0 B14R2.8239 CC1=CC2=CC(Cl)=CC=C2N=C1Cl OR307884 [0,0,0,0,0,0|4,0,0]=4 1 B14R2.8239 CC1=CC2=CC=C(Br)C=C2N=C1Cl OR307503 [0,0,0,0,0,0|2,1,1]=4 2 B14R2.8239 CC1=CC2=CC=C(Cl)C=C2N=C1N OR309449 [0,0,0,0,0,0|2,0,1]=3 3 B14R2.8239 CC1=CC=C2C=C(C)C(N)=NC2=C1 OR309450 [0,0,0,0,0,0|3,0,1]=4 4 B14R2.8239 CC1OC2=CC=C(N)C=C2NC1=O OR13750 [0,0,0,0,0,0|3,0,1]=4 5 B14R2.8239 OC1=NC2=CC=C(Cl)C=C2N=C1O OR11158 [0,0,0,0,0,0|1,0,2]=3 6 B13R2.155 BrC1=CC=C2C=CC(Br)=CC2=C1 OR19537 [1,0,0,0,0,0|2,1,0]=4 7 B13R2.155 CC1=CC2=C(C=C1)C=CC(C)=C2 OR3785 [1,0,0,0,0,0|3,0,0]=4 8 B13R2.155 CC1=CC=C2C=CC(=O)OC2=C1 OR30939 [1,0,0,0,0,0|2,0,0]=3 9 B13R2.155 CC1=CC=C2C=CC(C)=NC2=C1 OR928151 [1,0,0,0,0,0|2,0,1]=4 10 B13R2.155 CC1=NC2=CC(Br)=CC=C2C=C1 OR309220 [1,0,0,0,0,0|1,1,1]=4 11 B13R2.155 CC1=NC2=CC(Cl)=CC=C2C=C1 OR8258 [1,0,0,0,0,0|1,0,1]=3 12 B13R2.155 ClC1=CC2=CC(Br)=CC=C2C=N1 OR40220 [1,0,0,0,0,0|3,0,0]=4 13 B13R2.155 ClC1=CC2=CC(Br)=CN=C2C=C1 OR52668 [1,0,0,0,0,0|3,0,0]=4 14 B13R2.155 ClC1=CC=C2C=NC(Br)=CC2=C1 OR300092 [1,0,0,0,0,0|3,0,0]=4 15 B13R2.155 ClC1=NC2=CC(Br)=CC=C2C=C1 OR3654 [1,0,0,0,0,0|1,1,1]=4 16 B13R2.155 NC1=CC2=C(C=C1)OCC(=O)N2 OR110727 [1,0,0,0,0,0|2,0,1]=4 17 B13R2.155 NC1=CC2=CC(Cl)=CC=C2N=C1 OR42242 [1,0,0,0,0,0|3,0,0]=4 18 B13R2.155 NC1=CC=C2C=NC(Cl)=CC2=C1 OR300114 [1,0,0,0,0,0|3,0,0]=4 19 B13R2.155 NC1=NC2=NC(Cl)=CC=C2C=C1 OR52698 [1,0,0,0,0,0|2,0,1]=4 20 B13R2.155 O=C1C=CC2=CC=C(O)C=C2O1 OR14329 [1,0,0,0,0,0|2,0,0]=3 21 B13R2.155 O=C1CCC2=CC=C(Cl)C=C2C1 OR12937 [1,0,0,0,0,0|1,0,2]=4 22 B13R2.155 O=C1CCC2=CC=C(O)C=C2N1 OR59478 [1,0,0,0,0,0|1,0,2]=4 23 B13R2.155 O=C1COC2=C(C=C(Cl)C=C2)N1 OR8948 [1,0,0,0,0,0|1,0,1]=3 24 B13R2.155 OC1=CC=C2C=CC(Br)=CC2=C1 OR301112 [1,0,0,0,0,0|1,1,1]=4 25 B13R2.155 OC1=CC=C2C=NC(Cl)=CC2=C1 OR300116 [1,0,0,0,0,0|2,0,1]=4 26 B13R2.369 CC1=CC2=CC=CC=C2N=C1N OR307516 [1,0,0,0,0,0|2,0,1]=4 27 B13R2.369 CC1OC2=C(C=CC=C2)NC1=O OR110335 [1,0,0,0,0,0|2,0,1]=4 28 B13R2.369 NC1=C(O)C=C2C=CC=CC2=C1 OR27856 [1,0,0,0,0,0|2,0,0]=3 29 B13R2.369 O=C1CC2=CC=CC=C2OC1=O OR9103 [1,0,0,0,0,0|1,0,2]=4 30 B13R2.3683 BrC1=CC2=CC=C(I)C=C2N=C1 OR55324 [1,0,0,0,0,0|1,1,1]=4 31 B13R2.3683 BrC1=CC=C2C=C(Br)C=CC2=C1 OR46098 [1,0,0,0,0,0|2,1,0]=4 32 B13R2.3683 CC1=CC=C2C=C(C)C=CC2=C1 OR17622 [1,0,0,0,0,0|3,0,0]=4 33 B13R2.3683 CC1=NC2=CC=C(O)C=C2C=C1 OR22357 [1,0,0,0,0,0|3,0,0]=4 34 B13R2.3683 ClC1=CC2=CC=C(Br)C=C2C=N1 OR40228 [1,0,0,0,0,0|3,0,0]=4 35 B13R2.3683 ClC1=CC=C2C=C(Br)N=CC2=C1 OR300094 [1,0,0,0,0,0|3,0,0]=4 36 B13R2.3683 ClC1=CC=C2C=C(Cl)C=CC2=C1 OR1108 [1,0,0,0,0,0|2,0,0]=3 37 B13R2.3683 ClC1=CC=C2N=C(Cl)C=CC2=C1 OR307515 [1,0,0,0,0,0|3,0,0]=4 38 B13R2.3683 ClC1=NC2=CC=C(Br)C=C2C=C1 OR17558 [1,0,0,0,0,0|3,0,0]=4 39 B13R2.3683 NC1=CC2=CC=C(Br)C=C2C=C1 OR8620 [1,0,0,0,0,0|2,1,0]=4 40 B13R2.3683 NC1=CC2=CC=C(Br)C=C2N=C1 OR42245 [1,0,0,0,0,0|1,1,1]=4 41 B13R2.3683 NC1=CC2=CC=C(O)N=C2C=C1 OR302388 [1,0,0,0,0,0|3,0,0]=4 42 B13R2.3683 NC1=CC=C2C=C(Cl)N=CC2=C1 OR300115 [1,0,0,0,0,0|3,0,0]=4 43 B13R2.3683 NC1=CC=C2C=C(O)N=CC2=C1 OR43644 [1,0,0,0,0,0|3,0,0]=4 44 B13R2.3683 O=C1C=CC2=CC(O)=CC=C2O1 OR9098 [1,0,0,0,0,0|3,0,0]=4 45 B13R2.3683 OC1=CC2=C(C=C1)C=C(Br)C=C2 OR1161 [1,0,0,0,0,0|1,1,0]=3 46 B13R2.3683 OC1=CC2=CC=C(Br)C=C2C=N1 OR42115 [1,0,0,0,0,0|2,1,0]=4 47 B13R2.3683 OC1=CC=C2C=C(Cl)N=CC2=C1 OR300117 [1,0,0,0,0,0|2,0,0]=3 48 B13R2.3683 OC1=NC2=CC=C(Br)C=C2C=C1 OR307506 [1,0,0,0,0,0|2,1,0]=4 49 B13R2.3683 OC1=NC2=CC=C(Cl)C=C2N=C1 OR11188 [1,0,0,0,0,0|1,0,1]=3 50 B15R2.1754 N#CC1=CC2=CC=C(Cl)C=C2N=C1Cl OR309453 [0,1,0,0,0,0|2,0,1]=4 51 B15R2.1824 O=C1OC2=C(C=C(Cl)C=C2)N\C1=N\O OR12056 [0,1,0,0,0,0|1,0,2]=4 52 B15R2.1824 O=CC1=CC2=CC(Cl)=CC=C2N=C1Cl OR12545 [0,1,0,0,0,0|3,0,0]=4 53 B15R2.62227 O=C1NC2=CC(Cl)=C(Cl)C=C2NC1=O OR11519 [0,1,0,0,0,0|1,0,1]=3 54 B15R2.62227 OC1=CC2=CC(O)=C(Br)C=C2C=C1Br OR28082 [0,1,0,0,0,0|2,1,0]=4 55 B13R1.133 O=C(O)C(O)CC1=CC=C(Cl)C=C1 OR471447 [0,0,1,0,0,0|1,0,2]=4 56 B13R2.3028 CC1=C(Br)SC2=C1C=C(Cl)C=C2 OR3913 [0,0,0,0,1,0|3,0,0]=4 57 B13R2.3028 CC1=CC=C2NC(=O)C(=O)C2=C1 OR30934 [0,0,0,0,1,0|2,0,1]=4 58 B13R2.3028 O=C1NC2=C(C=C(I)C=C2)C1=O OR9765 [0,0,0,0,1,0|1,1,1]=4 59 B13R2.3028 O=C1NC2=CC=C(Br)C=C2C1=O OR28576 [0,0,0,0,1,0|1,1,1]=4 60 B13R2.3028 O=C1NC2=CC=C(Cl)C=C2C1=O