0 B13R2.3683 BrC1=CC=C2C=C(I)N=NC2=C1 F51337 [0,0,0,0,0,0|4,0,0]=4 1 B13R2.3683 CC1=CC2=C(C=C1)NC(=O)CO2 AC6060 [0,0,0,0,0,0|3,0,1]=4 2 B13R2.3683 CC1=CC2=C(C=C1)NC(=O)N=C2 F15802 [0,0,0,0,0,0|3,0,0]=3 3 B13R2.3683 CC1=CC2=CC=C(N)C=C2N=C1 K10051 [0,0,0,0,0,0|3,0,0]=3 4 B13R2.3683 CC1=CC=C2C=C(Br)C=CC2=C1 D78656 [0,0,0,0,0,0|2,0,0]=2 5 B13R2.3683 CC1=CC=C2C=C(Cl)N=CC2=C1 W16225 [0,0,0,0,0,0|3,0,0]=3 6 B13R2.3683 CC1=CC=C2N=C(N)C=NC2=C1 92064 [0,0,0,0,0,0|4,0,0]=4 7 B13R2.3683 CC1=CC=C2N=C(N)C=NC2=C1 92082 [0,0,0,0,0,0|4,0,0]=4 8 B13R2.3683 CC1=CC=C2N=C(N)C=NC2=C1 92083 [0,0,0,0,0,0|4,0,0]=4 9 B13R2.3683 CC1=CN=C2C=C(Br)C=CC2=N1 91922 [0,0,0,0,0,0|4,0,0]=4 10 B13R2.3683 CC1=CN=C2C=C(I)C=CC2=N1 91923 [0,0,0,0,0,0|4,0,0]=4 11 B13R2.3683 CC1=CN=C2N=C(C)C=CC2=C1 D75079 [0,0,0,0,0,0|4,0,0]=4 12 B13R2.3683 CC1=NC2=CC=C(N)C=C2N=C1 91921 [0,0,0,0,0,0|4,0,0]=4 13 B13R2.3683 CC1=NC=C2C=C(Cl)C=CC2=N1 91919 [0,0,0,0,0,0|4,0,0]=4 14 B13R2.3683 CC1=NC=C2C=C(F)C=CC2=N1 91915 [0,0,0,0,0,0|4,0,0]=4 15 B13R2.3683 CC1=NC=C2C=C(I)C=CC2=N1 91918 [0,0,0,0,0,0|4,0,0]=4 16 B13R2.3683 N=C1C=C2C=CC(Br)=CC2=CN1 O11642 [0,0,0,0,0,0|3,0,0]=3 17 B13R2.3683 NC1=CC2=C(C=C1)NC(=O)C=C2 P10166 [0,0,0,0,0,0|2,0,0]=2 18 B13R2.3683 NC1=CC2=C(C=C1)NC(=O)OC2 AC7323 [0,0,0,0,0,0|3,0,1]=4 19 B13R2.3683 NC1=CC=C2C=C(Br)C=CC2=N1 S11534 [0,0,0,0,0,0|3,0,0]=3 20 B13R2.3683 NC1=CC=C2C=C(F)C=CC2=C1 C72558 [0,0,0,0,0,0|2,0,0]=2 21 B13R2.3683 NC1=CC=C2C=C(O)C=CC2=C1 AT25693 [0,0,0,0,0,0|1,0,1]=2 22 B13R2.3683 NC1=NC=C2C=C(F)C=CC2=N1 AC5166 [0,0,0,0,0,0|4,0,0]=4 23 B13R2.3683 O=C1C=CN2N=C(Cl)C=CC2=N1 O11645 [0,0,0,0,0,0|4,0,0]=4 24 B13R2.3683 O=C1COC2=C(C=CC(F)=C2)N1 25433 [0,0,0,0,0,0|3,0,1]=4 25 B13R2.3683 O=C1N=CC2=C(C=CC(Cl)=C2)N1 F15803 [0,0,0,0,0,0|3,0,0]=3 26 B13R2.3683 O=C1N=CC2=C(C=CC(F)=C2)N1 F15804 [0,0,0,0,0,0|3,0,0]=3 27 B13R2.3683 O=C1NC2=C(C=C(F)C=C2)CO1 AC4756 [0,0,0,0,0,0|3,0,1]=4 28 B13R2.3683 O=C1NC2=C(C=C(I)C=C2)CO1 AC5099 [0,0,0,0,0,0|3,0,1]=4 29 B13R2.3683 OC1=CC=C2C=C(I)C=CC2=N1 F18811 [0,0,0,0,0,0|2,0,1]=3 30 B13R2.3683 OC1=CN=C2C=C(Cl)C=CC2=C1 33310 [0,0,0,0,0,0|2,0,1]=3 31 B12R2.24 CC1=CC2=C(C=CC=C2)CN1 F12577 [1,0,0,0,0,0|2,0,1]=4 32 B12R2.24 FC1=CC2=NC=NC=C2C=C1 D75735 [1,0,0,0,0,0|3,0,0]=4 33 B12R2.24 NC1=CC2=CC=CC=C2N=N1 W16974 [1,0,0,0,0,0|3,0,0]=4 34 B12R2.24 NC1=CC2=CC=CN=C2N=C1 N10431 [1,0,0,0,0,0|3,0,0]=4 35 B12R2.24 NC1=CC=C2N=CC=CC2=C1 F19169 [1,0,0,0,0,0|2,0,0]=3 36 B12R2.24 O=C1C=CC2=C(C=CC=N2)N1 97799 [1,0,0,0,0,0|2,0,0]=3 37 B12R2.24 O=C1C=NC2=C(C=CC=N2)N1 F14289 [1,0,0,0,0,0|3,0,0]=4 38 B12R2.24 O=C1COC2=C(C=CC=C2)C1 F53084 [1,0,0,0,0,0|1,0,2]=4 39 B12R2.24 O=C1N=CC2=C(C=CC=C2)N1 F15801 [1,0,0,0,0,0|2,0,0]=3 40 B12R2.24 O=C1N=CC2=C(N=CC=C2)N1 90179 [1,0,0,0,0,0|3,0,0]=4 41 B12R2.24 O=C1NC2=C(C=CC=C2)CO1 AC3815 [1,0,0,0,0,0|2,0,1]=4 42 B14R2.2332 CC1=CC=C2C=C(C=O)C=CC2=C1 AT10298 [0,1,0,0,0,0|1,0,0]=2 43 B14R2.2332 CNC1=CC=C2C=C(Br)C=CC2=C1 E71252 [0,1,0,0,0,0|2,0,0]=3 44 B14R2.2332 CNC1=CC=C2C=C(Br)C=CC2=N1 C91532 [0,1,0,0,0,0|3,0,0]=4 45 B14R2.2332 COC1=CC2=C(C=C1)NC(=O)N=C2 F15811 [0,1,0,0,0,0|2,0,1]=4 46 B14R2.2332 COC1=CC2=CC=C(C)C=C2C=C1 N14597 [0,1,0,0,0,0|1,0,1]=3 47 B14R2.2332 COC1=CC2=CN=C(N)C=C2C=C1 F31205 [0,1,0,0,0,0|2,0,1]=4 48 B14R2.2332 COC1=CC=C2C=C(Cl)C=NC2=C1 K10008 [0,1,0,0,0,0|2,0,1]=4 49 B14R2.2332 COC1=CC=C2N=C(F)C=CC2=C1 55499 [0,1,0,0,0,0|2,0,1]=4 50 B14R2.2332 COC1=NC2=CC=C(N)C=C2C=C1 CS1596 [0,1,0,0,0,0|2,0,1]=4 51 B14R2.2332 COC1=NC=C2C=C(Br)C=CC2=C1 C91486 [0,1,0,0,0,0|2,0,1]=4 52 B14R2.2332 N#CC1=CC2=C(C=C1)NC(=O)C=C2 P16953 [0,1,0,0,0,0|2,0,0]=3 53 B14R2.2332 N#CC1=CC2=CC=C(N)C=C2N=C1 K10140 [0,1,0,0,0,0|3,0,0]=4 54 B14R2.2332 N#CC1=CC2=CN=C(N)C=C2C=C1 68481 [0,1,0,0,0,0|3,0,0]=4 55 B14R2.2332 N#CC1=CN=C2C=C(Cl)C=CC2=C1 F13946 [0,1,0,0,0,0|3,0,0]=4 56 B14R2.2332 O=CC1=CC2=C(C=C1)NC(=O)CC2 F30681 [0,1,0,0,0,0|1,0,2]=4 57 B14R2.2332 O=CC1=CC2=C(C=C1)NC(=O)CO2 94700 [0,1,0,0,0,0|2,0,1]=4 58 B14R2.2332 O=CC1=CC2=C(C=C1)OC(=O)C=C2 F14768 [0,1,0,0,0,0|1,0,0]=2 59 B14R2.2332 O=CC1=CC=C2C=C(Cl)C=CC2=N1 80262 [0,1,0,0,0,0|2,0,0]=3 60 B14R2.2332 OCC1=CC=C2C=C(O)C=CC2=C1 C15542 [0,1,0,0,0,0|0,0,2]=3 61 B14R2.2332 OCC1=CN=C2C=C(Br)C=CC2=C1 K10050 [0,1,0,0,0,0|2,0,1]=4 62 B14R2.8235 CC1=C2C=C(Br)C=CC2=NC(Cl)=C1 36083 [0,1,0,0,0,0|3,0,0]=4 63 B14R2.8235 CC1=CC(=O)C2=C(C=CC(Cl)=C2)O1 F19840 [0,1,0,0,0,0|3,0,0]=4 64 B14R2.8235 CC1=CC(=O)NC2=C1C=C(N)C=C2 D74573 [0,1,0,0,0,0|2,0,0]=3 65 B14R2.8235 CC1=CC(Br)=CC2=C1NC(=O)C=C2 AC7497 [0,1,0,0,0,0|2,0,0]=3 66 B14R2.8235 CC1=CC2=C(C=C1)OC(=O)C=C2Cl AC1930 [0,1,0,0,0,0|2,0,0]=3 67 B14R2.8235 CC1=CC=C2C=C(Br)C=C(C)C2=N1 O11539 [0,1,0,0,0,0|3,0,0]=4 68 B14R2.8235 CC1=CC=C2C=C(Cl)C=C(I)C2=N1 D80123 [0,1,0,0,0,0|3,0,0]=4 69 B14R2.8235 CC1=CC=C2C=C(F)C=C(C)C2=N1 D80128 [0,1,0,0,0,0|3,0,0]=4 70 B14R2.8235 CC1=CC=C2C=C(F)C=C(O)C2=N1 AC2840 [0,1,0,0,0,0|3,0,0]=4 71 B14R2.8235 CC1=NC2=CC=C(Cl)C=C2C(Cl)=C1 60014 [0,1,0,0,0,0|3,0,0]=4 72 B14R2.8235 ClC1=CC=C2C=C(Cl)N=C(Cl)C2=C1 AT20879 [0,1,0,0,0,0|3,0,0]=4 73 B14R2.8235 ClC1=CC=C2N=C(Cl)C=C(Cl)C2=C1 83899 [0,1,0,0,0,0|3,0,0]=4 74 B14R2.8235 ClC1=NC(Cl)=C2C=C(I)C=CC2=C1 96190 [0,1,0,0,0,0|3,0,0]=4 75 B14R2.8235 FC1=CC(Br)=CC2=CC=C(Cl)N=C12 AC2125 [0,1,0,0,0,0|3,0,0]=4 76 B14R2.8235 O=C1C=C(Cl)C2=C(C=CC(Br)=C2)N1 F13886 [0,1,0,0,0,0|2,0,0]=3 77 B14R2.8235 O=C1C=C(O)C2=C(C=CC(Br)=N2)N1 F13889 [0,1,0,0,0,0|3,0,0]=4 78 B14R2.8235 O=C1C=C(O)C2=C(C=CC(O)=C2)O1 AC5863 [0,1,0,0,0,0|1,0,1]=3 79 B14R2.8235 