0 B13R2.162 CC1=CC=C2C=CN=C(Cl)C2=C1 34167 [1,0,0,0,0,0|3,0,0]=4 1 B13R2.162 CC1=NC2=C(Br)C=CC=C2C=C1 21848 [1,0,0,0,0,0|1,1,1]=4 2 B13R2.162 CC1=NC2=C(C)C=CC=C2C=C1 5878 [1,0,0,0,0,0|2,0,1]=4 3 B13R2.162 CC1=NC2=C(Cl)C=CC=C2C=C1 5852 [1,0,0,0,0,0|1,0,1]=3 4 B13R2.162 CC1=NC2=C(O)C=CC=C2C=C1 24684 [1,0,0,0,0,0|2,0,1]=4 5 B13R2.162 ClC1=CC=C2N=CC=C(Cl)C2=C1 5894 [1,0,0,0,0,0|3,0,0]=4 6 B13R2.162 ClC1=CC=NC2=CC=C(Br)C=C12 20825 [1,0,0,0,0,0|3,0,0]=4 7 B13R2.162 ClC1=CC=NC2=CC=C(I)C=C12 14688 [1,0,0,0,0,0|3,0,0]=4 8 B13R2.162 ClC1=NC2=C(Br)C=CC=C2C=C1 16930 [1,0,0,0,0,0|1,1,1]=4 9 B13R2.162 ClC1=NC2=C(Cl)C=CC=C2C=C1 23770 [1,0,0,0,0,0|1,0,1]=3 10 B13R2.162 FC1=CC=C2N=CC=C(Cl)C2=C1 5845 [1,0,0,0,0,0|3,0,0]=4 11 B13R2.162 NC1=CC=CC2=CC=C(O)C=C12 22270 [1,0,0,0,0,0|2,0,1]=4 12 B13R2.162 NC1=NC2=C(Br)C=CC=C2C=C1 27726 [1,0,0,0,0,0|1,1,1]=4 13 B13R2.162 O=C1C=CC2=CC=CC(Br)=C2N1 27901 [1,0,0,0,0,0|0,1,0]=2 14 B13R2.162 O=C1CCC2=CC=CC(Cl)=C2C1 17943 [1,0,0,0,0,0|1,0,2]=4 15 B13R2.162 O=C1COC2=C(N1)C(F)=CC=C2 27628 [1,0,0,0,0,0|1,1,1]=4 16 B13R2.162 O=C1COC2=CC=CC(Cl)=C2C1 18193 [1,0,0,0,0,0|2,0,1]=4 17 B13R2.162 OC1=CC=C2C=CN=C(Cl)C2=C1 34766 [1,0,0,0,0,0|2,0,1]=4 18 B13R2.162 OC1=NC2=C(O)C=CC=C2C=C1 7554 [1,0,0,0,0,0|1,0,2]=4 19 B13R2.369 CC1=C(O)C=C2C=CC=NC2=C1 34451 [1,0,0,0,0,0|3,0,0]=4 20 B13R2.369 CC1=CC2=CC=CC=C2N=C1Cl 12431 [1,0,0,0,0,0|2,0,1]=4 21 B13R2.369 CC1=NC2=CC=CC=C2N=C1O 15424 [1,0,0,0,0,0|2,0,1]=4 22 B13R2.369 ClC1=NC2=CC=CC=C2C=C1Br 35526 [1,0,0,0,0,0|2,0,1]=4 23 B13R2.369 NC1=CC2=CC=CC=C2C=C1N 15532 [1,0,0,0,0,0|3,0,0]=4 24 B13R2.369 NC1CC2=CC=CC=C2NC1=O 17875 [1,0,0,0,0,0|1,0,2]=4 25 B13R2.369 OC1=NC2=CC=CC=C2N=C1O 25656 [1,0,0,0,0,0|1,0,2]=4 26 B13R2.5179 BrC1=C2N=CC(I)=CC2=CC=C1 27663 [1,0,0,0,0,0|1,1,1]=4 27 B13R2.5179 CC1=CC=C2C(Cl)=CC=NC2=C1 34410 [1,0,0,0,0,0|3,0,0]=4 28 B13R2.5179 CC1=CC=C2C(N)=CC=CC2=C1 34782 [1,0,0,0,0,0|3,0,0]=4 29 B13R2.5179 ClC1=CC=C2C(=C1)C=CN=C2Cl 29719 [1,0,0,0,0,0|3,0,0]=4 30 B13R2.5179 ClC1=CC=C2C(Cl)=CC=NC2=C1 5880 [1,0,0,0,0,0|3,0,0]=4 31 B13R2.5179 ClC1=CC=NC2=CC(Br)=CC=C12 14669 [1,0,0,0,0,0|3,0,0]=4 