0 B8R1.18 BrC1=CC(Br)=C(Br)S1 MC41711 [0,0,0,0,0,0|4,0,0]=4 1 B8R1.18 BrC1=NC(Br)=C(Br)N1 CS22531 [0,0,0,0,0,0|4,0,0]=4 2 B8R1.18 BrC1=NC(Br)=C(Br)S1 MC442187 [0,0,0,0,0,0|3,0,0]=3 3 B8R1.18 CC1=C(Br)N=C(Br)S1 MC442181 [0,0,0,0,0,0|2,0,0]=2 4 B8R1.18 CC1=C(Br)NC(Br)=N1 CS19876 [0,0,0,0,0,0|3,0,0]=3 5 B8R1.18 CC1=C(Br)SC(Br)=C1 MC442189 [0,0,0,0,0,0|3,0,0]=3 6 B8R1.18 CC1=C(Br)SC(N)=N1 CS15953 [0,0,0,0,0,0|2,0,0]=2 7 B8R1.18 CC1=C(Br)SC(N)=N1 CS21269 [0,0,0,0,0,0|2,0,0]=2 8 B8R1.18 CC1=C(C)OC(=O)O1 CS18029 [0,0,0,0,0,0|2,1,0]=3 9 B8R1.18 CC1=C(C)SC(Br)=N1 CS13229 [0,0,0,0,0,0|1,0,0]=1 10 B8R1.18 CC1=C(C)SC(N)=N1 CS21234 [0,0,0,0,0,0|1,0,0]=1 11 B8R1.18 CC1=C(Cl)N=C(Cl)S1 CS16846 [0,0,0,0,0,0|2,0,0]=2 12 B8R1.18 CC1=C(Cl)SC(Br)=C1 MC442569 [0,0,0,0,0,0|3,0,0]=3 13 B8R1.18 CC1=C(Cl)SC(Cl)=C1 CS17499 [0,0,0,0,0,0|3,0,0]=3 14 B8R1.18 CC1=C(I)NC(I)=N1 CS19843 [0,0,0,0,0,0|3,0,0]=3 15 B8R1.18 CC1=CC(=O)N(C)N1 CS18184 [0,0,0,0,0,0|3,0,1]=4 16 B8R1.18 CC1=CC(C)=NN1C CS19810 [0,0,0,0,0,0|2,0,0]=2 17 B8R1.18 CC1=CC(I)=C(C)S1 MC425075 [0,0,0,0,0,0|2,0,0]=2 18 B8R1.18 CC1=CC(N)=NN1C CS13792 [0,0,0,0,0,0|3,0,0]=3 19 B8R1.18 CC1=NC(Br)=CN1C MC107044 [0,0,0,0,0,0|3,0,0]=3 20 B8R1.18 CC1=NN(C)C(=O)C1 CS17716 [0,0,0,0,0,0|3,0,0]=3 21 B8R1.18 CC1=NN(C)C=C1I MC431130 [0,0,0,0,0,0|3,0,0]=3 22 B8R1.18 CN1C=C(Br)C(N)=N1 CS22065 [0,0,0,0,0,0|4,0,0]=4 23 B8R1.18 CN1N=C(Br)C(Br)=N1 MC441040 [0,0,0,0,0,0|4,0,0]=4 24 B8R1.18 CN1N=C(Br)C=C1N CS14912 [0,0,0,0,0,0|4,0,0]=4 25 B8R1.18 CN1N=C(Br)N=C1Br CS16395 [0,0,0,0,0,0|4,0,0]=4 26 B8R1.18 CN1N=C(Cl)C=C1N MC105283 [0,0,0,0,0,0|4,0,0]=4 27 B8R1.18 ClC1=C(Cl)NC(Br)=N1 MC425712 [0,0,0,0,0,0|4,0,0]=4 28 B8R1.18 ClC1=C(Cl)SC(Br)=C1 CS16855 [0,0,0,0,0,0|4,0,0]=4 29 B7R1.2 BrC1=CC=C(Br)S1 CS22553 [1,0,0,0,0,0|3,0,0]=4 30 B7R1.2 BrC1=CN=C(Br)S1 CS19923 [1,0,0,0,0,0|2,0,0]=3 31 B7R1.2 BrC1=CSC(Br)=C1 MC41669 [1,0,0,0,0,0|3,0,0]=4 32 B7R1.2 BrC1=CSC(Br)=N1 CS13368 [1,0,0,0,0,0|2,0,0]=3 33 B7R1.2 CC1=CC(Br)=CS1 CS22736 [1,0,0,0,0,0|2,0,0]=3 34 B7R1.2 CC1=CC(Br)=NN1 CS12832 [1,0,0,0,0,0|3,0,0]=4 35 B7R1.2 CC1=CC(Br)=NO1 MC113406 [1,0,0,0,0,0|3,0,0]=4 36 B7R1.2 CC1=CC(C)=NN1 CS19982 [1,0,0,0,0,0|2,0,0]=3 37 B7R1.2 CC1=CC(C)=NO1 CS14107 [1,0,0,0,0,0|2,0,0]=3 38 B7R1.2 CC1=CC(I)=NN1 CS16887 [1,0,0,0,0,0|3,0,0]=4 39 B7R1.2 CC1=CC=C(Br)S1 CS22735 [1,0,0,0,0,0|2,0,0]=3 40 B7R1.2 CC1=CC=C(C)N1 CS21153 [1,0,0,0,0,0|1,0,1]=3 41 B7R1.2 CC1=CN(C)C=N1 MC111221 [1,0,0,0,0,0|2,0,0]=3 42 B7R1.2 CC1=CN(C)N=C1 CS20542 [1,0,0,0,0,0|2,0,0]=3 43 B7R1.2 CC1=CN(C)N=N1 MC103246 [1,0,0,0,0,0|3,0,0]=4 44 B7R1.2 CC1=CN=C(Br)S1 CS12301 [1,0,0,0,0,0|1,0,0]=2 45 B7R1.2 CC1=CN=C(C)S1 CS22782 [1,0,0,0,0,0|0,0,0]=1 46 B7R1.2 CC1=CN=C(N)S1 CS21821 [1,0,0,0,0,0|1,0,0]=2 47 B7R1.2 CC1=CNC(Br)=N1 MC111806 [1,0,0,0,0,0|2,0,0]=3 48 B7R1.2 CC1=CNC(C)=N1 CS21117 [1,0,0,0,0,0|1,0,0]=2 49 B7R1.2 CC1=COC(Br)=N1 MC113513 [1,0,0,0,0,0|1,1,0]=3 50 B7R1.2 CC1=CSC(Br)=N1 CS18300 [1,0,0,0,0,0|1,0,0]=2 51 B7R1.2 CC1=CSC(C)=N1 CS22781 [1,0,0,0,0,0|0,0,0]=1 52 B7R1.2 CC1=CSC(N)=C1 MC113026 [1,0,0,0,0,0|2,0,0]=3 53 B7R1.2 CC1=CSC(N)=C1 MC121228 [1,0,0,0,0,0|2,0,0]=3 54 B7R1.2 CC1=NC(C)CO1 MC428186 [1,0,0,0,0,0|0,1,2]=4 55 B7R1.2 CC1=NC(I)=CS1 MC432141 [1,0,0,0,0,0|1,0,0]=2 56 B7R1.2 CC1=NC=C(I)N1 CS19295 [1,0,0,0,0,0|2,0,0]=3 57 B7R1.2 CC1=NC=C(I)S1 MC441133 [1,0,0,0,0,0|1,0,0]=2 58 B7R1.2 CC1=NC=C(N)N1 MC445566 [1,0,0,0,0,0|2,0,0]=3 59 B7R1.2 CC1=NC=C(N)S1 CS15937 [1,0,0,0,0,0|1,0,0]=2 60 B7R1.2 CC1=NN(C)C=C1 CS20520 [1,0,0,0,0,0|2,0,0]=3 61 B7R1.2 CC1=NN=C(Br)S1 CS22523 [1,0,0,0,0,0|2,0,0]=3 62 B7R1.2 CC1=NN=C(C)O1 CS15161 [1,0,0,0,0,0|1,1,0]=3 63 B7R1.2 CC1=NN=C(N)N1 CS22083 [1,0,0,0,0,0|3,0,0]=4 64 B7R1.2 CC1=NNC(=O)C1 CS16242 [1,0,0,0,0,0|3,0,0]=4 65 B7R1.2 CC1=NNC(=O)O1 CS10427 [1,0,0,0,0,0|2,1,0]=4 66 B7R1.2 CC1=NNC(=O)S1 MC107311 [1,0,0,0,0,0|2,0,0]=3 67 B7R1.2 CC1=NNC(C)=N1 MC444208 [1,0,0,0,0,0|2,0,0]=3 68 B7R1.2 CC1=NOC(N)=C1 CS16239 [1,0,0,0,0,0|3,0,0]=4 69 B7R1.2 CC1=NSC(=O)O1 MC42245 [1,0,0,0,0,0|2,1,0]=4 70 B7R1.2 CC1=NSC(Br)=C1 CS10288 [1,0,0,0,0,0|3,0,0]=4 71 B7R1.2 CC1=NSC(Br)=N1 MC115942 [1,0,0,0,0,0|2,0,0]=3 72 B7R1.2 CC1=NSC(I)=C1 MC100265 [1,0,0,0,0,0|3,0,0]=4 73 B7R1.2 CC1=NSC(N)=C1 CS16387 [1,0,0,0,0,0|3,0,0]=4 74 B7R1.2 CN1C=C(Br)C=N1 CS19794 [1,0,0,0,0,0|3,0,0]=4 75 B7R1.2 CN1C=C(Cl)C=N1 CS12276 [1,0,0,0,0,0|3,0,0]=4 76 B7R1.2 CN1C=C(I)C=N1 CS20765 [1,0,0,0,0,0|3,0,0]=4 77 B7R1.2 CN1C=C(N)C=N1 CS12134 [1,0,0,0,0,0|3,0,0]=4 78 B7R1.2 CN1C=C(N)C=N1 CS15973 [1,0,0,0,0,0|3,0,0]=4 79 B7R1.2 CN1C=C(N)C=N1 MC41661 [1,0,0,0,0,0|3,0,0]=4 80 B7R1.2 CN1C=CC(Br)=N1 CS20720 [1,0,0,0,0,0|3,0,0]=4 81 B7R1.2 CN1C=CC(I)=N1 MC442844 [1,0,0,0,0,0|3,0,0]=4 82 B7R1.2 CN1C=CC(N)=N1 CS13878 [1,0,0,0,0,0|3,0,0]=4 83 B7R1.2 CN1C=NC(Br)=N1 CS22130 [1,0,0,0,0,0|3,0,0]=4 84 B7R1.2 CN1C=NC(I)=C1 CS16068 [1,0,0,0,0,0|3,0,0]=4 85 B7R1.2 CN1C=NC(N)=C1 CS15605 [1,0,0,0,0,0|3,0,0]=4 86 B7R1.2 CN1C=NC(N)=C1 MC102995 [1,0,0,0,0,0|3,0,0]=4 87 B7R1.2 