OR18353 [0,0,0,0,1,0|1,0,1]=3 61 B13R2.5190 CN1C(=O)NC2=C1C=CC(N)=C2 OR310077 [0,0,0,0,1,0|3,0,0]=4 62 B13R2.5190 O=C1NC2=CC(Br)=CC=C2C1=O OR3605 [0,0,0,0,1,0|0,1,1]=3 63 B13R2.5190 O=C1NC2=CC(Cl)=CC=C2C1=O OR40689 [0,0,0,0,1,0|0,0,1]=2 64 B13R2.5190 O=C1NC2=CC(I)=CC=C2C1=O OR310070 [0,0,0,0,1,0|0,1,1]=3 65 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 OR18348 [1,0,1,0,0,0|2,0,0]=4 66 B12R1.21 NC1=CC=C(C=CC(=O)O)C=C1 OR11317 [1,0,1,0,0,0|2,0,0]=4 67 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)C=C1 OR6580 [1,0,1,0,0,0|1,1,0]=4 68 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 OR6578 [1,0,1,0,0,0|1,0,0]=3 69 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 OR55198 [1,0,1,0,0,0|2,0,0]=4 70 B12R1.21 O=[N+]([O-])\C=C\C1=CC=C(Cl)C=C1 OR0285 [1,0,1,0,0,0|2,0,0]=4 71 B12R1.43 O=C(O)C(=O)NC1=CC=CC=C1 OR14807 [1,0,1,0,0,0|1,0,0]=3 72 B12R1.50 O=C(CCl)NC1=CC(Cl)=CC=C1 OR3114 [1,0,1,0,0,0|1,0,1]=4 73 B12R1.226 O=C(O)\C=C\C1=CC=CC(Cl)=C1 OR6577 [1,0,1,0,0,0|2,0,0]=4 74 B12R1.127 O=C(O)CC1=C(Br)C=CC(Cl)=C1 OR2153 [1,0,1,0,0,0|2,0,0]=4 75 B12R1.127 O=C(O)CC1=C(O)C=CC(Cl)=C1 OR55449 [1,0,1,0,0,0|2,0,0]=4 76 B12R1.233 O=C(O)CC1=C(Br)C=C(Cl)C=C1 OR400058 [1,0,1,0,0,0|1,0,1]=4 77 B12R1.233 O=C(O)CC1=C(Cl)C=C(Cl)C=C1 OR5793 [1,0,1,0,0,0|1,0,1]=4 78 B12R2.24 BrC1=CC2=CC=CC=C2C=C1 OR18329 [2,0,0,0,0,0|1,1,0]=4 79 B12R2.24 BrC1=CC2=CC=CC=C2N=C1 OR1946 [2,0,0,0,0,0|1,0,1]=4 80 B12R2.24 BrC1=CC2=NC=CC=C2C=C1 OR17561 [2,0,0,0,0,0|0,1,1]=4 81 B12R2.24 BrC1=NC2=CC=CC=C2C=C1 OR17842 [2,0,0,0,0,0|1,0,1]=4 82 B12R2.24 ClC1=CC2=CC=CC=C2C=N1 OR6098 [2,0,0,0,0,0|2,0,0]=4 83 B12R2.24 ClC1=CC=C2C=CC=NC2=C1 OR14909 [2,0,0,0,0,0|0,0,1]=3 84 B12R2.24 ClC1=CC=C2N=CC=CC2=C1 OR4203 [2,0,0,0,0,0|2,0,0]=4 85 B12R2.24 ClC1=CC=C2N=CC=NC2=C1 OR11146 [2,0,0,0,0,0|1,0,1]=4 86 B12R2.24 ClC1=NC2=CC=CC=C2C=C1 OR40446 [2,0,0,0,0,0|1,0,1]=4 87 B12R2.24 NC1=CC2=CC=CC=C2N=C1 OR30967 [2,0,0,0,0,0|1,0,1]=4 88 B12R2.24 NC1=CC2=NC=CC=C2C=C1 OR46576 [2,0,0,0,0,0|1,0,1]=4 89 B12R2.24 NC1=NC2=CC=CC=C2C=C1 OR22144 [2,0,0,0,0,0|1,0,1]=4 90 B12R2.24 O=C1CCC2=C(C=CC=C2)N1 OR4829 [2,0,0,0,0,0|0,0,2]=4 