O=C1C=CC2=CC(F)=CC(Br)=C2N1 D73421 [0,1,0,0,0,0|2,0,0]=3 80 B14R2.8235 O=C1CC2=C(C=C(Br)C=C2)C(=O)O1 A51200 [0,1,0,0,0,0|2,0,1]=4 81 B14R2.8235 O=C1N=CC2=CC(Br)=CC(Cl)=C2N1 F15820 [0,1,0,0,0,0|3,0,0]=4 82 B14R2.8235 O=C1N=CC2=CC(F)=CC(Br)=C2N1 F15819 [0,1,0,0,0,0|3,0,0]=4 83 B14R2.8235 O=C1NC(Cl)=CC2=C1C=C(Br)C=C2 AT13301 [0,1,0,0,0,0|3,0,0]=4 84 B14R2.8235 OC1=CC=C2C=C(Br)C=C(F)C2=C1 76349 [0,1,0,0,0,0|1,0,1]=3 85 B14R2.8239 CC1=C(C)C=C2C=C(N)N=CC2=C1 92164 [0,1,0,0,0,0|3,0,0]=4 86 B14R2.8239 CC1=C(O)C=C2C=CC(F)=CC2=N1 95154 [0,1,0,0,0,0|2,0,1]=4 87 B14R2.8239 NC1=CC=C2C=C(Br)C(Cl)=NC2=C1 E71225 [0,1,0,0,0,0|3,0,0]=4 88 B14R2.8239 NC1=CN=C2C=C(F)C(F)=CC2=C1 73650 [0,1,0,0,0,0|3,0,0]=4 89 B14R2.8239 NC1=NC=C2C=C(F)C(Br)=CC2=C1 E71148 [0,1,0,0,0,0|3,0,0]=4 90 B14R2.8239 O=C1N=CC2=CC(Br)=C(Cl)C=C2N1 F15815 [0,1,0,0,0,0|3,0,0]=4 91 B14R2.8239 O=C1N=CC2=CC(F)=C(Cl)C=C2N1 F15817 [0,1,0,0,0,0|3,0,0]=4 92 B14R2.8239 O=C1NC2=C(C=C(Br)C=C2)C=C1O 67213 [0,1,0,0,0,0|2,0,0]=3 93 B14R2.8239 O=C1NC2=C(C=C(Cl)C=C2)C=C1O 67214 [0,1,0,0,0,0|2,0,0]=3 94 B14R2.8239 O=C1NC2=C(C=CC(Br)=C2)C=C1O 67965 [0,1,0,0,0,0|2,0,1]=4 95 B14R2.29369 CC1=CC=C2N=C(C)C=CC2=C1N 53087 [0,1,0,0,0,0|3,0,0]=4 96 B14R2.29369 CN1C(=O)C=CC2=C1C=CC(Br)=C2 88454 [0,1,0,0,0,0|2,0,0]=3 97 B14R2.29369 CN1C(=O)C=CC2=C1C=CC(N)=C2 58051 [0,1,0,0,0,0|2,0,0]=3 98 B14R2.29369 ClC1=CC=C2C(=C1)N=CC(I)=C2Cl AT11279 [0,1,0,0,0,0|3,0,0]=4 99 B14R2.29369 ClC1=CC=C2C(=N1)C=CC(Cl)=C2Br 94645 [0,1,0,0,0,0|3,0,0]=4 100 B14R2.29369 FC1=CC=C2C=C(I)C=NC2=C1F 95156 [0,1,0,0,0,0|3,0,0]=4 101 B14R2.29369 NC1=CC=C2C=C(Br)C=CC2=C1N AC3324 [0,1,0,0,0,0|2,0,0]=3 102 B14R2.29369 NC1=NC=C2C(=C1)C=CC(Cl)=C2F 52991 [0,1,0,0,0,0|3,0,0]=4 103 B14R2.29369 O=C1N=CC2=C(C=CC(Cl)=C2Cl)N1 F15816 [0,1,0,0,0,0|3,0,0]=4 104 B14R2.29369 OC1=C(Br)C=NC2=CC(Cl)=CC=C21 AT11280 [0,1,0,0,0,0|3,0,0]=4 105 B14R2.29369 OC1=C(Cl)C=NC2=CC(Cl)=CC=C21 AT11276 [0,1,0,0,0,0|3,0,0]=4 106 B14R2.29369 OC1=C(I)C=NC2=CC(Cl)=CC=C21 AT11278 [0,1,0,0,0,0|3,0,0]=4 107 B12R1.49 C=CC(=O)NC1=CC=C(C)C=C1 N11698 [0,0,1,0,0,0|2,0,0]=3 108 B12R2.606 CC1=CC2=C(C=C(Br)C=C2)S1 82307 [0,0,0,0,1,0|3,0,0]=4 109 B12R2.606 CC1=CC2=C(C=C1)NC(=O)O2 AC5672 [0,0,0,0,1,0|3,0,0]=4 110 B12R2.606 CC1=CC2=C(C=C1)SC(=O)N2 O11473 [0,0,0,0,1,0|3,0,0]=4 111 B12R2.606 CC1=CC2=C(C=CC(Br)=C2)O1 D78665 [0,0,0,0,1,0|3,0,0]=4 112 B12R2.606 CC1=CC2=C(C=CC(N)=C2)O1 AC5757 [0,0,0,0,1,0|3,0,0]=4 113 B12R2.606 ClC1=CC2=C(C=C1)C=C(Cl)N2 F52575 [0,0,0,0,1,0|3,0,0]=4 114 B12R2.606 ClC1=CC2=C(C=C1)SC(Br)=C2 F19742 [0,0,0,0,1,0|3,0,0]=4 115 B12R2.606 FC1=CC2=C(C=C(Br)C=C2)S1 98453 [0,0,0,0,1,0|3,0,0]=4 116 B12R2.606 NC1=CC2=C(C=C(Br)C=C2)S1 37562 [0,0,0,0,1,0|3,0,0]=4 117 B12R2.606 NC1=CC2=C(C=CC(Br)=C2)S1 P16602 [0,0,0,0,1,0|3,0,0]=4 118 B12R2.606 O=C1NC2=C(C=CC(F)=C2)S1 C14119 [0,0,0,0,1,0|3,0,0]=4 119 B12R2.606 O=C1OC2=C(C=C(O)C=C2)S1 D77666 [0,0,0,0,1,0|2,0,1]=4 120 B12R2.612 BrC1=CC2=C(C=C1)C(Br)=CS2 81955 [0,0,0,0,1,0|3,0,0]=4 121 B12R2.612 CC1=CC2=C(C=C1)C(=O)NC2 F21430 [0,0,0,0,1,0|2,0,1]=4 122 B12R2.612 CC1=COC2=C1C=CC(Br)=C2 V10221 [0,0,0,0,1,0|3,0,0]=4 123 B12R2.612 CN1C=CC2=C1C=CC(F)=C2 98405 [0,0,0,0,1,0|3,0,0]=4 124 B12R2.612 ClC1=CNC2=C1C=CC(Br)=C2 W17736 [0,0,0,0,1,0|3,0,0]=4 125 B12R2.612 FC1=CSC2=C1C=CC(Br)=C2 98454 [0,0,0,0,1,0|3,0,0]=4 126 B12R2.612 O=C1CCC2=C1C=CC(S)=C2 79915 [0,0,0,0,1,0|0,1,2]=4 127 B12R2.612 O=C1N=CC2=C1C=CC(F)=C2 W17708 [0,0,0,0,1,0|2,0,0]=3 128 B12R2.612 O=C1ONC2=C1C=CC(Br)=C2 D78660 [0,0,0,0,1,0|3,0,0]=4 129 B11R1.1 C=C\C=C\C1=CC=C(F)C=C1 59824 [1,0,1,0,0,0|1,0,0]=3 130 B11R1.24 O=C\C=C\C1=CC=CC(F)=C1 FD10704 [1,0,1,0,0,0|1,0,0]=3 131 B11R1.17 O=C\C=C\C1=C(Br)C=CC=C1 W16727 [1,0,1,0,0,0|1,0,0]=3 132 B11R1.17 O=C\C=C\C1=C(O)C=CC=C1 D90980 [1,0,1,0,0,0|1,0,0]=3 133 B11R2.20 C1=CC2=CC=NC=C2C=N1 69947 [2,0,0,0,0,0|2,0,0]=4 134 B13R1.2679 C=CC(=O)NC1=C(F)C=C(Br)C=C1 N11741 [0,1,1,0,0,0|2,0,0]=4 135 B13R1.2879 C=CC(=O)NC1=CC(Br)=C(F)C=C1 N11739 [0,1,1,0,0,0|2,0,0]=4 136 B13R1.2879 C=CC(=O)NC1=CC(Cl)=C(F)C=C1 N11738 [0,1,1,0,0,0|2,0,0]=4 137 B13R1.150 O=C(O)\C=C\C1=CC=CC(Br)=C1Cl 95972 [0,1,1,0,0,0|2,0,0]=4 138 B13R1.150 O=C(O)\C=C\C1=CC=CC(Br)=C1F 95993 [0,1,1,0,0,0|2,0,0]=4 139 B13R1.150 O=C(O)\C=C\C1=CC=CC(Cl)=C1Cl C78035 [0,1,1,0,0,0|2,0,0]=4 140 B13R1.511 CC1=C(Br)C=CC(\C=C\C(=O)O)=C1 AT20409 [0,1,1,0,0,0|2,0,0]=4 141 B13R2.32 BrC1=C(Br)C2=CC=CC=C2C=N1 36192 [1,1,0,0,0,0|2,0,0]=4 142 B13R2.32 CC1=C(O)C2=NC=CC=C2C=C1 71141 [1,1,0,0,0,0|2,0,0]=4 143 B13R2.32 ClC1=C(Br)C2=CC=CC=C2N=C1 93348 [1,1,0,0,0,0|2,0,0]=4 144 B13R2.32 FC1=C(Br)C2=CC=CN=C2C=C1 AC2843 [1,1,0,0,0,0|2,0,0]=4 145 B13R2.32 NC1=C(Br)N=CC2=CC=CC=C21 27185 [1,1,0,0,0,0|2,0,0]=4 146 B13R2.32 NC1=C(Cl)C2=CC=CC=C2C=N1 91248 [1,1,0,0,0,0|2,0,0]=4 147 B13R2.32 NC1=C(Cl)C=NC2=CC=CC=C21 O10994 [1,1,0,0,0,0|2,0,0]=4 148 B13R2.32 NC1=CC=C2N=CC=CC2=C1N 98386 [1,1,0,0,0,0|2,0,0]=4 149 B13R2.32 NC1=CC=C2N=CC=CC2=C1N CS1203 [1,1,0,0,0,0|2,0,0]=4 150 B13R2.32 OC1=C(Cl)C2=CC=CC=C2N=C1 C15579 [1,1,0,0,0,0|1,0,1]=4 151 B13R2.32 OC1=C(Cl)C2=NC=CC=C2C=C1 C14483 [1,1,0,0,0,0|1,0,1]=4 152 B13R2.32 OC1=C(Cl)C=NC2=CC=CC=C21 93347 [1,1,0,0,0,0|2,0,0]=4 153 B13R2.32 OC1=C(Cl)N=CC2=CC=CC=C21 CL1036 [1,1,0,0,0,0|2,0,0]=4 154 B13R2.57 BrCC1=CC2=CC=CC=C2N=C1 D88103 [1,1,0,0,0,0|2,0,0]=4 155 B13R2.57 BrCC1=CC2=CC=CN=C2C=C1 73463 [1,1,0,0,0,0|2,0,0]=4 156 B13R2.57 BrCC1=CC2=CN=CC=C2C=C1 AT24114 [1,1,0,0,0,0|2,0,0]=4 157 B13R2.57 BrCC1=CC2=NC=CC=C2C=C1 AT24126 [1,1,0,0,0,0|2,0,0]=4 