32 B13R2.5179 ClC1=CC=NC2=CC(I)=CC=C12 23080 [1,0,0,0,0,0|3,0,0]=4 33 B13R2.5179 ClC1=NC2=CC=CC(Cl)=C2C=C1 24683 [1,0,0,0,0,0|3,0,0]=4 34 B13R2.5179 ClC1=NC=CC2=CC(Br)=CC=C21 23144 [1,0,0,0,0,0|3,0,0]=4 35 B13R2.5179 FC1=C2N=CC(I)=CC2=CC=C1 35230 [1,0,0,0,0,0|1,1,1]=4 36 B13R2.5179 NC1=CC=C2C(O)=CC=CC2=C1 12474 [1,0,0,0,0,0|3,0,0]=4 37 B13R2.5179 NC1=CC=CC2=CC(F)=CC=C12 34829 [1,0,0,0,0,0|3,0,0]=4 38 B13R2.5179 OC1=CC2=NC=CC(Cl)=C2N=C1 34626 [1,0,0,0,0,0|1,0,1]=3 39 B15R2.2039 O=CC1=CC2=CC=CC(Cl)=C2N=C1Cl 23769 [0,1,0,0,0,0|1,0,2]=4 40 B13R2.4825 O=C1NC2=C(Br)C=CC=C2C1=O 16675 [0,0,0,0,1,0|0,1,1]=3 41 B13R2.4825 O=C1NC2=C(Cl)C=CC=C2C1=O 15537 [0,0,0,0,1,0|0,0,1]=2 42 B13R2.4825 O=C1NC2=C(F)C=CC=C2C1=O 1955 [0,0,0,0,1,0|0,1,1]=3 43 B13R2.4825 O=C1NC2=C(I)C=CC=C2C1=O 20658 [0,0,0,0,1,0|0,1,1]=3 44 B13R2.4856 O=C1NC2=CC=CC(Br)=C2C1=O 3903 [0,0,0,0,1,0|1,1,1]=4 45 B13R2.4856 O=C1NC2=CC=CC(Cl)=C2C1=O 13911 [0,0,0,0,1,0|1,0,1]=3 46 B12R1.224 O=C(O)CC1=C(Br)C(Cl)=CC=C1 31465 [1,0,1,0,0,0|1,0,1]=4 47 B12R1.224 O=C(O)CC1=C(Cl)C(Cl)=CC=C1 26145 [1,0,1,0,0,0|1,0,1]=4 48 B12R1.224 O=C(O)CC1=C(F)C(Cl)=CC=C1 7138 [1,0,1,0,0,0|1,0,1]=4 49 B12R1.43 C\C(=C/C1=CC=CC=C1)C(=O)O 8190 [1,0,1,0,0,0|2,0,0]=4 50 B12R1.226 O=C(O)\C=C\C1=CC(Br)=CC=C1 3757 [1,0,1,0,0,0|1,1,0]=4 51 B12R1.226 O=C(O)\C=C\C1=CC(Cl)=CC=C1 3629 [1,0,1,0,0,0|1,0,0]=3 52 B12R1.226 O=C(O)\C=C\C1=CC(F)=CC=C1 3489 [1,0,1,0,0,0|1,1,0]=4 53 B12R1.226 O=C(O)\C=C\C1=CC(F)=CC=C1 4346 [1,0,1,0,0,0|1,1,0]=4 54 B12R1.226 O=C(O)\C=C\C1=CC(O)=CC=C1 8222 [1,0,1,0,0,0|2,0,0]=4 55 B12R1.125 O=C(O)\C=C\C1=C(Cl)C=CC=C1 3628 [1,0,1,0,0,0|2,0,0]=4 56 B12R1.1009 O=C(O)CC1=C(Cl)C=CC=C1Cl 4323 [1,0,1,0,0,0|2,0,0]=4 57 B12R1.1009 O=C(O)CC1=C(Cl)C=CC=C1F 4254 [1,0,1,0,0,0|2,0,0]=4 58 B12R1.1009 O=C(O)NC1=C(I)C=CN=C1Cl 16539 [1,0,1,0,0,0|2,0,0]=4 59 B12R2.24 BrC1=CC2=CC=CC=C2C=C1 9426 [2,0,0,0,0,0|2,0,0]=4 60 B12R2.24 BrC1=CC2=CC=CC=C2N=C1 5814 [2,0,0,0,0,0|1,0,1]=4 61 B12R2.24 BrC1=NC2=CC=CC=C2C=C1 21827 [2,0,0,0,0,0|1,0,1]=4 62 B12R2.24 CC1=CC2=CC=CC=C2N=C1 2344 [2,0,0,0,0,0|1,0,1]=4 63 B12R2.24 CC1=NC2=CC=CC=C2C=C1 