CN1C=NC(N)=N1 MC443496 [1,0,0,0,0,0|3,0,0]=4 88 B7R1.2 CN1N=CC(Br)=N1 CS17389 [1,0,0,0,0,0|3,0,0]=4 89 B7R1.2 ClC1=CC=C(I)S1 MC114731 [1,0,0,0,0,0|3,0,0]=4 90 B7R1.2 ClC1=CN=C(Br)S1 MC441007 [1,0,0,0,0,0|2,0,0]=3 91 B7R1.2 ClC1=CSC(Br)=N1 CS17180 [1,0,0,0,0,0|2,0,0]=3 92 B7R1.2 ClC1=CSC(Cl)=N1 CS14318 [1,0,0,0,0,0|2,0,0]=3 93 B7R1.2 ClC1=NC(Br)=CS1 MC425755 [1,0,0,0,0,0|2,0,0]=3 94 B7R1.2 ClC1=NC=C(Br)S1 MC441006 [1,0,0,0,0,0|2,0,0]=3 95 B7R1.2 FC1=CN=C(Br)S1 MC105255 [1,0,0,0,0,0|2,0,0]=3 96 B7R1.2 FC1=CSC(Br)=C1 MC430931 [1,0,0,0,0,0|3,0,0]=4 97 B7R1.2 NC1=CC(Cl)=CS1 MC104036 [1,0,0,0,0,0|3,0,0]=4 98 B7R1.2 NC1=CSC(Br)=N1 MC110924 [1,0,0,0,0,0|2,0,0]=3 99 B7R1.2 NC1=CSC(Cl)=C1 MC102443 [1,0,0,0,0,0|3,0,0]=4 100 B7R1.2 NC1=CSC(Cl)=C1 MC104600 [1,0,0,0,0,0|3,0,0]=4 101 B7R1.2 NC1=CSC(N)=N1 CS14359 [1,0,0,0,0,0|2,0,0]=3 102 B7R1.2 NC1=NC(Br)=CS1 CS18333 [1,0,0,0,0,0|2,0,0]=3 103 B7R1.2 NC1=NC(O)=CS1 MC111277 [1,0,0,0,0,0|2,0,0]=3 104 B7R1.2 NC1=NC=C(Cl)S1 CS21276 [1,0,0,0,0,0|2,0,0]=3 105 B7R1.2 NC1=NC=C(Cl)S1 MC442845 [1,0,0,0,0,0|2,0,0]=3 106 B7R1.2 NC1=NC=C(F)S1 CS10393 [1,0,0,0,0,0|2,0,0]=3 107 B7R1.2 NC1=NN=C(Br)S1 CS13944 [1,0,0,0,0,0|3,0,0]=4 108 B7R1.2 NC1=NN=C(Cl)S1 CS12574 [1,0,0,0,0,0|3,0,0]=4 109 B7R1.2 NC1=NN=C(S)S1 MC20709 [1,0,0,0,0,0|3,0,0]=4 110 B7R1.2 SC1=NN=C(S)S1 MC20523 [1,0,0,0,0,0|3,0,0]=4 111 B7R1.4 BrC1=C(Br)SC=C1 CS22551 [1,0,0,0,0,0|3,0,0]=4 112 B7R1.4 BrC1=C(Br)SC=N1 MC442188 [1,0,0,0,0,0|2,0,0]=3 113 B7R1.4 BrC1=C(I)C=CS1 MC113889 [1,0,0,0,0,0|3,0,0]=4 114 B7R1.4 BrC1=C(I)SC=C1 MC431562 [1,0,0,0,0,0|3,0,0]=4 115 B7R1.4 CC1=C(Br)NN=N1 MC114929 [1,0,0,0,0,0|3,0,0]=4 116 B7R1.4 CC1=C(Br)SC=C1 CS13700 [1,0,0,0,0,0|2,0,0]=3 117 B7R1.4 CC1=C(C)NC=N1 MC20435 [1,0,0,0,0,0|1,0,0]=2 118 B7R1.4 CC1=C(C)SC=N1 CS22784 [1,0,0,0,0,0|0,0,0]=1 119 B7R1.4 CC1=CC=NN1C CS19266 [1,0,0,0,0,0|2,0,0]=3 120 B7R1.4 CC1=CNN=C1C CS13346 [1,0,0,0,0,0|2,0,0]=3 121 B7R1.4 CC1=NNC=C1Br CS15947 [1,0,0,0,0,0|3,0,0]=4 122 B7R1.4 CC1=NNC=C1I CS22358 [1,0,0,0,0,0|3,0,0]=4 123 B7R1.4 CC1=NOC=C1N CS17073 [1,0,0,0,0,0|3,0,0]=4 124 B7R1.4 CC1=NSC=C1Br MC100263 [1,0,0,0,0,0|3,0,0]=4 125 B7R1.4 CN1C=CN=C1Br MC428146 [1,0,0,0,0,0|3,0,0]=4 126 B7R1.4 CN1C=CN=C1I CS21609 [1,0,0,0,0,0|3,0,0]=4 127 B7R1.4 CN1N=CC=C1Br CS12124 [1,0,0,0,0,0|3,0,0]=4 128 B7R1.4 CN1N=CC=C1N CS22609 [1,0,0,0,0,0|3,0,0]=4 129 B7R1.4 CN1N=CC=C1O CS10399 [1,0,0,0,0,0|3,0,0]=4 130 B7R1.4 CN1N=CCC1=O CS15601 [1,0,0,0,0,0|3,0,0]=4 131 B7R1.4 CN1N=CN=C1N MC443221 [1,0,0,0,0,0|3,0,0]=4 132 B7R1.4 ClC1=C(Br)C=CS1 CS22555 [1,0,0,0,0,0|3,0,0]=4 133 B7R1.4 ClC1=C(Br)SC=C1 MC442573 [1,0,0,0,0,0|3,0,0]=4 134 B7R1.4 IC1=C(I)NC=N1 MC443844 [1,0,0,0,0,0|3,0,0]=4 135 B9R1.22 CC1=C(C#N)N=C(Cl)S1 CS18228 [0,1,0,0,0,0|1,0,1]=3 136 B9R1.22 CC1=C(CCl)OC(=O)O1 CS17711 [0,1,0,0,0,0|2,1,0]=4 137 B9R1.22 CC1=C(CO)OC(=O)O1 CS15068 [0,1,0,0,0,0|2,1,0]=4 138 B9R1.22 CC1=C(CO)SC(Br)=N1 MC432524 [0,1,0,0,0,0|1,0,0]=2 139 B9R1.22 CC1=CC(C#N)=C(C)N1 MC427285 [0,1,0,0,0,0|1,0,2]=4 140 B9R1.22 CC1=CC(C#N)=C(N)S1 CS19410 [0,1,0,0,0,0|2,0,1]=4 141 B9R1.22 CC1=CC(C)=C(C=O)N1 CS10535 [0,1,0,0,0,0|1,0,2]=4 142 B9R1.22 CC1=NC(C)=C(C=O)N1 MC427470 [0,1,0,0,0,0|1,0,1]=3 143 B9R1.22 CC1=NN(C)C(C=O)=C1 MC21034 [0,1,0,0,0,0|2,0,1]=4 144 B9R1.22 CC1=NN(C)C(CBr)=C1 MC106883 [0,1,0,0,0,0|2,0,0]=3 145 B9R1.22 CC1=NN(C)C(CCl)C1 MC431242 [0,1,0,0,0,0|2,0,1]=4 146 B9R1.22 CC1=NN(C)C(CN)=C1 MC431417 [0,1,0,0,0,0|2,0,0]=3 147 B9R1.22 CC1=NN(C)C=C1C=O CS13371 [0,1,0,0,0,0|2,0,1]=4 148 B9R1.22 CCC1=C(Br)SC(Cl)=N1 MC100474 [0,1,0,0,0,0|2,0,0]=3 149 B9R1.22 CCC1=C(C)N=C(N)S1 CS18463 [0,1,0,0,0,0|1,0,0]=2 150 B9R1.22 ClC1=C(CBr)C=C(Br)S1 MC443705 [0,1,0,0,0,0|3,0,0]=4 151 B9R1.22 N#CC1=C(Cl)N=C(Cl)S1 CS14424 [0,1,0,0,0,0|2,0,1]=4 152 B9R1.22 NC1=NC(Cl)=C(C=O)S1 CS18473 [0,1,0,0,0,0|2,0,1]=4 153 B9R1.22 O=CC1=C(Cl)N=C(Cl)S1 CS16290 [0,1,0,0,0,0|2,0,1]=4 154 B9R1.22 OCC1=C(Cl)N=C(Cl)S1 CS13821 [0,1,0,0,0,0|2,0,0]=3 155 B9R1.23 CC1=C(C)NC(C=O)=N1 MC427115 [0,1,0,0,0,0|1,0,1]=3 156 B9R1.23 CC1=C(C)SC(C#N)=N1 MC115733 [0,1,0,0,0,0|0,0,1]=2 157 B9R1.23 CC1=C(C)SC(NN)=N1 MC431528 [0,1,0,0,0,0|1,0,0]=2 158 B9R1.23 CC1=CC(CO)=NN1C MC429810 [0,1,0,0,0,0|2,0,0]=3 159 B9R1.23 CN1N=C(CO)C=C1Br MC429813 [0,1,0,0,0,0|3,0,0]=4 160 B9R1.37 CC1=C(C)C(I)=C(C)S1 MC425074 [0,1,0,0,0,0|1,0,0]=2 161 B9R1.37 CC1=NN(C)C(C)=C1Br CS22622 [0,1,0,0,0,0|2,0,0]=3 162 B9R1.37 CC1=NN(C)C(C)=C1N CS15695 [0,1,0,0,0,0|2,0,0]=3 163 B9R1.34 CC1=CC(=O)NC(N)=N1 CS14276 [0,0,0,0,0,1|3,0,0]=4 164 B9R1.34 CC1=CC(Br)=CC(Br)=N1 MC441309 [0,0,0,0,0,1|3,0,0]=4 165 B9R1.34 CC1=CC(Br)=CC(C)=N1 CS17464 [0,0,0,0,0,1|2,0,0]=3 166 B9R1.34 CC1=CC(Br)=CC(F)=N1 MC431200 [0,0,0,0,0,1|3,0,0]=4 167 B9R1.34 CC1=CC(Br)=CC(O)=N1 CS15180 [0,0,0,0,0,1|3,0,0]=4 168 B9R1.34 CC1=CC(Br)=NC(Br)=C1 CS12414 [0,0,0,0,0,1|3,0,0]=4 169 B9R1.34 CC1=CC(Br)=NC(C)=C1 CS14545 [0,0,0,0,0,1|2,0,0]=3 170 B9R1.34 CC1=CC(Br)=NC(Cl)=C1 MC433059 [0,0,0,0,0,1|3,0,0]=4 171 B9R1.34 