158 B13R2.57 BrCC1=NC2=CC=CC=C2C=C1 C11064 [1,1,0,0,0,0|2,0,0]=4 159 B13R2.57 CSC1=NC2=CC=CC=C2C=C1 H11532 [1,1,0,0,0,0|1,1,0]=4 160 B13R2.57 ClCC1=CC2=NC=CC=C2C=C1 AT24125 [1,1,0,0,0,0|2,0,0]=4 161 B13R2.57 NCC1=CC2=CC=CC=C2N=C1 56109 [1,1,0,0,0,0|2,0,0]=4 162 B13R2.57 NCC1=CC=C2C=NC=CC2=C1 N10568 [1,1,0,0,0,0|2,0,0]=4 163 B13R2.57 NNC1=CC2=CC=CC=C2C=C1 F21338 [1,1,0,0,0,0|1,0,0]=3 164 B13R2.57 NNC1=CC2=CC=CC=C2N=C1 78667 [1,1,0,0,0,0|2,0,0]=4 165 B13R2.57 O=CC1=CC2=CN=CN=C2C=C1 72281 [1,1,0,0,0,0|2,0,0]=4 166 B13R2.57 OCC1=CC2=NC=CC=C2C=C1 AT24124 [1,1,0,0,0,0|1,0,1]=4 167 B13R2.155 CC1=CC2=C(C=CC(=O)N2)N=C1 91722 [1,1,0,0,0,0|2,0,0]=4 168 B13R2.155 CC1=CC=C2C=CC(Br)=CC2=C1 O10697 [1,1,0,0,0,0|1,0,0]=3 169 B13R2.155 CC1=CC=C2N=CC(Br)=CC2=C1 84135 [1,1,0,0,0,0|2,0,0]=4 170 B13R2.155 CC1=CC=C2N=CC(O)=CC2=C1 A10636 [1,1,0,0,0,0|1,0,1]=4 171 B13R2.155 ClC1=CC=C2C=CC(Cl)=NC2=C1 80787 [1,1,0,0,0,0|2,0,0]=4 172 B13R2.155 NC1=CC=C2N=CC(I)=CC2=C1 D74425 [1,1,0,0,0,0|2,0,0]=4 173 B13R2.155 NC1=CC=C2N=CC(O)=CC2=C1 33324 [1,1,0,0,0,0|1,0,1]=4 174 B13R2.155 NC1=NC=C2C=CC(O)=CC2=C1 68526 [1,1,0,0,0,0|1,0,1]=4 175 B13R2.155 O=C1C=CC2=C(C=C(F)C=C2)O1 D83247 [1,1,0,0,0,0|1,0,0]=3 176 B13R2.155 O=C1N=CC2=C(C=C(Br)C=C2)N1 F15807 [1,1,0,0,0,0|2,0,0]=4 177 B13R2.155 O=C1N=CC2=C(C=C(Cl)C=C2)N1 F15805 [1,1,0,0,0,0|2,0,0]=4 178 B13R2.155 O=C1N=CC2=C(C=C(F)C=C2)N1 F15808 [1,1,0,0,0,0|2,0,0]=4 179 B13R2.155 OC1=CC=C2N=CC(Cl)=CC2=C1 80398 [1,1,0,0,0,0|1,0,1]=4 180 B13R2.162 BrC1=CC2=C(Br)C=CC=C2C=N1 D80057 [1,1,0,0,0,0|2,0,0]=4 181 B13R2.162 CC1=C2N=C(Br)C=CC2=CC=C1 94408 [1,1,0,0,0,0|2,0,0]=4 182 B13R2.162 CC1=C2N=C(N)C=CC2=CC=C1 72104 [1,1,0,0,0,0|2,0,0]=4 183 B13R2.162 CC1=CC=C2C=CC=C(Br)C2=C1 97676 [1,1,0,0,0,0|1,0,0]=3 184 B13R2.162 CC1=CC=C2C=CC=C(N)C2=C1 C16241 [1,1,0,0,0,0|1,0,0]=3 185 B13R2.162 CC1=CC=C2C=CN=C(Cl)C2=C1 F30684 [1,1,0,0,0,0|2,0,0]=4 186 B13R2.162 ClC1=CC=C2C=CC=C(Br)C2=C1 W18103 [1,1,0,0,0,0|1,0,0]=3 187 B13R2.162 ClC1=CC=C2N=CC=C(I)C2=C1 AT14806 [1,1,0,0,0,0|2,0,0]=4 188 B13R2.162 ClC1=CN=C2C=CC=C(Br)C2=C1 80410 [1,1,0,0,0,0|2,0,0]=4 189 B13R2.162 FC1=C2C=C(Br)C=CC2=CC=N1 55505 [1,1,0,0,0,0|2,0,0]=4 190 B13R2.162 FC1=CC=C2C=CC=C(Br)C2=N1 91504 [1,1,0,0,0,0|2,0,0]=4 191 B13R2.162 NC1=C2N=C(Br)C=CC2=CC=C1 E72018 [1,1,0,0,0,0|2,0,0]=4 192 B13R2.162 NC1=CC=C2C=CC=C(Br)C2=C1 AT10622 [1,1,0,0,0,0|1,0,0]=3 193 B13R2.162 O=C1N=CC2=CC=CC(Cl)=C2N1 F15812 [1,1,0,0,0,0|2,0,0]=4 194 B13R2.162 OC1=C2C=C(Cl)C=NC2=CC=C1 80400 [1,1,0,0,0,0|2,0,0]=4 195 B13R2.162 OC1=CC=C2C=CN=C(Cl)C2=C1 C73233 [1,1,0,0,0,0|1,0,1]=4 196 B13R2.162 OC1=CN=C2C=CC=C(Cl)C2=C1 33283 [1,1,0,0,0,0|1,0,1]=4 197 B13R2.162 SC1=C2C=C(Br)C=CC2=NC=C1 AT15189 [1,1,0,0,0,0|2,0,0]=4 198 B13R2.328 