,0|1,0,1]=4 539 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 W18192 [0,0,1,0,1,0|1,0,1]=4 540 B11R2.1 CC1=CCC2=C1C=CC=C2 C76459 [1,0,0,0,1,0|1,0,1]=4 541 B11R2.1 ClC1=COC2=C1C=CC=C2 F14423 [1,0,0,0,1,0|2,0,0]=4 542 B11R2.1 NC1=CNC2=C1C=CC=C2 51896 [1,0,0,0,1,0|2,0,0]=4 543 B11R2.1 NC1=CSC2=C1C=CC=C2 25380 [1,0,0,0,1,0|2,0,0]=4 544 B11R2.1 O=C1C=CC2=C1C=CC=C2 O10409 [1,0,0,0,1,0|0,0,0]=2 545 B11R2.1 O=C1CSC2=C1C=CC=C2 26760 [1,0,0,0,1,0|1,0,1]=4 546 B11R2.10 BrC1=CC2=C(C=CC=C2)O1 30106 [1,0,0,0,1,0|1,0,0]=3 547 B11R2.10 CC1=CC2=C(C=CC=C2)O1 F11695 [1,0,0,0,1,0|1,0,0]=3 548 B11R2.10 CC1=CC2=NC=CC=C2N1 27734 [1,0,0,0,1,0|2,0,0]=4 549 B11R2.10 CC1=CN2C=CC=CC2=C1 AC8553 [1,0,0,0,1,0|2,0,0]=4 550 B11R2.10 ClC1=CC2=C(C=CC=C2)N1 F11679 [1,0,0,0,1,0|2,0,0]=4 551 B11R2.10 IC1=CC2=C(C=CC=C2)N1 F18254 [1,0,0,0,1,0|2,0,0]=4 552 B11R2.10 IC1=CC2=C(C=CC=C2)O1 D83864 [1,0,0,0,1,0|1,0,0]=3 553 B11R2.10 IC1=CC2=C(C=CC=C2)S1 F13439 [1,0,0,0,1,0|1,1,0]=4 554 B11R2.10 NC1=CC2=C(C=CC=C2)S1 27373 [1,0,0,0,1,0|1,1,0]=4 555 B11R2.10 O=C1NC2=C(C=CN=C2)O1 AC6441 [1,0,0,0,1,0|2,0,0]=4 556 B11R2.10 O=C1NC2=C(C=NC=C2)O1 O12039 [1,0,0,0,1,0|2,0,0]=4 557 B11R2.10 O=C1NC2=C(N=CC=C2)O1 O12038 [1,0,0,0,1,0|2,0,0]=4 558 B11R2.36 BrC1=CC2=C(C=C1)ON=C2 25694 [1,0,0,0,1,0|2,0,0]=4 559 B11R2.36 BrC1=CN=C2OC=CC2=C1 83432 [1,0,0,0,1,0|2,0,0]=4 560 B11R2.36 CC1=CC2=C(C=C1)SC=C2 F11127 [1,0,0,0,1,0|0,1,0]=3 561 B11R2.36 CC1=CC2=C(C=CS2)C=C1 C73204 [1,0,0,0,1,0|1,0,0]=3 562 B11R2.36 CC1=CN=C2C=CNC2=C1 54346 [1,0,0,0,1,0|2,0,0]=4 563 B11R2.36 CC1=CN=C2NC=CC2=C1 25496 [1,0,0,0,1,0|2,0,0]=4 564 B11R2.36 CC1=NC2=C(C=C1)NC=C2 82266 [1,0,0,0,1,0|2,0,0]=4 565 B11R2.36 CC1=NC=C2C=CNC2=C1 76378 [1,0,0,0,1,0|2,0,0]=4 566 B11R2.36 CC1=NC=C2NC=CC2=C1 76311 [1,0,0,0,1,0|2,0,0]=4 567 B11R2.36 ClC1=CC2=C(C=C1)CC=C2 53583 [1,0,0,0,1,0|1,0,1]=4 568 B11R2.36 ClC1=CC2=C(C=C1)ON=C2 D78570 [1,0,0,0,1,0|2,0,0]=4 569 B11R2.36 ClC1=CC2=C(C=CC2)C=C1 F13902 [1,0,0,0,1,0|1,0,1]=4 570 B11R2.36 ClC1=NC2=C(C=C1)OC=C2 P11783 [1,0,0,0,1,0|2,0,0]=4 571 B11R2.36 FC1=CC2=C(C=C1)OC=C2 F30233 [1,0,0,0,1,0|1,0,0]=3 572 B11R2.36 FC1=CC2=C(C=CS2)C=C1 P15213 [1,0,0,0,1,0|2,0,0]=4 573 B11R2.36 IC1=CC2=C(C=C1)ON=C2 C77293 [1,0,0,0,1,0|2,0,0]=4 574 B11R2.36 NC1=CC2=C(C=CO2)C=C1 D70068 [1,0,0,0,1,0|2,0,0]=4 575 B11R2.36 OC1=CC2=C(C=C1)OC=N2 AC4843 [1,0,0,0,1,0|2,0,0]=4 576 B11R2.36 OC1=CC2=C(C=C1)SC=C2 59802 [1,0,0,0,1,0|1,1,0]=4 577 B11R2.36 OC1=CC2=C(C=CO2)C=C1 84605 [1,0,0,0,1,0|2,0,0]=4 578 B13R1.149 CC1=CC=CC(OCCC(=O)O)=C1 AC1695 [0,0,1,0,0,1|0,0,2]=4 579 B13R1.149 O=C(O)C\C=C\C1=CC=CC(F)=C1 21126 [0,0,1,0,0,1|1,0,0]=3