CC1=CC(Br)=NC(F)=C1 MC433041 [0,0,0,0,0,1|3,0,0]=4 172 B9R1.34 CC1=CC(Br)=NC(N)=N1 CS12756 [0,0,0,0,0,1|3,0,0]=4 173 B9R1.34 CC1=CC(C)=CC(Br)=C1 CS19140 [0,0,0,0,0,1|3,0,0]=4 174 B9R1.34 CC1=CC(C)=CC(C)=C1 MC41548 [0,0,0,0,0,1|2,0,0]=3 175 B9R1.34 CC1=CC(C)=CC(I)=C1 CS19879 [0,0,0,0,0,1|3,0,0]=4 176 B9R1.34 CC1=CC(C)=CC(N)=C1 CS19815 [0,0,0,0,0,1|3,0,0]=4 177 B9R1.34 CC1=CC(C)=CC(O)=C1 MC41192 [0,0,0,0,0,1|3,0,0]=4 178 B9R1.34 CC1=CC(C)=CC(S)=C1 MC41408 [0,0,0,0,0,1|3,0,0]=4 179 B9R1.34 CC1=CC(C)=NC(C)=C1 MC41641 [0,0,0,0,0,1|1,0,0]=2 180 B9R1.34 CC1=CC(C)=NC(Cl)=N1 CS19469 [0,0,0,0,0,1|2,0,0]=3 181 B9R1.34 CC1=CC(C)=NC(N)=N1 CS19549 [0,0,0,0,0,1|2,0,0]=3 182 B9R1.34 CC1=CC(C)=NC(O)=N1 CS19523 [0,0,0,0,0,1|2,0,0]=3 183 B9R1.34 CC1=CC(C)=NC(S)=N1 CS19545 [0,0,0,0,0,1|2,0,0]=3 184 B9R1.34 CC1=CC(C)=NC(S)=N1 MC41647 [0,0,0,0,0,1|2,0,0]=3 185 B9R1.34 CC1=CC(Cl)=CC(C)=N1 CS17490 [0,0,0,0,0,1|2,0,0]=3 186 B9R1.34 CC1=CC(Cl)=CC(Cl)=N1 CS21090 [0,0,0,0,0,1|3,0,0]=4 187 B9R1.34 CC1=CC(Cl)=CC(F)=N1 MC429626 [0,0,0,0,0,1|3,0,0]=4 188 B9R1.34 CC1=CC(Cl)=CC(N)=N1 CS21244 [0,0,0,0,0,1|3,0,0]=4 189 B9R1.34 CC1=CC(Cl)=NC(C)=C1 CS18953 [0,0,0,0,0,1|2,0,0]=3 190 B9R1.34 CC1=CC(Cl)=NC(C)=N1 CS19474 [0,0,0,0,0,1|2,0,0]=3 191 B9R1.34 CC1=CC(Cl)=NC(Cl)=C1 CS21169 [0,0,0,0,0,1|3,0,0]=4 192 B9R1.34 CC1=CC(Cl)=NC(Cl)=N1 CS21790 [0,0,0,0,0,1|3,0,0]=4 193 B9R1.34 CC1=CC(Cl)=NC(N)=N1 CS14995 [0,0,0,0,0,1|3,0,0]=4 194 B9R1.34 CC1=CC(F)=CC(F)=N1 MC432636 [0,0,0,0,0,1|3,0,0]=4 195 B9R1.34 CC1=CC(F)=CC(O)=N1 MC431644 [0,0,0,0,0,1|3,0,0]=4 196 B9R1.34 CC1=CC(I)=CC(C)=N1 CS15577 [0,0,0,0,0,1|2,0,0]=3 197 B9R1.34 CC1=CC(I)=CC(N)=N1 MC430536 [0,0,0,0,0,1|3,0,0]=4 198 B9R1.34 CC1=CC(N)=CC(Br)=N1 MC441310 [0,0,0,0,0,1|3,0,0]=4 199 B9R1.34 CC1=CC(N)=CC(C)=N1 CS17195 [0,0,0,0,0,1|2,0,0]=3 200 B9R1.34 CC1=CC(N)=CC(Cl)=N1 MC427512 [0,0,0,0,0,1|3,0,0]=4 201 B9R1.34 CC1=CC(N)=NC(Br)=C1 CS12540 [0,0,0,0,0,1|3,0,0]=4 202 B9R1.34 CC1=CC(N)=NC(C)=C1 CS19570 [0,0,0,0,0,1|2,0,0]=3 203 B9R1.34 CC1=CC(N)=NC(C)=N1 CS14489 [0,0,0,0,0,1|2,0,0]=3 204 B9R1.34 CC1=CC(N)=NC(Cl)=C1 CS21290 [0,0,0,0,0,1|3,0,0]=4 205 B9R1.34 CC1=CC(N)=NC(Cl)=N1 MC444182 [0,0,0,0,0,1|3,0,0]=4 206 B9R1.34 CC1=CC(N)=NC(N)=C1 MC427350 [0,0,0,0,0,1|3,0,0]=4 207 B9R1.34 CC1=CC(N)=NC(N)=N1 CS13657 [0,0,0,0,0,1|3,0,0]=4 208 B9R1.34 CC1=CC(O)=CC(C)=N1 CS21802 [0,0,0,0,0,1|2,0,0]=3 209 B9R1.34 CC1=CC(O)=CC(Cl)=N1 MC441247 [0,0,0,0,0,1|3,0,0]=4 210 B9R1.34 CC1=CC(O)=CC(O)=N1 CS21109 [0,0,0,0,0,1|3,0,0]=4 211 B9R1.34 CC1=CC(O)=NC(C)=C1 CS18772 [0,0,0,0,0,1|2,0,0]=3 212 B9R1.34 CC1=NC(C)=NC(O)=C1 MC428287 [0,0,0,0,0,1|2,0,0]=3 213 B9R1.34 CC1=NC(Cl)=CC(Cl)=N1 MC10399 [0,0,0,0,0,1|3,0,0]=4 214 B9R1.34 CC1=NC(Cl)=CC(N)=N1 CS17451 [0,0,0,0,0,1|3,0,0]=4 215 B9R1.34 CC1=NC(Cl)=CC(O)=N1 MC431944 [0,0,0,0,0,1|3,0,0]=4 216 B9R1.34 CC1=NC(I)=CC(I)=N1 CS19730 [0,0,0,0,0,1|3,0,0]=4 217 B9R1.34 CC1=NC(I)=CC(N)=N1 CS15438 [0,0,0,0,0,1|3,0,0]=4 218 B9R1.34 CC1=NC(N)=CC(N)=N1 MC102817 [0,0,0,0,0,1|3,0,0]=4 219 B9R1.34 CC1=NC(N)=NC(O)=N1 CS16289 [0,0,0,0,0,1|3,0,0]=4 220 B9R1.34 CC1=NC(O)=CC(O)=N1 CS17927 [0,0,0,0,0,1|3,0,0]=4 221 B9R1.34 Cc1cc(C)cc(C)c1 MC444978 [0,0,0,0,0,1|2,0,0]=3 222 B9R1.34 Cc1cc(C)cc(F)c1 CS10870 [0,0,0,0,0,1|3,0,0]=4 223 B9R1.69 CC1=C(Br)C=C(N)C=N1 CS18819 [0,0,0,0,0,1|3,0,0]=4 224 B9R1.69 CC1=C(Br)C=CC(N)=N1 CS23028 [0,0,0,0,0,1|3,0,0]=4 225 B9R1.69 CC1=C(Br)C=CC(O)=N1 CS18359 [0,0,0,0,0,1|3,0,0]=4 226 B9R1.69 CC1=C(Br)C=NC(=O)N1 CS15560 [0,0,0,0,0,1|3,0,0]=4 227 B9R1.69 CC1=C(Br)N=C(N)C=C1 MC428235 [0,0,0,0,0,1|3,0,0]=4 228 B9R1.69 CC1=C(Br)N=C(N)C=N1 MC106830 [0,0,0,0,0,1|3,0,0]=4 229 B9R1.69 CC1=C(Br)N=CC(N)=C1 CS19464 [0,0,0,0,0,1|3,0,0]=4 230 B9R1.69 CC1=C(Br)N=CC(N)=N1 CS14357 [0,0,0,0,0,1|3,0,0]=4 231 B9R1.69 CC1=C(Br)N=CC(O)=C1 MC443767 [0,0,0,0,0,1|3,0,0]=4 232 B9R1.69 CC1=C(C)C=C(Cl)C=C1 MC433525 [0,0,0,0,0,1|3,0,0]=4 233 B9R1.69 CC1=C(C)C=C(N)C=C1 CS20010 [0,0,0,0,0,1|3,0,0]=4 234 B9R1.69 CC1=C(C)C=C(O)C=C1 MC41191 [0,0,0,0,0,1|3,0,0]=4 235 B9R1.69 CC1=C(C)N=C(N)C=N1 MC115982 [0,0,0,0,0,1|2,0,0]=3 236 B9R1.69 CC1=C(C)N=C(O)C=N1 MC443140 [0,0,0,0,0,1|2,0,0]=3 237 B9R1.69 CC1=C(C)NC(=O)C=C1 MC111283 [0,0,0,0,0,1|2,0,1]=4 238 B9R1.69 CC1=C(Cl)C=C(O)C=N1 MC443262 [0,0,0,0,0,1|3,0,0]=4 239 B9R1.69 CC1=C(Cl)C=CC(O)=N1 MC431924 [0,0,0,0,0,1|3,0,0]=4 240 B9R1.69 CC1=C(Cl)N=C(N)C=C1 CS21753 [0,0,0,0,0,1|3,0,0]=4 241 B9R1.69 CC1=C(Cl)N=CC(N)=C1 CS14239 [0,0,0,0,0,1|3,0,0]=4 242 B9R1.69 CC1=C(Cl)N=CC(O)=C1 CS15214 [0,0,0,0,0,1|3,0,0]=4 243 B9R1.69 CC1=C(Cl)N=NC(Cl)=C1 CS18830 [0,0,0,0,0,1|3,0,0]=4 244 B9R1.69 CC1=C(F)C=C(N)C=N1 MC432276 [0,0,0,0,0,1|3,0,0]=4 245 B9R1.69 CC1=C(F)C=CC(N)=N1 MC433033 [0,0,0,0,0,1|3,0,0]=4 246 B9R1.69 CC1=C(F)N=CC(N)=C1 CS13868 [0,0,0,0,0,1|3,0,0]=4 247 B9R1.69 CC1=C(I)C=CC(F)=N1 MC433047 [0,0,0,0,0,1|3,0,0]=4 248 B9R1.69 CC1=C(I)C=CC(N)=N1 MC33318 [0,0,0,0,0,1|3,0,0]=4 249 B9R1.69 CC1=C(N)C=NC(Br)=C1 CS19458 [0,0,0,0,0,1|3,0,0]=4 250 B9R1.69 