5809 [2,0,0,0,0,0|1,0,1]=4 64 B12R2.24 ClC1=CC2=CC=CC=C2C=C1 9464 [2,0,0,0,0,0|2,0,0]=4 65 B12R2.24 ClC1=CC2=CC=CC=C2N=C1 14555 [2,0,0,0,0,0|1,0,1]=4 66 B12R2.24 ClC1=NC2=CC=CC=C2C=C1 7580 [2,0,0,0,0,0|1,0,1]=4 67 B12R2.24 FC1=CC2=CC=CC=C2C=C1 19886 [2,0,0,0,0,0|2,0,0]=4 68 B12R2.24 IC1=NC2=CC=CC=C2C=C1 24681 [2,0,0,0,0,0|1,0,1]=4 69 B12R2.24 NC1=CC2=CC=CC=C2C=C1 23236 [2,0,0,0,0,0|2,0,0]=4 70 B12R2.24 NC1=CC2=CC=CC=C2N=C1 12769 [2,0,0,0,0,0|1,0,1]=4 71 B12R2.24 NC1=NC2=CC=CC=C2C=C1 5818 [2,0,0,0,0,0|1,0,1]=4 72 B12R2.24 O=C1C=CC2=CC=CC=C2O1 21620 [2,0,0,0,0,0|1,0,0]=3 73 B12R2.24 O=C1C=CC2=CC=NC=C2N1 25763 [2,0,0,0,0,0|1,0,0]=3 74 B12R2.24 O=C1C=CC2=CN=CC=C2N1 27583 [2,0,0,0,0,0|1,0,0]=3 75 B12R2.24 O=C1COC2=C(C=CC=C2)N1 18791 [2,0,0,0,0,0|1,0,1]=4 76 B12R2.24 OC1=CC2=CC=CC=C2N=C1 12770 [2,0,0,0,0,0|0,0,1]=3 77 B12R2.24 OC1=CC=C2C=CC=NC2=C1 5841 [2,0,0,0,0,0|2,0,0]=4 78 B12R2.24 OC1=CC=C2C=CN=CC2=C1 6264 [2,0,0,0,0,0|2,0,0]=4 79 B12R2.24 OC1=CC=C2C=NC=CC2=C1 6260 [2,0,0,0,0,0|2,0,0]=4 80 B12R2.24 OC1=CC=C2N=CC=CC2=C1 5840 [2,0,0,0,0,0|2,0,0]=4 81 B12R2.24 OC1=NC2=CC=CC=C2N=C1 15472 [2,0,0,0,0,0|1,0,1]=4 82 B12R2.24 SC1=CC2=CC=CC=C2C=C1 6833 [2,0,0,0,0,0|1,1,0]=4 83 B12R2.1081 BrC1=C2N=CC=CC2=CC=C1 5816 [2,0,0,0,0,0|0,1,1]=4 84 B12R2.1081 Brc1cccc2ccccc12 36195 [2,0,0,0,0,0|1,1,0]=4 85 B12R2.1081 CC1=C2N=CC=CC2=CC=C1 5806 [2,0,0,0,0,0|1,0,1]=4 86 B12R2.1081 ClC1=C2C=NC=CC2=CC=C1 6216 [2,0,0,0,0,0|2,0,0]=4 87 B12R2.1081 ClC1=C2N=CC=CC2=CC=C1 10742 [2,0,0,0,0,0|0,0,1]=3 88 B12R2.1081 ClC1=C2N=CC=CC2=CC=N1 33824 [2,0,0,0,0,0|1,0,1]=4 89 B12R2.1081 ClC1=C2N=CN=CC2=CC=C1 23036 [2,0,0,0,0,0|1,0,1]=4 90 B12R2.1081 ClC1=CC=CC2=CC=CC=C12 9388 [2,0,0,0,0,0|1,0,0]=3 91 B12R2.1081 ClC1=NC=CC2=CC=CC=C21 13906 [2,0,0,0,0,0|2,0,0]=4 92 B12R2.1081 FC1=CC=CC2=CC=CC=C12 10866 [2,0,0,0,0,0|1,1,0]=4 93 B12R2.1081 IC1=CC=CC2=CC=CC=C12 28941 [2,0,0,0,0,0|1,1,0]=4 94 B12R2.1081 NC1=C2N=CC=CC2=CC=C1 7574 [2,0,0,0,0,0|1,0,1]=4 95 B12R2.1081 NC1=CC=CC2=CC=CC=C12 23886 [2,0,0,0,0,0|2,0,0]=4 96 B12R2.1081 OC1=C2N=CC=CC2=CC=C1 17430 [2,0,0,0,0,0|1,0,1]=4 97 B12R2.1081 