BrC1=CC2=CC=CC=C2C(I)=C1 AC3548 [1,1,0,0,0,0|1,0,0]=3 199 B13R2.328 CC1=CC(N)=C2C=CC=NC2=C1 K10310 [1,1,0,0,0,0|2,0,0]=4 200 B13R2.328 CC1=CC2=CC=CC=C2C(C)=C1 T71081 [1,1,0,0,0,0|1,0,0]=3 201 B13R2.328 ClC1=CC2=CN=CC=C2C(Cl)=C1 C16294 [1,1,0,0,0,0|2,0,0]=4 202 B13R2.328 FC1=CC(Br)=CC2=CC=CC=C12 F11290 [1,1,0,0,0,0|1,0,0]=3 203 B13R2.328 FC1=CC2=CC=CC=C2C(Br)=C1 E72054 [1,1,0,0,0,0|1,0,0]=3 204 B13R2.328 FC1=CC2=CC=NC=C2C(Cl)=C1 97671 [1,1,0,0,0,0|2,0,0]=4 205 B13R2.328 NC1=C2C=CC=CC2=NC(=O)N1 25868 [1,1,0,0,0,0|2,0,0]=4 206 B13R2.328 NC1=CC(Br)=CC2=CC=NC=C12 D87185 [1,1,0,0,0,0|2,0,0]=4 207 B13R2.328 NC1=CC(Cl)=CC2=CN=CC=C12 C16071 [1,1,0,0,0,0|2,0,0]=4 208 B13R2.328 NC1=CC2=CC=CC=C2C(O)=C1 F50945 [1,1,0,0,0,0|1,0,0]=3 209 B13R2.328 NC1=CC2=CC=CN=C2C(Br)=C1 84593 [1,1,0,0,0,0|2,0,0]=4 210 B13R2.328 NC1=CC2=CC=NC=C2C(F)=C1 D87186 [1,1,0,0,0,0|2,0,0]=4 211 B13R2.328 NC1=CC2=CN=CC=C2C(O)=C1 D87200 [1,1,0,0,0,0|2,0,0]=4 212 B13R2.328 NC1=CC2=NC=CC=C2C(Br)=C1 K10003 [1,1,0,0,0,0|2,0,0]=4 213 B13R2.328 NC1=NC2=CC=CC=C2C(Cl)=C1 AT23422 [1,1,0,0,0,0|2,0,0]=4 214 B13R2.328 O=C1C=C(Cl)C2=C(C=CC=C2)O1 D76212 [1,1,0,0,0,0|1,0,0]=3 215 B13R2.328 O=C1C=C(I)OC2=C1C=CC=C2 C91932 [1,1,0,0,0,0|2,0,0]=4 216 B13R2.328 O=C1C=C(O)C2=C(C=CC=N2)N1 O11237 [1,1,0,0,0,0|2,0,0]=4 217 B13R2.328 O=C1C=C(O)C2=C(C=CC=N2)O1 94800 [1,1,0,0,0,0|2,0,0]=4 218 B13R2.328 O=C1NC(=O)C2=C(C=CC=C2)S1 D73547 [1,1,0,0,0,0|2,0,0]=4 219 B13R2.328 O=C1NC(Cl)=CC2=C1C=CC=C2 32072 [1,1,0,0,0,0|2,0,0]=4 220 B13R2.328 OC1=CC(Br)=CC2=CN=CC=C12 E70451 [1,1,0,0,0,0|2,0,0]=4 221 B13R2.328 OC1=CC(Cl)=CC2=CN=CC=C12 D87205 [1,1,0,0,0,0|2,0,0]=4 222 B13R2.328 OC1=CC(F)=CC2=CN=CC=C12 D87208 [1,1,0,0,0,0|2,0,0]=4 223 B13R2.369 BrC1=CC2=CC=CC=C2N=C1I F30333 [1,1,0,0,0,0|2,0,0]=4 224 B13R2.369 CC1=C(C)C=C2N=CC=CC2=C1 N13369 [1,1,0,0,0,0|2,0,0]=4 225 B13R2.369 CC1=CC2=C(C=CC=C2)NC1=O 58045 [1,1,0,0,0,0|1,0,0]=3 226 B13R2.369 CC1=CC2=CC=CC=C2N=C1Br 94406 [1,1,0,0,0,0|2,0,0]=4 227 B13R2.369 CC1=CC2=CN=CC=C2C=C1F 81070 [1,1,0,0,0,0|2,0,0]=4 228 B13R2.369 ClC1=CC2=CC=CC=C2N=C1Br D84301 [1,1,0,0,0,0|2,0,0]=4 229 B13R2.369 ClC1=CC2=CC=CC=C2N=C1Cl 26652 [1,1,0,0,0,0|2,0,0]=4 230 B13R2.369 FC1=CC2=CC=NC=C2C=C1Cl 97669 [1,1,0,0,0,0|2,0,0]=4 231 B13R2.369 NC1=CC2=CC=CN=C2C=C1Cl 91345 [1,1,0,0,0,0|2,0,0]=4 232 B13R2.369 NC1=NC2=C(C=CC=C2)NC1=O 38523 [1,1,0,0,0,0|2,0,0]=4 233 B13R2.369 OC1=CC2=NC=CC=C2C=C1Br K10294 [1,1,0,0,0,0|1,0,1]=4 234 B13R2.5179 BrC1=CC=C2C(=C1)C=CN=C2Br D80052 [1,1,0,0,0,0|2,0,0]=4 235 B13R2.5179 CC1=CC2=C(C=C1)C(=O)C=CO2 C91052 [1,1,0,0,0,0|2,0,0]=4 236 B13R2.5179 CC1=CC=C2C(Br)=CC=NC2=C1 F53837 [1,1,0,0,0,0|2,0,0]=4 237 B13R2.5179 CC1=CC=C2C(Cl)=CC=NC2=C1 84263 [1,1,0,0,0,0|2,0,0]=4 238 B13R2.5179 