CC1=C(N)C=NC(Cl)=C1 CS19473 [0,0,0,0,0,1|3,0,0]=4 251 B9R1.69 CC1=C(N)C=NC(F)=C1 MC20830 [0,0,0,0,0,1|3,0,0]=4 252 B9R1.69 CC1=C(N)N=C(O)N=N1 MC116093 [0,0,0,0,0,1|3,0,0]=4 253 B9R1.69 CC1=C(N)N=NC(Cl)=C1 CS17524 [0,0,0,0,0,1|3,0,0]=4 254 B9R1.69 CC1=C(O)N=NC(O)=C1 MC427429 [0,0,0,0,0,1|3,0,0]=4 255 B9R1.69 CC1=CC(=O)N=NC1=O MC427493 [0,0,0,0,0,1|3,0,0]=4 256 B9R1.69 CC1=CC(=O)NN=C1Cl CS15734 [0,0,0,0,0,1|3,0,0]=4 257 B9R1.69 CC1=CC(Br)=C(C)C=C1 CS21410 [0,0,0,0,0,1|3,0,0]=4 258 B9R1.69 CC1=CC(Br)=C(N)N=N1 MC432046 [0,0,0,0,0,1|3,0,0]=4 259 B9R1.69 CC1=CC(Br)=C(O)C=N1 MC432165 [0,0,0,0,0,1|3,0,0]=4 260 B9R1.69 CC1=CC(Br)=CN=C1Br CS18978 [0,0,0,0,0,1|3,0,0]=4 261 B9R1.69 CC1=CC(Br)=CN=C1C MC432124 [0,0,0,0,0,1|2,0,0]=3 262 B9R1.69 CC1=CC(Br)=CN=C1Cl CS18994 [0,0,0,0,0,1|3,0,0]=4 263 B9R1.69 CC1=CC(Br)=CN=C1F CS14095 [0,0,0,0,0,1|3,0,0]=4 264 B9R1.69 CC1=CC(Br)=CN=C1N MC20013 [0,0,0,0,0,1|3,0,0]=4 265 B9R1.69 CC1=CC(Br)=CN=C1O CS18541 [0,0,0,0,0,1|3,0,0]=4 266 B9R1.69 CC1=CC(Br)=NC=C1Br CS14171 [0,0,0,0,0,1|3,0,0]=4 267 B9R1.69 CC1=CC(Br)=NC=C1Cl MC427549 [0,0,0,0,0,1|3,0,0]=4 268 B9R1.69 CC1=CC(Br)=NC=C1F MC430954 [0,0,0,0,0,1|3,0,0]=4 269 B9R1.69 CC1=CC(C)=C(Br)C=C1 MC41530 [0,0,0,0,0,1|3,0,0]=4 270 B9R1.69 CC1=CC(C)=C(C)C=C1 MC41547 [0,0,0,0,0,1|2,0,0]=3 271 B9R1.69 CC1=CC(C)=C(Cl)N=N1 MC444259 [0,0,0,0,0,1|2,0,0]=3 272 B9R1.69 CC1=CC(C)=C(F)C=C1 MC33141 [0,0,0,0,0,1|3,0,0]=4 273 B9R1.69 CC1=CC(C)=C(N)C=C1 CS20011 [0,0,0,0,0,1|3,0,0]=4 274 B9R1.69 CC1=CC(C)=C(O)C=C1 MC30165 [0,0,0,0,0,1|3,0,0]=4 275 B9R1.69 CC1=CC(C)=C(S)C=C1 MC443880 [0,0,0,0,0,1|3,0,0]=4 276 B9R1.69 CC1=CC(C)=NC=C1Br MC427292 [0,0,0,0,0,1|2,0,0]=3 277 B9R1.69 CC1=CC(C)=NNC1=O MC105060 [0,0,0,0,0,1|2,0,0]=3 278 B9R1.69 CC1=CC(Cl)=C(C)C=C1 MC41534 [0,0,0,0,0,1|3,0,0]=4 279 B9R1.69 CC1=CC(Cl)=CN=C1Br CS15514 [0,0,0,0,0,1|3,0,0]=4 280 B9R1.69 CC1=CC(Cl)=CN=C1Cl CS15205 [0,0,0,0,0,1|3,0,0]=4 281 B9R1.69 CC1=CC(Cl)=CN=C1F CS14231 [0,0,0,0,0,1|3,0,0]=4 282 B9R1.69 CC1=CC(Cl)=CN=C1N CS13921 [0,0,0,0,0,1|3,0,0]=4 283 B9R1.69 CC1=CC(Cl)=CN=C1O MC20516 [0,0,0,0,0,1|3,0,0]=4 284 B9R1.69 CC1=CC(Cl)=NC=C1Br CS18475 [0,0,0,0,0,1|3,0,0]=4 285 B9R1.69 CC1=CC(Cl)=NC=C1Cl MC20731 [0,0,0,0,0,1|3,0,0]=4 286 B9R1.69 CC1=CC(Cl)=NC=C1F CS19390 [0,0,0,0,0,1|3,0,0]=4 287 B9R1.69 CC1=CC(F)=C(C)C=C1 CS13237 [0,0,0,0,0,1|3,0,0]=4 288 B9R1.69 CC1=CC(F)=C(C)C=C1 MC433527 [0,0,0,0,0,1|3,0,0]=4 289 B9R1.69 CC1=CC(F)=CN=C1Br CS21373 [0,0,0,0,0,1|3,0,0]=4 290 B9R1.69 CC1=CC(F)=CN=C1Cl CS14240 [0,0,0,0,0,1|3,0,0]=4 291 B9R1.69 CC1=CC(F)=CN=C1N CS17590 [0,0,0,0,0,1|3,0,0]=4 292 B9R1.69 CC1=CC(F)=NC=C1Br CS10262 [0,0,0,0,0,1|3,0,0]=4 293 B9R1.69 CC1=CC(F)=NC=C1Cl MC433043 [0,0,0,0,0,1|3,0,0]=4 294 B9R1.69 CC1=CC(F)=NC=C1I MC433046 [0,0,0,0,0,1|3,0,0]=4 295 B9R1.69 CC1=CC(I)=CN=C1N CS13801 [0,0,0,0,0,1|3,0,0]=4 296 B9R1.69 CC1=CC(N)=C(C)C=C1 MC40905 [0,0,0,0,0,1|3,0,0]=4 297 B9R1.69 CC1=CC(N)=NC=C1Br CS19457 [0,0,0,0,0,1|3,0,0]=4 298 B9R1.69 CC1=CC(N)=NC=C1Cl CS19468 [0,0,0,0,0,1|3,0,0]=4 299 B9R1.69 CC1=CC(N)=NC=C1F MC10782 [0,0,0,0,0,1|3,0,0]=4 300 B9R1.69 CC1=CC(O)=C(C)C=C1 CS19431 [0,0,0,0,0,1|3,0,0]=4 301 B9R1.69 CC1=CC(O)=CN=C1F MC20357 [0,0,0,0,0,1|3,0,0]=4 302 B9R1.69 CC1=CC(O)=NC=C1Br CS13793 [0,0,0,0,0,1|3,0,0]=4 303 B9R1.69 CC1=CC=C(Br)C(Br)=N1 CS14048 [0,0,0,0,0,1|3,0,0]=4 304 B9R1.69 CC1=CC=C(Br)C(C)=N1 CS20363 [0,0,0,0,0,1|2,0,0]=3 305 B9R1.69 CC1=CC=C(Br)C(Cl)=N1 CS13860 [0,0,0,0,0,1|3,0,0]=4 306 B9R1.69 CC1=CC=C(Br)C(F)=N1 MC20350 [0,0,0,0,0,1|3,0,0]=4 307 B9R1.69 CC1=CC=C(Br)C(N)=N1 CS19460 [0,0,0,0,0,1|3,0,0]=4 308 B9R1.69 CC1=CC=C(Br)C(O)=N1 MC443419 [0,0,0,0,0,1|3,0,0]=4 309 B9R1.69 CC1=CC=C(Br)C=C1C MC41529 [0,0,0,0,0,1|3,0,0]=4 310 B9R1.69 CC1=CC=C(Br)N=C1N MC443537 [0,0,0,0,0,1|3,0,0]=4 311 B9R1.69 CC1=CC=C(C)C(Cl)=N1 CS16816 [0,0,0,0,0,1|2,0,0]=3 312 B9R1.69 CC1=CC=C(C)C(N)=N1 CS16045 [0,0,0,0,0,1|2,0,0]=3 313 B9R1.69 CC1=CC=C(Cl)C(Cl)=N1 CS21017 [0,0,0,0,0,1|3,0,0]=4 314 B9R1.69 CC1=CC=C(Cl)N=C1Br CS16574 [0,0,0,0,0,1|3,0,0]=4 315 B9R1.69 CC1=CC=C(Cl)N=C1C MC111284 [0,0,0,0,0,1|2,0,0]=3 316 B9R1.69 CC1=CC=C(Cl)N=C1Cl CS15124 [0,0,0,0,0,1|3,0,0]=4 317 B9R1.69 CC1=CC=C(Cl)N=C1O MC430249 [0,0,0,0,0,1|3,0,0]=4 318 B9R1.69 CC1=CC=C(F)C(Br)=N1 CS14229 [0,0,0,0,0,1|3,0,0]=4 319 B9R1.69 CC1=CC=C(F)C(C)=N1 MC429927 [0,0,0,0,0,1|2,0,0]=3 320 B9R1.69 CC1=CC=C(F)C(Cl)=N1 CS14228 [0,0,0,0,0,1|3,0,0]=4 321 B9R1.69 CC1=CC=C(F)C(F)=N1 MC432593 [0,0,0,0,0,1|3,0,0]=4 322 B9R1.69 CC1=CC=C(F)C(N)=N1 MC432249 [0,0,0,0,0,1|3,0,0]=4 323 B9R1.69 CC1=CC=C(F)C=C1C MC41541 [0,0,0,0,0,1|3,0,0]=4 324 B9R1.69 CC1=CC=C(F)N=C1Br MC430347 [0,0,0,0,0,1|3,0,0]=4 325 B9R1.69 CC1=CC=C(I)C(N)=N1 CS13037 [0,0,0,0,0,1|3,0,0]=4 326 B9R1.69 CC1=CC=C(N)C(Br)=N1 CS19459 [0,0,0,0,0,1|3,0,0]=4 327 B9R1.69 CC1=CC=C(N)C(C)=N1 CS19572 [0,0,0,0,0,1|2,0,0]=3 328 B9R1.69 CC1=CC=C(N)C(Cl)=N1 CS19471 [0,0,0,0,0,1|3,0,0]=4 329 B9R1.69 CC1=CC=C(N)C(N)=N1 MC427322 [0,0,0,0,0,1|3,0,0]=4 330 B9R1.69 