OC1=CC=CC2=CC=CC=C12 16938 [2,0,0,0,0,0|2,0,0]=4 98 B12R2.1081 SC1=C2N=CC=CC2=CC=C1 5830 [2,0,0,0,0,0|1,0,1]=4 99 B14R2.4513 O=C1C=CC2=CC=C(O)C(O)=C2O1 13303 [1,1,0,0,0,0|2,0,0]=4 100 B14R2.1128 N#CC1=CC2=CC=CC=C2OC1=O 8675 [1,1,0,0,0,0|2,0,0]=4 101 B14R2.1801 COC1=CC2=NC=CC(Cl)=C2N=C1 34595 [1,1,0,0,0,0|1,0,1]=4 102 B14R2.1801 COC1=CC=C2C(Cl)=CC=NC2=C1 13232 [1,1,0,0,0,0|2,0,0]=4 103 B14R2.8620 CC1=C2C(=O)C(=O)NC2=C(F)C=C1 29126 [0,1,0,0,1,0|0,1,1]=4 104 B14R2.8620 CC1=C2NC(=O)C(=O)C2=C(Br)C=C1 13603 [0,1,0,0,1,0|1,0,1]=4 105 B14R2.8620 CC1=C2NC(=O)C(=O)C2=C(Cl)C=C1 29243 [0,1,0,0,1,0|1,0,1]=4 106 B14R2.8620 CC1=C2NC(=O)C(=O)C2=C(F)C=C1 29121 [0,1,0,0,1,0|1,0,1]=4 107 B14R2.8620 O=C1NC2=C(Br)C=CC(F)=C2C1=O 20357 [0,1,0,0,1,0|0,1,1]=4 108 B14R2.8620 O=C1NC2=C(F)C=CC(F)=C2C1=O 15260 [0,1,0,0,1,0|0,1,1]=4 109 B14R2.8737 CC1=C2NC(=O)C(=O)C2=CC=C1F 29125 [0,1,0,0,1,0|1,0,1]=4 110 B14R2.8737 CC1=CC=C2C(=O)C(=O)NC2=C1F 17138 [0,1,0,0,1,0|0,1,1]=4 111 B14R2.8737 CC1=CC=C2C(=O)C(=O)NC2=C1F 29127 [0,1,0,0,1,0|0,1,1]=4 112 B14R2.9184 CC1=C2NC(=O)C(=O)C2=CC(Cl)=C1 13601 [0,1,0,0,1,0|1,0,1]=4 113 B14R2.9184 CC1=C2NC(=O)C(=O)C2=CC(F)=C1 29123 [0,1,0,0,1,0|1,0,1]=4 114 B14R2.9184 CC1=CC(Br)=C2NC(=O)C(=O)C2=C1 7944 [0,1,0,0,1,0|0,1,1]=4 115 B14R2.9184 CC1=CC(F)=C2NC(=O)C(=O)C2=C1 17970 [0,1,0,0,1,0|0,1,1]=4 116 B14R2.9184 O=C1NC2=C(Cl)C=C(Cl)C=C2C1=O 22561 [0,1,0,0,1,0|0,0,1]=3 117 B14R2.11645 CCC1=C2NC(=O)C(=O)C2=CC=C1 27688 [0,1,0,0,1,0|1,0,1]=4 118 B14R2.11645 COC1=C2NC(=O)C(=O)C2=CC=C1 15517 [0,1,0,0,1,0|1,0,1]=4 119 B14R2.27750 O=C1NC2=CC(F)=CC(Cl)=C2C1=O 31700 [0,1,0,0,1,0|1,0,1]=4 120 B16R2.192589 O=CC1=CC2=CC(Cl)=CC(Cl)=C2OC1=O 8676 [0,2,0,0,0,0|1,0,1]=4 121 B14R2.4529 CC1=CC2=C(C=C1)OC(C(=O)O)=C2 32492 [0,0,1,1,0,0|2,0,0]=4 122 B14R2.4529 NC(=O)C1=CC2=C(C=CC(Br)=C2)O1 24755 [0,0,1,1,0,0|0,1,0]=3 123 B14R2.4529 NC1=CC2=C(C=C1)OC(C(=O)O)=C2 20509 [0,0,1,1,0,0|2,0,0]=4 124 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)O1 28019 [0,0,1,1,0,0|1,1,0]=4 125 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Cl)=C2)O1 28034 [0,0,1,1,0,0|1,0,0]=3 126 