91 B12R2.24 O=C1CSC2=CC=CC=C2N1 OR7000 [2,0,0,0,0,0|1,0,1]=4 92 B12R2.24 OC1=CC2=C(C=CC=C2)C=N1 OR1224 [2,0,0,0,0,0|2,0,0]=4 93 B12R2.24 OC1=CC2=NC=CC=C2N=C1 OR53176 [2,0,0,0,0,0|1,0,1]=4 94 B12R2.24 OC1=CC=C2C=CC=NC2=C1 OR301114 [2,0,0,0,0,0|1,0,1]=4 95 B12R2.24 OC1=CC=C2C=CN=CC2=C1 OR30506 [2,0,0,0,0,0|2,0,0]=4 96 B12R2.24 OC1=CC=C2C=NC=CC2=C1 OR6099 [2,0,0,0,0,0|2,0,0]=4 97 B12R2.24 OC1=CC=C2N=CC=CC2=C1 OR14332 [2,0,0,0,0,0|2,0,0]=4 98 B12R2.24 OC1=NC2=CC=CC=C2C=C1 OR18280 [2,0,0,0,0,0|0,0,2]=4 99 B12R2.24 OC1=NC2=CC=CC=C2N=C1 OR11198 [2,0,0,0,0,0|1,0,1]=4 100 B12R2.24 SC1=CC2=C(C=CC=C2)C=C1 OR0790 [2,0,0,0,0,0|1,1,0]=4 101 B14R1.536 N#C\C(=C/C1=CC=C(Cl)C=C1)C(=O)O OR14200 [0,1,1,0,0,0|2,0,0]=4 102 B14R2.134 O=CC1=CC=C2C=NC(Cl)=CC2=C1 OR300076 [1,1,0,0,0,0|2,0,0]=4 103 B14R2.29365 CC1=CC(=O)OC2=C1C=CC(N)=C2 OR9400 [1,1,0,0,0,0|2,0,0]=4 104 B14R2.29365 CC1=CC(=O)OC2=C1C=CC(O)=C2 OR7969 [1,1,0,0,0,0|2,0,0]=4 105 B14R2.29365 CC1=CC(=O)OC2=CC(S)=CC=C12 OR52240 [1,1,0,0,0,0|2,0,0]=4 106 B14R2.29365 CC1=CC=C2C(=O)OC(=O)NC2=C1 OR400018 [1,1,0,0,0,0|2,0,0]=4 107 B14R2.29365 O=C1NC2=CC(Br)=CC=C2C(=O)O1 OR400015 [1,1,0,0,0,0|1,1,0]=4 108 B14R2.29365 O=C1NC2=CC(Cl)=CC=C2C(=O)O1 OR400016 [1,1,0,0,0,0|1,0,0]=3 109 B14R2.1128 O=C1NC2=CC=CC=C2N=C1CBr OR9013 [1,1,0,0,0,0|2,0,0]=4 110 B14R2.1128 O=C1NC2=CC=CC=C2N\C1=N\O OR12080 [1,1,0,0,0,0|1,0,0]=3 111 B14R2.1128 O=C1OC2=C(C=CC=C2)N\C1=N\O OR12020 [1,1,0,0,0,0|2,0,0]=4 112 B14R2.1128 O=C1SC2=C(C=CC=C2)N\C1=N\O OR12019 [1,1,0,0,0,0|2,0,0]=4 113 B14R2.1128 O=CC1=CC2=CC=CC=C2N=C1O OR14001 [1,1,0,0,0,0|2,0,0]=4 114 B14R2.1128 OCC1=CC2=CC=CC=C2N=C1O OR14005 [1,1,0,0,0,0|0,0,2]=4 115 B14R2.2332 COC1=CC=C2C=C(Br)C=CC2=C1 OR28828 [1,1,0,0,0,0|1,1,0]=4 116 B14R2.2332 COC1=CC=C2N=C(Cl)C=CC2=C1 OR307500 [1,1,0,0,0,0|2,0,0]=4 117 B14R2.2332 N#CC1=CC2=CC=C(O)C=C2C=C1 OR61500 [1,1,0,0,0,0|2,0,0]=4 118 B14R2.2332 O=CC1=CC2=CC=C(O)C=C2C=C1 OR14282 [1,1,0,0,0,0|2,0,0]=4 119 B14R2.645 O=C1NC2=C(C=C(Cl)C(Br)=C2)C1=O OR52245 [0,1,0,0,1,0|1,0,1]=4 120 B14R2.19008 O=CC1=C(Br)SC2=CC=C(Cl)C=C21 OR26058 [0,1,0,0,1,0|2,0,0]=4 121 