CC1=CC=C(N)C(N)=N1 MC427509 [0,0,0,0,0,1|3,0,0]=4 331 B9R1.69 CC1=CC=C(N)C(O)=N1 MC33453 [0,0,0,0,0,1|3,0,0]=4 332 B9R1.69 CC1=CC=C(O)C(Br)=N1 CS21385 [0,0,0,0,0,1|3,0,0]=4 333 B9R1.69 CC1=CC=C(O)C(C)=N1 MC41612 [0,0,0,0,0,1|2,0,0]=3 334 B9R1.69 CC1=CC=C(O)C(Cl)=N1 CS21487 [0,0,0,0,0,1|3,0,0]=4 335 B9R1.69 CC1=CC=C(O)C(F)=N1 MC430626 [0,0,0,0,0,1|3,0,0]=4 336 B9R1.69 CC1=CC=C(O)C(I)=N1 CS21614 [0,0,0,0,0,1|3,0,0]=4 337 B9R1.69 CC1=CC=C(O)C(N)=N1 MC431086 [0,0,0,0,0,1|3,0,0]=4 338 B9R1.69 CC1=CN=C(Br)C(Br)=C1 CS18938 [0,0,0,0,0,1|3,0,0]=4 339 B9R1.69 CC1=CN=C(Br)C(C)=C1 MC20801 [0,0,0,0,0,1|2,0,0]=3 340 B9R1.69 CC1=CN=C(Br)C(F)=C1 MC20932 [0,0,0,0,0,1|3,0,0]=4 341 B9R1.69 CC1=CN=C(Br)C(I)=C1 MC33513 [0,0,0,0,0,1|3,0,0]=4 342 B9R1.69 CC1=CN=C(Br)C(N)=C1 MC20317 [0,0,0,0,0,1|3,0,0]=4 343 B9R1.69 CC1=CN=C(Br)C=C1N CS16645 [0,0,0,0,0,1|3,0,0]=4 344 B9R1.69 CC1=CN=C(C)C(Br)=C1 MC431912 [0,0,0,0,0,1|2,0,0]=3 345 B9R1.69 CC1=CN=C(C)C(C)=C1 CS20999 [0,0,0,0,0,1|1,0,0]=2 346 B9R1.69 CC1=CN=C(C)C(Cl)=N1 MC427591 [0,0,0,0,0,1|2,0,0]=3 347 B9R1.69 CC1=CN=C(C)C(I)=N1 MC427440 [0,0,0,0,0,1|2,0,0]=3 348 B9R1.69 CC1=CN=C(C)C(N)=N1 CS15990 [0,0,0,0,0,1|2,0,0]=3 349 B9R1.69 CC1=CN=C(C)C=C1Br MC107156 [0,0,0,0,0,1|2,0,0]=3 350 B9R1.69 CC1=CN=C(C)C=C1Cl CS15163 [0,0,0,0,0,1|2,0,0]=3 351 B9R1.69 CC1=CN=C(C)C=C1N MC111434 [0,0,0,0,0,1|2,0,0]=3 352 B9R1.69 CC1=CN=C(C)N=C1N CS17171 [0,0,0,0,0,1|2,0,0]=3 353 B9R1.69 CC1=CN=C(Cl)C(Br)=C1 CS13831 [0,0,0,0,0,1|3,0,0]=4 354 B9R1.69 CC1=CN=C(Cl)C(C)=N1 CS21418 [0,0,0,0,0,1|2,0,0]=3 355 B9R1.69 CC1=CN=C(Cl)C(Cl)=N1 CS17128 [0,0,0,0,0,1|3,0,0]=4 356 B9R1.69 CC1=CN=C(Cl)C(F)=C1 CS19037 [0,0,0,0,0,1|3,0,0]=4 357 B9R1.69 CC1=CN=C(Cl)C(I)=C1 CS21432 [0,0,0,0,0,1|3,0,0]=4 358 B9R1.69 CC1=CN=C(Cl)C(N)=C1 CS19472 [0,0,0,0,0,1|3,0,0]=4 359 B9R1.69 CC1=CN=C(Cl)C(N)=N1 MC105904 [0,0,0,0,0,1|3,0,0]=4 360 B9R1.69 CC1=CN=C(Cl)C(O)=C1 MC20346 [0,0,0,0,0,1|3,0,0]=4 361 B9R1.69 CC1=CN=C(Cl)C=C1Br MC115935 [0,0,0,0,0,1|3,0,0]=4 362 B9R1.69 CC1=CN=C(Cl)C=C1Cl MC20301 [0,0,0,0,0,1|3,0,0]=4 363 B9R1.69 CC1=CN=C(Cl)C=C1F MC431381 [0,0,0,0,0,1|3,0,0]=4 364 B9R1.69 CC1=CN=C(Cl)C=C1N CS14350 [0,0,0,0,0,1|3,0,0]=4 365 B9R1.69 CC1=CN=C(Cl)N=C1Cl CS17479 [0,0,0,0,0,1|3,0,0]=4 366 B9R1.69 CC1=CN=C(Cl)N=C1N CS22545 [0,0,0,0,0,1|3,0,0]=4 367 B9R1.69 CC1=CN=C(F)C(Br)=C1 CS13828 [0,0,0,0,0,1|3,0,0]=4 368 B9R1.69 CC1=CN=C(F)C(Cl)=C1 CS15154 [0,0,0,0,0,1|3,0,0]=4 369 B9R1.69 CC1=CN=C(F)C(I)=C1 CS13746 [0,0,0,0,0,1|3,0,0]=4 370 B9R1.69 CC1=CN=C(F)C(N)=C1 MC430819 [0,0,0,0,0,1|3,0,0]=4 371 B9R1.69 CC1=CN=C(F)C=C1Br MC430278 [0,0,0,0,0,1|3,0,0]=4 372 B9R1.69 CC1=CN=C(F)C=C1I CS18758 [0,0,0,0,0,1|3,0,0]=4 373 B9R1.69 CC1=CN=C(I)C(F)=C1 MC431910 [0,0,0,0,0,1|3,0,0]=4 374 B9R1.69 CC1=CN=C(N)C(Br)=C1 CS19456 [0,0,0,0,0,1|3,0,0]=4 375 B9R1.69 CC1=CN=C(N)C(C)=C1 MC427372 [0,0,0,0,0,1|2,0,0]=3 376 B9R1.69 CC1=CN=C(N)C(Cl)=C1 MC103285 [0,0,0,0,0,1|3,0,0]=4 377 B9R1.69 CC1=CN=C(N)C(F)=C1 MC433035 [0,0,0,0,0,1|3,0,0]=4 378 B9R1.69 CC1=CN=C(N)C(I)=C1 MC425469 [0,0,0,0,0,1|3,0,0]=4 379 B9R1.69 CC1=CN=C(N)C(N)=C1 CS12089 [0,0,0,0,0,1|3,0,0]=4 380 B9R1.69 CC1=CN=C(N)C=C1C MC110553 [0,0,0,0,0,1|2,0,0]=3 381 B9R1.69 CC1=CN=C(N)N=C1Cl CS13071 [0,0,0,0,0,1|3,0,0]=4 382 B9R1.69 CC1=CN=C(N)NC1=O MC443213 [0,0,0,0,0,1|3,0,0]=4 383 B9R1.69 CC1=CN=C(O)C(Br)=C1 CS13830 [0,0,0,0,0,1|3,0,0]=4 384 B9R1.69 CC1=CN=C(O)C(C)=N1 CS12599 [0,0,0,0,0,1|2,0,0]=3 385 B9R1.69 CC1=CNC(=O)N=C1N CS18115 [0,0,0,0,0,1|3,0,0]=4 386 B9R1.69 CC1=NC(=O)C(N)=CN1 CS17940 [0,0,0,0,0,1|3,0,0]=4 387 B9R1.69 CC1=NC(Br)=CC=C1Br CS19042 [0,0,0,0,0,1|3,0,0]=4 388 B9R1.69 CC1=NC(Br)=CC=C1F CS18998 [0,0,0,0,0,1|3,0,0]=4 389 B9R1.69 CC1=NC(Br)=CC=C1I MC106491 [0,0,0,0,0,1|3,0,0]=4 390 B9R1.69 CC1=NC(Br)=CC=C1N CS13574 [0,0,0,0,0,1|3,0,0]=4 391 B9R1.69 CC1=NC(Br)=CC=C1O CS15297 [0,0,0,0,0,1|3,0,0]=4 392 B9R1.69 CC1=NC(Br)=CN=C1Cl MC443229 [0,0,0,0,0,1|3,0,0]=4 393 B9R1.69 CC1=NC(Br)=CN=C1N CS12476 [0,0,0,0,0,1|3,0,0]=4 394 B9R1.69 CC1=NC(Br)=NC=C1Br MC441030 [0,0,0,0,0,1|3,0,0]=4 395 B9R1.69 CC1=NC(Br)=NC=C1N MC443750 [0,0,0,0,0,1|3,0,0]=4 396 B9R1.69 CC1=NC(Cl)=CC=C1F CS19395 [0,0,0,0,0,1|3,0,0]=4 397 B9R1.69 CC1=NC(Cl)=CC=C1N CS13794 [0,0,0,0,0,1|3,0,0]=4 398 B9R1.69 CC1=NC(Cl)=CN=C1Br MC432358 [0,0,0,0,0,1|3,0,0]=4 399 B9R1.69 CC1=NC(Cl)=NC=C1Br CS12644 [0,0,0,0,0,1|3,0,0]=4 400 B9R1.69 CC1=NC(Cl)=NC=C1F CS14202 [0,0,0,0,0,1|3,0,0]=4 401 B9R1.69 CC1=NC(F)=CC=C1Br CS19026 [0,0,0,0,0,1|3,0,0]=4 402 B9R1.69 CC1=NC(I)=CC=C1O MC431760 [0,0,0,0,0,1|3,0,0]=4 403 B9R1.69 CC1=NC(N)=CC=C1N MC427482 [0,0,0,0,0,1|3,0,0]=4 404 B9R1.69 CC1=NC(N)=NC=C1Br CS19861 [0,0,0,0,0,1|3,0,0]=4 405 B9R1.69 CC1=NC=C(Br)C(=O)N1 CS17891 [0,0,0,0,0,1|3,0,0]=4 406 B9R1.69 CC1=NC=C(Br)C(Cl)=N1 CS14459 [0,0,0,0,0,1|3,0,0]=4 407 B9R1.69 CC1=NC=C(Br)C(O)=N1 CS10273 [0,0,0,0,0,1|3,0,0]=4 408 B9R1.69 CC1=NC=C(Br)C=C1Br CS13993 [0,0,0,0,0,1|3,0,0]=4 409 B9R1.69 CC1=NC=C(Br)C=C1Cl CS10285 [0,0,0,0,0,1|3,0,0]=4 