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Cl)=C2)S1 27991 [0,0,1,1,0,0|1,1,0]=4 127 B14R2.4529 O=C(O)C1=CC2=C(C=CC(F)=C2)O1 28035 [0,0,1,1,0,0|1,1,0]=4 128 B14R2.4529 O=C(O)C1=CC2=CC(Cl)=CC=C2N1 1670 [0,0,1,1,0,0|2,0,0]=4 129 B14R2.7969 CC1=CC=CC2=C1OC(C(=O)O)=C2 32491 [0,0,1,1,0,0|2,0,0]=4 130 B14R2.7969 O=C(O)C1=CC2=C(O1)C(Br)=CC=C2 32476 [0,0,1,1,0,0|1,1,0]=4 131 B14R2.7969 O=C(O)C1=CC2=C(O1)C(F)=CC=C2 32474 [0,0,1,1,0,0|1,1,0]=4 132 B14R2.7969 O=C(O)C1=CC2=C(S1)C(Cl)=CC=C2 34191 [0,0,1,1,0,0|1,1,0]=4 133 B14R2.7969 O=C(O)C1=CC2=CC=CC(Cl)=C2N1 28833 [0,0,1,1,0,0|2,0,0]=4 134 B12R1.24 NC1=C(C(=O)C=O)C=CC=C1F 28931 [0,0,1,0,1,0|0,1,1]=4 135 B12R1.225 O=C(O)[C@@H](O)C1=CC(Cl)=CC=C1 25302 [0,0,1,0,1,0|1,0,1]=4 136 B12R1.225 O=C(O)[C@H](O)C1=CC(Cl)=CC=C1 25304 [0,0,1,0,1,0|1,0,1]=4 137 B12R2.202 CC1=CC=CC2=C1NC(=O)S2 21873 [1,0,0,0,1,0|2,0,0]=4 138 B12R2.202 O=C1CC2=CC=CC(Br)=C2N1 8934 [1,0,0,0,1,0|0,1,1]=4 139 B12R2.202 O=C1CC2=CC=CC(Cl)=C2C1 18014 [1,0,0,0,1,0|1,0,1]=4 140 B12R2.202 O=C1CC2=CC=CC(Cl)=C2N1 8305 [1,0,0,0,1,0|0,0,1]=3 141 B12R2.202 O=C1CC2=CC=CC(F)=C2N1 8552 [1,0,0,0,1,0|0,1,1]=4 142 B12R2.202 O=C1NC2=C(C=CC=C2Cl)S1 21835 [1,0,0,0,1,0|1,0,0]=3 143 B12R2.202 O=C1NC2=C(C=CC=C2F)S1 21838 [1,0,0,0,1,0|1,1,0]=4 144 B12R2.203 CC1=CSC2=C1C(Cl)=CC=C2 33022 [1,0,0,0,1,0|2,0,0]=4 145 B12R2.203 O=C1CCC2=CC=CC(Cl)=C12 13780 [1,0,0,0,1,0|0,0,2]=4 146 B12R2.203 O=C1COC2=C1C(Cl)=CC=C2 17974 [1,0,0,0,1,0|1,0,1]=4 147 B12R2.203 O=C1NOC2=C1C(Cl)=CC=C2 17389 [1,0,0,0,1,0|2,0,0]=4 148 B12R2.203 O=C1OCC2=CC=CC(Cl)=C12 19473 [1,0,0,0,1,0|1,0,1]=4 149 B12R2.18 CC1=C(C)C2=CC=CC=C2N1 7334 [1,0,0,0,1,0|2,0,0]=4 150 B12R2.18 O=C1NC2=CC=CC=C2C1=O 13609 [1,0,0,0,1,0|0,0,1]=3 151 B12R2.18 O=C1NC2=NC=CC=C2C1=O 26690 [1,0,0,0,1,0|1,0,1]=4 152 B12R2.196 CC1=C2NC=C(Br)C2=CC=C1 8324 [1,0,0,0,1,0|2,0,0]=4 153 B12R2.196 CC1=CSC2=C1C=CC=C2Cl 13563 [1,0,0,0,1,0|2,0,0]=4 154 B12R2.196 ClC1=C2NC=C(Br)C2=CC=C1 7965 [1,0,0,0,1,0|1,0,0]=3 155 B12R2.196 ClC1=C2NN=C(Br)C2=CC=C1 33047 [1,0,0,0,1,0|2,0,0]=4 156 B12R2.196 ClC1=C2NN=C(I)C2=CC=C1 33048 [1,0,0,0,1,0|2,0,0]=4