B14R2.1815 COC1=CC=C2C(=O)C(=O)NC2=C1 OR52220 [0,1,0,0,1,0|1,0,1]=4 122 B16R2.23520 CC1=NC2=CC(Cl)=CC=C2C=C1C(=O)O OR3612 [0,2,0,0,0,0|1,0,1]=4 123 B16R2.23520 O=C(O)C1=CC2=C(C=C(O)C=C2)OC1=O OR351002 [0,2,0,0,0,0|2,0,0]=4 124 B16R2.192946 CC1=C(C)C=C2N\C(=N\O)C(=O)NC2=C1 OR12085 [0,2,0,0,0,0|2,0,0]=4 125 B16R2.192946 O=C1NC2=C(C=C(Cl)C(Cl)=C2)N\C1=N\O OR12071 [0,2,0,0,0,0|1,0,0]=3 126 B14R2.4529 O=C(O)C1=CC2=C(C=C(Cl)C=C2)S1 OR14043 [0,0,1,1,0,0|1,1,0]=4 127 B14R2.8620 O=C1NC2=C(Cl)C=CC(Cl)=C2C1=O OR28538 [0,0,1,1,0,0|1,0,1]=4 128 B12R1.20 CC(=O)C(=O)C1=CC=C(Cl)C=C1 OR7779 [0,0,1,0,1,0|1,0,1]=4 129 B12R1.20 O=C(O)C(O)C1=CC=C(Cl)C=C1 OR13218 [0,0,1,0,1,0|1,0,1]=4 130 B12R2.132 CC1=CNC2=C1C=C(Cl)C=C2 OR40238 [1,0,0,0,1,0|2,0,0]=4 131 B12R2.132 CC1=CSC2=C1C=C(Cl)C=C2 OR1242 [1,0,0,0,1,0|2,0,0]=4 132 B12R2.132 CN1C=CC2=CC=C(Cl)C=C21 OR70060 [1,0,0,0,1,0|2,0,0]=4 133 B12R2.132 O=C1COC2=CC=C(Cl)C=C12 OR40015 [1,0,0,0,1,0|1,0,1]=4 134 B12R2.132 O=C1NCC2=C1C=C(Cl)C=C2 OR305292 [1,0,0,0,1,0|1,0,1]=4 135 B12R2.606 CC1=CC2=C(C=C(Cl)C=C2)N1 OR7950 [1,0,0,0,1,0|1,0,0]=3 136 B12R2.606 O=C1CC2=C(C=CC(Cl)=C2)N1 OR10940 [1,0,0,0,1,0|2,0,0]=4 137 B12R2.606 O=C1CC2=CC=C(Br)C=C2N1 OR10384 [1,0,0,0,1,0|0,1,1]=4 138 B12R2.606 O=C1CC2=CC=C(Cl)C=C2N1 OR18299 [1,0,0,0,1,0|0,0,1]=3 139 B12R2.606 O=C1CC2=CN=C(Cl)C=C2N1 OR310092 [1,0,0,0,1,0|1,0,1]=4 140 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)N1 OR13660 [1,0,0,0,1,0|1,1,0]=4 141 B12R2.606 O=C1NC2=C(C=C(Cl)C=C2)O1 OR5094 [1,0,0,0,1,0|2,0,0]=4 142 B12R2.606 O=C1NC2=CC(Cl)=CC=C2O1 OR18273 [1,0,0,0,1,0|1,0,0]=3 143 B12R2.606 O=C1NC2=CC(Cl)=CC=C2S1 OR10944 [1,0,0,0,1,0|1,0,0]=3 144 B12R2.18 CC1=C(C)C2=C(C=CC=C2)N1 OR10173 [1,0,0,0,1,0|2,0,0]=4 145 B12R2.18 CC1C(=O)NC2=C1C=CC=C2 OR53155 [1,0,0,0,1,0|1,0,1]=4 146 B12R2.18 CN1C(=O)NC2=C1C=CC=C2 OR60004 [1,0,0,0,1,0|2,0,0]=4 147 B12R2.18 O=C1NC2=CC=CC=C2C1=O OR53066 [1,0,0,0,1,0|0,0,1]=3 148 B12R2.18 O=C1NC2=NC=CC=C2C1=O OR305630 [1,0,0,0,1,0|1,0,1]=4 149 B12R2.612 CC1=CNC2=CC(Br)=CC=C12 OR62080 [1,0,0,0,1,0|1,1,0]=4 150 B12R2.612 OC1=NOC2=CC(Cl)=CC=C21 OR27159 [1,0,0,0,1,0|2,0,0]=4