410 B9R1.69 CC1=NC=C(Br)C=C1F MC430134 [0,0,0,0,0,1|3,0,0]=4 411 B9R1.69 CC1=NC=C(Br)C=C1I MC432529 [0,0,0,0,0,1|3,0,0]=4 412 B9R1.69 CC1=NC=C(Br)C=C1N CS10276 [0,0,0,0,0,1|3,0,0]=4 413 B9R1.69 CC1=NC=C(Br)C=C1O CS15115 [0,0,0,0,0,1|3,0,0]=4 414 B9R1.69 CC1=NC=C(Br)N=C1C MC442142 [0,0,0,0,0,1|2,0,0]=3 415 B9R1.69 CC1=NC=C(Cl)C(N)=C1 MC105902 [0,0,0,0,0,1|3,0,0]=4 416 B9R1.69 CC1=NC=C(Cl)C=C1Br MC33304 [0,0,0,0,0,1|3,0,0]=4 417 B9R1.69 CC1=NC=C(Cl)N=C1C MC442143 [0,0,0,0,0,1|2,0,0]=3 418 B9R1.69 CC1=NC=C(F)C(=O)N1 CS14592 [0,0,0,0,0,1|3,0,0]=4 419 B9R1.69 CC1=NC=C(F)C(Br)=C1 CS16271 [0,0,0,0,0,1|3,0,0]=4 420 B9R1.69 CC1=NC=C(F)C(Cl)=C1 MC431999 [0,0,0,0,0,1|3,0,0]=4 421 B9R1.69 CC1=NC=C(F)C(Cl)=N1 CS12957 [0,0,0,0,0,1|3,0,0]=4 422 B9R1.69 CC1=NC=C(F)C=C1O MC431170 [0,0,0,0,0,1|3,0,0]=4 423 B9R1.69 CC1=NC=C(N)C(=O)N1 CS14824 [0,0,0,0,0,1|3,0,0]=4 424 B9R1.69 CC1=NC=C(N)C(C)=N1 CS14188 [0,0,0,0,0,1|2,0,0]=3 425 B9R1.69 CC1=NC=C(N)C(Cl)=N1 CS13251 [0,0,0,0,0,1|3,0,0]=4 426 B9R1.69 CC1=NC=C(O)C(C)=N1 CS16008 [0,0,0,0,0,1|2,0,0]=3 427 B9R1.69 CC1=NC=C(O)C=C1Br MC20377 [0,0,0,0,0,1|3,0,0]=4 428 B9R1.69 Cc1ccc(Cl)c(C)c1 MC433524 [0,0,0,0,0,1|3,0,0]=4 429 B6R1.2 BrC1=CC=CS1 CS21414 [2,0,0,0,0,0|2,0,0]=4 430 B6R1.2 BrC1=CN=CO1 MC105695 [2,0,0,0,0,0|1,1,0]=4 431 B6R1.2 BrC1=CN=CS1 CS14114 [2,0,0,0,0,0|1,0,0]=3 432 B6R1.2 BrC1=CNC=N1 CS14270 [2,0,0,0,0,0|2,0,0]=4 433 B6R1.2 BrC1=CSC=C1 CS21415 [2,0,0,0,0,0|2,0,0]=4 434 B6R1.2 BrC1=CSC=N1 MC20197 [2,0,0,0,0,0|1,0,0]=3 435 B6R1.2 BrC1=NC=CN1 CS19858 [2,0,0,0,0,0|2,0,0]=4 436 B6R1.2 BrC1=NC=CO1 MC104314 [2,0,0,0,0,0|1,1,0]=4 437 B6R1.2 BrC1=NC=CS1 CS14242 [2,0,0,0,0,0|1,0,0]=3 438 B6R1.2 BrC1=NC=NS1 CS14599 [2,0,0,0,0,0|2,0,0]=4 439 B6R1.2 BrC1=NN=CS1 CS21329 [2,0,0,0,0,0|2,0,0]=4 440 B6R1.2 CC1=CC=CN1 CS21660 [2,0,0,0,0,0|1,0,1]=4 441 B6R1.2 CC1=CC=CO1 MC41695 [2,0,0,0,0,0|1,1,0]=4 442 B6R1.2 CC1=CC=CS1 CS21701 [2,0,0,0,0,0|1,0,0]=3 443 B6R1.2 CC1=CC=NN1 MC21108 [2,0,0,0,0,0|2,0,0]=4 444 B6R1.2 CC1=CN=CS1 CS10460 [2,0,0,0,0,0|0,0,0]=2 445 B6R1.2 CC1=CNC=C1 MC20689 [2,0,0,0,0,0|1,0,1]=4 446 B6R1.2 CC1=CNC=N1 MC20397 [2,0,0,0,0,0|1,0,0]=3 447 B6R1.2 CC1=CNN=C1 CS22982 [2,0,0,0,0,0|2,0,0]=4 448 B6R1.2 CC1=CNN=N1 CS12910 [2,0,0,0,0,0|2,0,0]=4 449 B6R1.2 CC1=COC=N1 MC427478 [2,0,0,0,0,0|0,1,0]=3 450 B6R1.2 CC1=CSC=N1 CS15621 [2,0,0,0,0,0|0,0,0]=2 451 B6R1.2 CC1=NC=CO1 CS11827 [2,0,0,0,0,0|0,1,0]=3 452 B6R1.2 CC1=NC=CS1 CS22598 [2,0,0,0,0,0|0,0,0]=2 453 B6R1.2 CC1=NN=CO1 CS12863 [2,0,0,0,0,0|1,1,0]=4 454 B6R1.2 CC1=NNC=C1 CS13720 [2,0,0,0,0,0|2,0,0]=4 455 B6R1.2 CC1=NNC=N1 CS22353 [2,0,0,0,0,0|2,0,0]=4 456 B6R1.2 CC1=NOC=C1 CS11533 [2,0,0,0,0,0|2,0,0]=4 457 B6R1.2 CN1C=CC=N1 CS19419 [2,0,0,0,0,0|2,0,0]=4 458 B6R1.2 CN1C=CN=C1 CS19753 [2,0,0,0,0,0|2,0,0]=4 459 B6R1.2 CN1C=NC=N1 CS20744 [2,0,0,0,0,0|2,0,0]=4 460 B6R1.2 ClC1=CN=CN1 CS10347 [2,0,0,0,0,0|2,0,0]=4 461 B6R1.2 ClC1=CSC=N1 CS14317 [2,0,0,0,0,0|1,0,0]=3 462 B6R1.2 ClC1=NC=CO1 MC106420 [2,0,0,0,0,0|1,1,0]=4 463 B6R1.2 ClC1=NC=NS1 CS13994 [2,0,0,0,0,0|2,0,0]=4 464 B6R1.2 FC1=CN=CN1 MC429981 [2,0,0,0,0,0|2,0,0]=4 465 B6R1.2 FC1=NC=CN1 MC430938 [2,0,0,0,0,0|2,0,0]=4 466 B6R1.2 FC1=NC=CN1 MC431135 [2,0,0,0,0,0|2,0,0]=4 467 B6R1.2 IC1=CC=CS1 CS21616 [2,0,0,0,0,0|2,0,0]=4 468 B6R1.2 IC1=CN=CS1 MC441132 [2,0,0,0,0,0|1,0,0]=3 469 B6R1.2 IC1=CNC=N1 CS14306 [2,0,0,0,0,0|2,0,0]=4 470 B6R1.2 IC1=CSC=C1 CS22332 [2,0,0,0,0,0|2,0,0]=4 471 B6R1.2 IC1=NC=CN1 CS21881 [2,0,0,0,0,0|2,0,0]=4 472 B6R1.2 IC1=NC=CO1 MC103755 [2,0,0,0,0,0|1,1,0]=4 473 B6R1.2 NC1=CN=NS1 CS13955 [2,0,0,0,0,0|2,0,0]=4 474 B6R1.2 NC1=CNC=N1 CS16117 [2,0,0,0,0,0|2,0,0]=4 475 B6R1.2 NC1=COC=N1 MC121309 [2,0,0,0,0,0|1,1,0]=4 476 B6R1.2 NC1=CSC=C1 CS12280 [2,0,0,0,0,0|2,0,0]=4 477 B6R1.2 NC1=CSC=N1 MC106910 [2,0,0,0,0,0|1,0,0]=3 478 B6R1.2 NC1=CSC=N1 MC121317 [2,0,0,0,0,0|1,0,0]=3 479 B6R1.2 NC1=NC=CN1 CS13716 [2,0,0,0,0,0|2,0,0]=4 480 B6R1.2 NC1=NC=CN1 CS16946 [2,0,0,0,0,0|2,0,0]=4 481 B6R1.2 NC1=NC=CO1 CS19070 [2,0,0,0,0,0|1,1,0]=4 482 B6R1.2 NC1=NC=CS1 CS16381 [2,0,0,0,0,0|1,0,0]=3 483 B6R1.2 NC1=NC=NS1 CS13953 [2,0,0,0,0,0|2,0,0]=4 484 B6R1.2 NC1=NC=NS1 CS15183 [2,0,0,0,0,0|2,0,0]=4 485 B6R1.2 NC1=NN=CS1 CS22505 [2,0,0,0,0,0|2,0,0]=4 486 B6R1.2 OC1=NC=CS1 CS12100 [2,0,0,0,0,0|1,0,0]=3 487 B6R1.2 SC1=NN=CS1 MC20533 [2,0,0,0,0,0|2,0,0]=4 488 B8R1.1 BrCC1=CC(Br)=CS1 MC107253 [1,1,0,0,0,0|2,0,0]=4 489 B8R1.1 CC1=CC(C=O)=CS1 MC443650 [1,1,0,0,0,0|1,0,1]=4 490 B8R1.1 CC1=CC(CO)=NN1 CS17779 [1,1,0,0,0,0|2,0,0]=4 491 B8R1.1 CC1=CC=C(C=O)S1 MC20284 [1,1,0,0,0,0|1,0,1]=4 492 B8R1.1 CC1=CN=C(C=O)S1 MC425517 [1,1,0,0,0,0|0,0,1]=3 493 B8R1.1 CC1=CNC(C#N)=N1 CS17142 [1,1,0,0,0,0|1,0,1]=4 494 B8R1.1 CC1=COC(C=O)=N1 MC104070 [1,1,0,0,0,0|0,1,1]=4 495 B8R1.1 CC1=COC(CN)=C1 MC105034 [1,1,0,0,0,0|1,1,0]=4 496 B8R1.1 CC1=CSC(C#N)=N1 MC425479 [1,1,0,0,0,0|0,0,1]=3 497 B8R1.1 CC1=CSC(C=O)=N1 MC431095 [1,1,0,0,0,0|0,0,1]=3 498 B8R1.1 CC1=NC(C#N)=CS1 MC106832 [1,1,0,0,0,0|0,0,1]=3 