CC1=CC=C2C(O)=CC=CC2=N1 69653 [1,1,0,0,0,0|2,0,0]=4 239 B13R2.5179 CC1=NC2=CC=CC(C)=C2C=C1 AT13138 [1,1,0,0,0,0|2,0,0]=4 240 B13R2.5179 ClC1=C2C=CC(Br)=CC2=CC=C1 D86133 [1,1,0,0,0,0|1,0,0]=3 241 B13R2.5179 ClC1=CC=C2C(Cl)=CC=[15N]C2=C1 D98227 [1,1,0,0,0,0|2,0,0]=4 242 B13R2.5179 FC1=C2C=CC(Br)=CC2=NC=C1 80388 [1,1,0,0,0,0|2,0,0]=4 243 B13R2.5179 FC1=CC=C2C(Br)=CC=CC2=N1 91506 [1,1,0,0,0,0|2,0,0]=4 244 B13R2.5179 NC1=C2C=CC(Cl)=NC2=CC=C1 O10759 [1,1,0,0,0,0|2,0,0]=4 245 B13R2.5179 NC1=CN=C2C(O)=CC=CC2=C1 80441 [1,1,0,0,0,0|2,0,0]=4 246 B13R2.5179 O=C1C=C2C=CC=C(Br)C2=CN1 P16671 [1,1,0,0,0,0|1,0,0]=3 247 B13R2.5179 O=C1C=C2C=CC=C(Cl)C2=CN1 D76504 [1,1,0,0,0,0|1,0,0]=3 248 B13R2.5179 O=C1C=CC2=C(Br)C=CC=C2O1 E70217 [1,1,0,0,0,0|1,0,0]=3 249 B13R2.5179 O=C1NC=CC2=C1C=CC(I)=C2 F19085 [1,1,0,0,0,0|2,0,0]=4 250 B13R2.5179 OC1=C2C=CC(F)=CC2=CC=N1 81072 [1,1,0,0,0,0|2,0,0]=4 251 B13R2.5179 OC1=NC=C2C(Br)=CC=CC2=C1 24374 [1,1,0,0,0,0|1,0,1]=4 252 B13R2.5179 [O-][N+]1=C2C=CC(Br)=CC2=CC=C1 D85320 [1,1,0,0,0,0|2,0,0]=4 253 B13R2.5179 [O-][N+]1=C2C=CC(O)=CC2=CC=C1 AC9845 [1,1,0,0,0,0|1,0,1]=4 254 B13R2.43 CC1=CC2=C(C=C1)NC(C=O)=C2 D75515 [0,1,0,0,1,0|2,0,0]=4 255 B13R2.43 O=CC1=CC2=C(C=C(Br)C=C2)O1 E71165 [0,1,0,0,1,0|2,0,0]=4 256 B13R2.43 O=CC1=CC2=C(C=C(Br)C=C2)S1 F13894 [0,1,0,0,1,0|2,0,0]=4 257 B13R2.43 O=CC1=CC2=C(C=C(F)C=C2)O1 98428 [0,1,0,0,1,0|2,0,0]=4 258 B13R2.43 O=CC1=CC2=C(C=C(F)C=C2)S1 98425 [0,1,0,0,1,0|2,0,0]=4 259 B13R2.43 O=CC1=CC2=C(C=CC(F)=C2)N1 28115 [0,1,0,0,1,0|2,0,0]=4 260 B13R2.43 O=CC1=CC2=C(C=CC(F)=C2)O1 98431 [0,1,0,0,1,0|2,0,0]=4 261 B13R2.43 O=CC1=CC2=C(C=CC(F)=C2)S1 98413 [0,1,0,0,1,0|2,0,0]=4 262 B13R2.2121 CC1=CC2=C(C=CC(C=O)=C2)N1 96764 [0,1,0,0,1,0|2,0,0]=4 263 B13R2.662 NC1=CC2=C(C=C1)C(C=O)=CN2 F15902 [0,1,0,0,1,0|2,0,0]=4 264 B13R2.662 O=CC1=CNC2=C1C=CC(I)=C2 F15904 [0,1,0,0,1,0|2,0,0]=4 265 B13R2.662 O=CC1=CNC2=C1C=CC(O)=C2 D77285 [0,1,0,0,1,0|1,0,1]=4 266 B13R2.662 O=CC1=COC2=C1C=CC(Br)=C2 93446 [0,1,0,0,1,0|2,0,0]=4 267 B13R2.5187 O=C1CC(=O)C2=C1C=CC(Br)=C2 D86839 [0,1,0,0,1,0|1,0,1]=4 268 B15R2.1754 O=CC1=C(Cl)N=C2C=C(Br)C=CC2=C1 AT13208 [0,2,0,0,0,0|2,0,0]=4 269 B15R2.1754 O=CC1=C(Cl)N=C2C=C(I)C=CC2=C1 D80075 [0,2,0,0,0,0|2,0,0]=4 270 B15R2.1754 O=CC1=CC2=C(C=C(F)C=C2)NC1=O AT24322 [0,2,0,0,0,0|2,0,0]=4 271 B15R2.1754 O=CC1=CC2=C(C=C(O)C=C2)OC1=O D73339 [0,2,0,0,0,0|1,0,1]=4 272 B15R2.1754 O=CC1=CC2=CC=C(O)C=C2N=C1Cl AC6284 [0,2,0,0,0,0|1,0,1]=4 273 B15R2.4778 O=CC1=C(Br)C2=CC=C(Cl)C=C2C=C1 57922 [0,2,0,0,0,0|1,0,0]=3 274 B15R2.4778 O=CC1=C(Br)C2=CC=C(F)C=C2C=C1 57921 [0,2,0,0,0,0|1,0,0]=3 275 B15R2.4780 CNC1=CC=C2C=C(C#N)C=CC2=C1 E71251 [0,2,0,0,0,0|2,0,0]=4 276 B15R2.4780 CNC1=CC=C2C=C(C=O)C=CC2=C1 E72020 [0,2,0,0,0,0|1,0,0]=3 277 B15R2.4780 COC1=CC=C2N=C(C=O)C=CC2=C1 AT13130 [0,2,0,0,0,0|1,0,1]=4 278 B15R2.7180 CC(=O)C1=CC2=NC=C(C)C=C2C=C1 92516 [0,2,0,0,0,0|2,0,0]=4 279 B15R2.7180 CC(=O)C1=CC=C2C=C(Br)C=NC2=C1 K10055 [0,2,0,0,0,0|2,0,0]=4 280 B15R2.7180 CC1=CC=C2C=C(C(=O)O)C=NC2=C1 69430 [0,2,0,0,0,0|2,0,0]=4 281 B15R2.7180 CC1=CN=C2C=C(C(=O)O)C=CC2=C1 K10057 [0,2,0,0,0,0|2,0,0]=4 282 B15R2.7180 NC(=O)C1=CN=C2C=C(Br)C=CC2=C1 K10030 [0,2,0,0,0,0|2,0,0]=4 283 B15R2.7180 NC1=CC=C2N=C(C(=O)O)C=CC2=C1 80341 [0,2,0,0,0,0|2,0,0]=4 284 B15R2.7180 O=C(O)C1=CC=C2C=C(I)C=CC2=C1 D78655 [0,2,0,0,0,0|1,0,0]=3 285 B15R2.7180 O=C(O)C1=CN=C2C=C(I)C=CC2=C1 69427 [0,2,0,0,0,0|2,0,0]=4 286 B15R2.7180 O=[N+]([O-])C1=CC=C2C=C(Br)C=NC2=C1 33228 [0,2,0,0,0,0|2,0,0]=4 287 B15R2.7180 OB(O)C1=CC=C2C=C(Cl)C=CC2=C1 AT25686 [0,2,0,0,0,0|1,0,1]=4 288 B15R2.21329 COC1=CC2=C(C=C1)NC(=O)C=C2C D74570 [0,2,0,0,0,0|1,0,1]=4 289 B15R2.63814 O=C1NC(=O)C2=C(C=CC(Br)=C2)C1=O P18287 [0,2,0,0,0,0|2,0,0]=4 290 B15R2.89950 N#CC1=CC(Br)=CC2=CC=C(O)C=C12 P16720 [0,2,0,0,0,0|1,0,1]=4 291 B15R2.1824 CC1=CC2=C(C=C1)NC(=O)C(C=O)=C2 52377 [0,2,0,0,0,0|2,0,0]=4 292 B15R2.1824 COC1=CC2=C(C=CC(=O)O2)C=C1O 43053 [0,2,0,0,0,0|1,0,1]=4 293 B15R2.1824 COC1=CC2=C(C=CC(Br)=C2)NC1=O 87956 [0,2,0,0,0,0|2,0,0]=4 294 B15R2.1824 N#CC1=CC2=C(C=CC(Br)=C2)OC1=O 95284 [0,2,0,0,0,0|2,0,0]=4 295 B15R2.1824 N#CC1=CC2=C(C=CC(Cl)=C2)OC1=O 97145 [0,2,0,0,0,0|2,0,0]=4 296 B15R2.1824 N#CC1=CC2=C(C=CC(F)=C2)OC1=O 95285 [0,2,0,0,0,0|2,0,0]=4 297 B15R2.63924 OC1=CC=C2C(Cl)=C(O)C=CC2=C1Cl F50514 [0,2,0,0,0,0|0,0,2]=4 298 B13R2.342 O=C1C=CNC2=C(I)C=CC=C12 D87289 [0,0,1,1,0,0|2,0,0]=4 299 B13R2.342 O=C1NC=CC2=C(F)C=CC=C12 F18879 [0,0,1,1,0,0|2,0,0]=4 300 B13R2.342 O=C1NC=CC2=C(I)C=CC=C12 F18906 [0,0,1,1,0,0|2,0,0]=4 301 B13R2.342 SC1=CC=CC2=C(S)C=CC=C12 T71015 [0,0,1,1,0,0|0,2,0]=4 302 B11R1.22 O=CC(=O)C1=CC=C(Cl)C=C1 O10480 [0,0,1,0,1,0|2,0,0]=4 303 B11R2.1 BrC1=CCC2=C1C=CC=C2 D78625 [1,0,0,0,1,0|1,0,1]=4 304 B11R2.1 OC1=CNC2=C1C=CC=C2 F18139 [1,0,0,0,1,0|1,0,1]=4 305 B11R2.1 OC1=CSC2=C1C=CC=C2 C15915 [1,0,0,0,1,0|1,0,1]=4 306 B11R2.10 ClC1=CC2=C(C=CC=C2)O1 AC6512 [1,0,0,0,1,0|2,0,0]=4 307 B11R2.10 NC1=CC2=C(C=CC=C2)N1 79767 [1,0,0,0,1,0|2,0,0]=4 308 B11R2.10 NC1=CC2=C(C=CC=C2)N1 F13373 [1,0,0,0,1,0|2,0,0]=4 309 B11R2.10 O=C1C=C2C=CC=CN2N1 W16687 [1,0,0,0,1,0|2,0,0]=4 310 B11R2.10 O=C1CC2=C(C=CC=C2)S1 A51238 [1,0,0,0,1,0|1,0,1]=4 311 B11R2.36 ClC1=CC2=C(C=C1)OC=C2 A51024 [1,0,0,0,1,0|2,0,0]=4 312 B11R2.36 ClC1=CN2C=CC=C2C=C1 SC1109 [1,0,0,0,1,0|2,0,0]=4 313 B11R2.36 FC1=CC2=C(C=C1)CC=C2 N14223 [1,0,0,0,1,0|1,0,1]=4 314 B11R2.36 FC1=CC2=C(C=C1)SC=C2 P15215 [1,0,0,0,1,0|2,0,0]=4 315 B11R2.36 OC1=CC2=C(C=CS2)C=C1 A11012 [1,0,0,0,1,0|1,0,1]=4