499 B8R1.1 CC1=NC(CCl)=CS1 MC442177 [1,1,0,0,0,0|0,0,0]=2 500 B8R1.1 CC1=NC(CN)=CN1 MC107345 [1,1,0,0,0,0|1,0,0]=3 501 B8R1.1 CC1=NC(CO)=CS1 MC430697 [1,1,0,0,0,0|0,0,0]=2 502 B8R1.1 CC1=NC=C(C=O)S1 MC21171 [1,1,0,0,0,0|0,0,1]=3 503 B8R1.1 CC1=NN=C(CO)S1 MC107561 [1,1,0,0,0,0|1,0,0]=3 504 B8R1.1 CN1C=C(CCl)C=N1 MC425489 [1,1,0,0,0,0|2,0,0]=4 505 B8R1.1 CN1C=C(CCl)C=N1 MC425794 [1,1,0,0,0,0|2,0,0]=4 506 B8R1.1 CN1C=C(CO)C=N1 CS19818 [1,1,0,0,0,0|2,0,0]=4 507 B8R1.1 CN1C=NC(CN)=C1 MC103434 [1,1,0,0,0,0|2,0,0]=4 508 B8R1.1 CN1C=NC(CN)=C1 MC444306 [1,1,0,0,0,0|2,0,0]=4 509 B8R1.1 CN1C=NC(CO)=C1 CS18049 [1,1,0,0,0,0|2,0,0]=4 510 B8R1.1 CN1C=NC(CO)=N1 CS14509 [1,1,0,0,0,0|2,0,0]=4 511 B8R1.1 CNC1=NC(N)=CS1 MC102822 [1,1,0,0,0,0|1,0,0]=3 512 B8R1.1 COC1=NN=C(C)S1 MC107310 [1,1,0,0,0,0|1,0,0]=3 513 B8R1.1 ClC1=NC(CBr)=CO1 MC442485 [1,1,0,0,0,0|1,1,0]=4 514 B8R1.1 ClCC1=CC=C(Cl)S1 CS17500 [1,1,0,0,0,0|2,0,0]=4 515 B8R1.1 ClCC1=CN=C(Cl)S1 CS22566 [1,1,0,0,0,0|1,0,0]=3 516 B8R1.1 ClCC1=CSC(Br)=N1 MC442178 [1,1,0,0,0,0|1,0,0]=3 517 B8R1.1 N#CC1=CN=C(Cl)S1 CS18343 [1,1,0,0,0,0|1,0,1]=4 518 B8R1.1 N#CC1=CN=C(N)S1 CS21313 [1,1,0,0,0,0|1,0,1]=4 519 B8R1.1 N#CC1=CSC(Br)=N1 CS12271 [1,1,0,0,0,0|1,0,1]=4 520 B8R1.1 N#CC1=CSC(Cl)=N1 CS16417 [1,1,0,0,0,0|1,0,1]=4 521 B8R1.1 N#CC1=NC(Br)=CS1 MC431677 [1,1,0,0,0,0|1,0,1]=4 522 B8R1.1 N#CC1=NC(Cl)=CS1 MC101999 [1,1,0,0,0,0|1,0,1]=4 523 B8R1.1 N#CC1=NC=C(Br)S1 MC104139 [1,1,0,0,0,0|1,0,1]=4 524 B8R1.1 N#CC1=NC=C(Cl)S1 MC104143 [1,1,0,0,0,0|1,0,1]=4 525 B8R1.1 NC1=NC(CCl)=CS1 CS18388 [1,1,0,0,0,0|1,0,0]=3 526 B8R1.1 NC1=NC(CO)=CS1 CS14646 [1,1,0,0,0,0|1,0,0]=3 527 B8R1.1 NC1=NC=C(C=O)S1 CS21279 [1,1,0,0,0,0|1,0,1]=4 528 B8R1.1 NCC1=CN=C(Cl)S1 CS12616 [1,1,0,0,0,0|1,0,0]=3 529 B8R1.1 NCC1=CN=C(Cl)S1 CS19827 [1,1,0,0,0,0|1,0,0]=3 530 B8R1.1 NCC1=NC=C(Br)S1 MC103526 [1,1,0,0,0,0|1,0,0]=3 531 B8R1.1 NCC1=NC=C(Br)S1 MC104137 [1,1,0,0,0,0|1,0,0]=3 532 B8R1.1 NCC1=NC=C(Cl)S1 MC104486 [1,1,0,0,0,0|1,0,0]=3 533 B8R1.1 NCc1ccc(F)s1 MC102141 [1,1,0,0,0,0|2,0,0]=4 534 B8R1.1 O=CC1=CSC(Br)=N1 CS15326 [1,1,0,0,0,0|1,0,1]=4 535 B8R1.1 O=CC1=NC(Br)=CS1 CS13190 [1,1,0,0,0,0|1,0,1]=4 536 B8R1.1 O=CC1=NC=C(Br)S1 MC431683 [1,1,0,0,0,0|1,0,1]=4 537 B8R1.1 O=CC1=NC=C(Cl)S1 MC425505 [1,1,0,0,0,0|1,0,1]=4 538 B8R1.1 O=CC1=NC=C(I)S1 MC431752 [1,1,0,0,0,0|1,0,1]=4 539 B8R1.1 OCC1=CC(Cl)=CS1 MC102399 [1,1,0,0,0,0|2,0,0]=4 540 B8R1.1 OCC1=CC=C(F)S1 MC113611 [1,1,0,0,0,0|2,0,0]=4 541 B8R1.1 OCC1=CN=C(Br)S1 CS18424 [1,1,0,0,0,0|1,0,0]=3 542 B8R1.1 OCC1=CSC(Br)=N1 CS15600 [1,1,0,0,0,0|1,0,0]=3 543 B8R1.1 OCC1=CSC(Cl)=C1 MC102400 [1,1,0,0,0,0|2,0,0]=4 544 B8R1.1 OCC1=NC(Br)=CS1 MC103530 [1,1,0,0,0,0|1,0,0]=3 545 B8R1.50 CC1=CNC(C)=C1C CS16478 [1,1,0,0,0,0|1,0,1]=4 546 B8R1.50 CC1=CSC(C)=C1Br CS16729 [1,1,0,0,0,0|1,0,0]=3 547 B8R1.50 CC1=NC=C(Br)N1C MC425507 [1,1,0,0,0,0|2,0,0]=4 548 B8R1.50 CC1=NNC(C)=C1Br CS18052 [1,1,0,0,0,0|2,0,0]=4 549 B8R1.50 CC1=NNC(C)=C1I CS18086 [1,1,0,0,0,0|2,0,0]=4 550 B8R1.50 CC1=NOC(C)=C1I CS17867 [1,1,0,0,0,0|2,0,0]=4 551 B8R1.50 CC1=NOC(C)=C1N MC425384 [1,1,0,0,0,0|2,0,0]=4 552 B8R1.11 CC1=C(CO)NC=N1 CS14250 [1,1,0,0,0,0|1,0,0]=3 553 B8R1.11 CN1C=CN=C1CO CS13833 [1,1,0,0,0,0|2,0,0]=4 554 B8R1.11 ClC1=C(CBr)C=CS1 CS14290 [1,1,0,0,0,0|2,0,0]=4 555 B8R1.11 NCC1=C(Br)C=CS1 MC103352 [1,1,0,0,0,0|2,0,0]=4 556 B8R1.11 O=CC1=C(Br)N=CS1 CS15329 [1,1,0,0,0,0|1,0,1]=4 557 B8R1.11 O=CC1=C(Cl)N=CS1 CS22797 [1,1,0,0,0,0|1,0,1]=4 558 B8R1.11 OCC1=C(Br)N=CS1 CS12138 [1,1,0,0,0,0|1,0,0]=3 559 B8R1.11 OCC1=C(Br)SC=C1 MC442201 [1,1,0,0,0,0|2,0,0]=4 560 B8R1.11 OCC1=C(F)C=CS1 MC429391 [1,1,0,0,0,0|2,0,0]=4 561 B10R1.8 CC1=CC(C#N)=CC(C)=N1 CS21183 [0,1,0,0,0,1|1,0,1]=4 562 B10R1.8 CC1=CC(C#N)=NC(C)=C1 MC111080 [0,1,0,0,0,1|1,0,1]=4 563 B10R1.8 CC1=CC(C)=CC(CBr)=C1 CS18923 [0,1,0,0,0,1|2,0,0]=4 564 B10R1.8 CC1=CC(C)=CC(CO)=C1 MC40707 [0,1,0,0,0,1|2,0,0]=4 565 B10R1.8 CC1=CC(C)=NC(C#N)=N1 CS12267 [0,1,0,0,0,1|1,0,1]=4 566 B10R1.8 CC1=CC(C)=NC(CCl)=N1 CS14603 [0,1,0,0,0,1|1,0,0]=3 567 B10R1.8 CC1=CC(C=O)=CC(C)=N1 MC443203 [0,1,0,0,0,1|1,0,1]=4 568 B10R1.8 CC1=CC(CCl)=NC(C)=C1 CS17890 [0,1,0,0,0,1|1,0,0]=3 569 B10R1.8 CC1=CC(CN)=CC(Cl)=N1 MC432601 [0,1,0,0,0,1|2,0,0]=4 570 B10R1.8 CC1=CC(CO)=CC(C)=N1 CS20117 [0,1,0,0,0,1|1,0,0]=3 571 B10R1.8 CC1=CC(Cl)=CC(CO)=N1 MC110838 [0,1,0,0,0,1|2,0,0]=4 572 B10R1.8 CC1=CC(N)=NC(CO)=N1 MC425247 [0,1,0,0,0,1|2,0,0]=4 573 B10R1.8 CC1=CC(O)=NC(CN)=N1 MC106273 [0,1,0,0,0,1|2,0,0]=4 574 B10R1.8 CC1=NC(N)=CC(CO)=N1 MC121184 [0,1,0,0,0,1|2,0,0]=4 575 B10R1.8 CCC1=CC(N)=NC(C)=N1 MC425886 [0,1,0,0,0,1|2,0,0]=4 576 B10R1.8 COC1=CC(C)=CC(C)=C1 MC41339 [0,1,0,0,0,1|2,0,0]=4 577 B10R1.8 COC1=CC(Cl)=NC(C)=N1 CS12795 [0,1,0,0,0,1|2,0,0]=4 578 B10R1.8 COC1=NC(Br)=NC(C)=C1 CS18105 [0,1,0,0,0,1|2,0,0]=4 579 B10R1.8 COC1=NC(Cl)=NC(C)=C1 MC442783 [0,1,0,0,0,1|2,0,0]=4 580 B10R1.8 COC1=NC(N)=NC(C)=C1 CS19550 [0,1,0,0,0,1|2,0,0]=4 581 B10R1.8 COC1=NC(N)=NC(C)=N1 CS21810 [0,1,0,0,0,1|2,0,0]=4 582 B10R1.8 CSC1=CC(C)=NC(Cl)=N1 MC20936 [0,1,0,0,0,1|2,0,0]=4 583 B10R1.8 CSC1=CC(Cl)=NC(C)=N1 MC444335 [0,1,0,0,0,1|2,0,0]=4 584 B10R1.22 CC1=CC(Br)=C(F)C(C)=N1 MC429926 [0,1,0,0,0,1|2,0,0]=4 585 B10R1.22 CC1=CC(C)=C(Br)C(C)=C1 MC433553 [0,1,0,0,0,1|2,0,0]=4 586 B10R1.22 CC1=CC(C)=C(F)C(C)=C1 MC433555 [0,1,0,0,0,1|2,0,0]=4 587 B10R1.22 CC1=CC(C)=C(N)C(C)=C1 MC40943 [0,1,0,0,0,1|2,0,0]=4 588 B10R1.22 CC1=CC(C)=C(O)C(C)=C1 MC433402 [0,1,0,0,0,1|2,0,0]=4 589 B10R1.22 CC1=CC(C)=[N+](F)C(C)=C1 MC429471 [0,1,0,0,0,1|1,0,1]=4 590 B10R1.22 CC1=CC(C)=[N+](F)C(C)=C1 MC429472 [0,1,0,0,0,1|1,0,1]=4 591 B10R1.22 CC1=NC(C)=C(F)C(N)=N1 CS17602 [0,1,0,0,0,1|2,0,0]=4 592 B10R1.22 CC1=NC(Cl)=NC(C)=C1Br CS10256 [0,1,0,0,0,1|2,0,0]=4 593 B10R1.22 CC1=NC(N)=NC(C)=C1Br CS10104 [0,1,0,0,0,1|2,0,0]=4 594 B10R1.25 CC1=C(CN)C=NC(Cl)=C1 MC116266 [0,1,0,0,0,1|2,0,0]=4 595 B10R1.25 CC1=CC(C)=C(CBr)C=C1 CS21116 [0,1,0,0,0,1|2,0,0]=4 596 B10R1.25 CC1=CC(C)=C(CCl)C=C1 MC40593 [0,1,0,0,0,1|2,0,0]=4 597 B10R1.25 CC1=CC(C)=NC=C1C#N CS22515 [0,1,0,0,0,1|1,0,1]=4 598 B10R1.25 CC1=CC(F)=CN=C1CO MC432488 [0,1,0,0,0,1|2,0,0]=4 599 B10R1.25 CC1=CC(F)=NC=C1CCl MC432284 [0,1,0,0,0,1|2,0,0]=4 600 B10R1.25 CC1=CC=C(CO)C(N)=N1 MC432551 [0,1,0,0,0,1|2,0,0]=4 601 B10R1.25 CC1=CN=C(CBr)C(C)=C1 CS18481 [0,1,0,0,0,1|1,0,0]=3 602 B10R1.25 CC1=CN=C(CCl)C(C)=C1 CS16524 [0,1,0,0,0,1|1,0,0]=3 603 B10R1.25 CC1=CN=C(CN)C(C)=C1 MC116261 [0,1,0,0,0,1|1,0,0]=3 604 B10R1.25 CC1=CN=C(CO)C(C)=C1 CS16432 [0,1,0,0,0,1|1,0,0]=3 605 B10R1.25 CC1=NC(=O)C(CO)=CN1 MC115941 [0,1,0,0,0,1|2,0,0]=4 606 B10R1.25 CC1=NC(F)=CC=C1CO MC431864 [0,1,0,0,0,1|2,0,0]=4 607 B10R1.25 CC1=NC=C(CN)C(N)=N1 CS18377 [0,1,0,0,0,1|2,0,0]=4 608 B10R1.25 CC1=NC=C(CO)C(N)=N1 CS22573 [0,1,0,0,0,1|2,0,0]=4 609 B10R1.25 CNC1=NC=C(Br)C=C1C MC443243 [0,1,0,0,0,1|2,0,0]=4 610 B10R1.25 COC1=C(C)C=C(N)C=N1 CS15363 [0,1,0,0,0,1|2,0,0]=4 611 B10R1.25 COC1=CN=C(C)C=C1Br MC431792 [0,1,0,0,0,1|2,0,0]=4 612 B10R1.25 COC1=CN=C(C)C=C1N MC431793 [0,1,0,0,0,1|2,0,0]=4 613 B10R1.25 COC1=CN=C(C)N=C1C CS16889 [0,1,0,0,0,1|1,0,0]=3 614 B10R1.25 COC1=CN=C(N)N=C1C MC432633 [0,1,0,0,0,1|2,0,0]=4 615 B10R1.25 COC1=NC=C(Br)C=C1C CS17558 [0,1,0,0,0,1|2,0,0]=4 616 B10R1.25 COC1=NC=C(C)C=C1Br CS12715 [0,1,0,0,0,1|2,0,0]=4 617 B10R1.25 COC1=NC=C(C)N=C1C CS15176 [0,1,0,0,0,1|1,0,0]=3 618 B10R1.25 COC1=NC=C(F)C=C1C MC431991 [0,1,0,0,0,1|2,0,0]=4 619 B10R1.25 Cc1cc(N)c(CCl)cn1 MC102821 [0,1,0,0,0,1|2,0,0]=4 620 B10R1.30 CC1=CC(CCl)=C(C)C=C1 MC40594 [0,1,0,0,0,1|2,0,0]=4 621 B10R1.30 CC1=CC(CN)=C(C)C=C1 MC20405 [0,1,0,0,0,1|2,0,0]=4 622 B10R1.30 CC1=CC(CN)=C(O)N=N1 MC104733 [0,1,0,0,0,1|2,0,0]=4 623 B10R1.30 CC1=CC=C(F)C(CCl)=N1 MC432129 [0,1,0,0,0,1|2,0,0]=4 624 B10R1.30 CC1=CC=C(N)C(CO)=N1 MC104329 [0,1,0,0,0,1|2,0,0]=4 625 B10R1.30 CC1=CN=C(C)C(C#N)=N1 MC427275 [0,1,0,0,0,1|1,0,1]=4 626 B10R1.30 CC1=CN=C(Cl)C(CO)=C1 MC430303 [0,1,0,0,0,1|2,0,0]=4 627 B10R1.30 CCC1=NC(C)=CC=C1O CS13984 [0,1,0,0,0,1|2,0,0]=4 628 B10R1.30 CCC1=NC(C)=CC=C1O MC41617 [0,1,0,0,0,1|2,0,0]=4 629 B10R1.30 COC1=NC(C)=CC=C1Br CS19284 [0,1,0,0,0,1|2,0,0]=4 630 B10R1.30 COC1=NC(C)=CC=C1F MC103284 [0,1,0,0,0,1|2,0,0]=4 631 B10R1.30 COC1=NC(C)=CC=C1N CS13867 [0,1,0,0,0,1|2,0,0]=4 632 B10R1.30 COC1=NC(Cl)=NC=C1C MC107229 [0,1,0,0,0,1|2,0,0]=4 633 B10R1.118 CC1=C(C)N=C(Cl)C(Cl)=N1 CS15618 [0,1,0,0,0,1|2,0,0]=4 634 B10R1.118 CC1=CC(Br)=C(C)N=C1Br MC115964 [0,1,0,0,0,1|2,0,0]=4 635 B10R1.118 CC1=CC(Br)=C(C)N=C1N MC33278 [0,1,0,0,0,1|2,0,0]=4 636 B10R1.118 CC1=NC(C)=C(Br)C=C1Br CS20270 [0,1,0,0,0,1|2,0,0]=4 637 B10R1.118 CC1=NC(C)=C(C)N=C1C CS18614 [0,1,0,0,0,1|1,0,0]=3 638 B10R1.118 Cc1cc(C)c(F)cc1C MC433554 [0,1,0,0,0,1|2,0,0]=4 639 B10R1.119 CC1=CN=C(C)C(Br)=C1N MC111435 [0,1,0,0,0,1|2,0,0]=4 640 B10R1.176 CC1=C(C)C=C(CBr)C=C1 CS14390 [0,1,0,0,0,1|2,0,0]=4 641 B10R1.176 CC1=C(C)C=C(CN)C=C1 MC40823 [0,1,0,0,0,1|2,0,0]=4 642 B10R1.176 CC1=C(C)C=C(CO)C=C1 MC40706 [0,1,0,0,0,1|2,0,0]=4 643 B10R1.176 CC1=C(Cl)N=CC(CO)=C1 CS16130 [0,1,0,0,0,1|2,0,0]=4 644 B10R1.176 CC1=CN=C(CO)C=C1Br MC106975 [0,1,0,0,0,1|2,0,0]=4 645 B10R1.176 CCC1=CN=C(C)C(C)=N1 CS21048 [0,1,0,0,0,1|1,0,0]=3 646 B10R1.176 COC1=CC(C)=C(N)C=N1 CS19252 [0,1,0,0,0,1|2,0,0]=4 647 B10R1.176 COC1=CC=C(Br)C(C)=N1 CS13578 [0,1,0,0,0,1|2,0,0]=4 648 B10R1.176 COC1=CC=C(Cl)C(C)=N1 MC33479 [0,1,0,0,0,1|2,0,0]=4 649 B10R1.176 COC1=CC=C(N)C(C)=N1 CS19107 [0,1,0,0,0,1|2,0,0]=4 650 B10R1.176 COC1=CC=C(N)C(C)=N1 MC20014 [0,1,0,0,0,1|2,0,0]=4 651 B10R1.176 COC1=CN=C(C)C(Br)=C1 MC104304 [0,1,0,0,0,1|2,0,0]=4 652 B10R1.176 COC1=CN=C(N)C(C)=C1 MC110629 [0,1,0,0,0,1|2,0,0]=4 653 B10R1.176 COC1=NC(C)=C(F)C=C1 MC20372 [0,1,0,0,0,1|2,0,0]=4 654 B10R1.176 COC1=NC=C(Br)C(C)=C1 MC20371 [0,1,0,0,0,1|2,0,0]=4 655 B10R1.176 COC1=NC=C(Br)C(C)=N1 MC441022 [0,1,0,0,0,1|2,0,0]=4 656 B10R1.176 CSC1=NC=C(C)C(=O)N1 MC103161 [0,1,0,0,0,1|2,0,0]=4 657 B10R1.176 CSC1=NC=C(C)C(Cl)=N1 CS16643 [0,1,0,0,0,1|2,0,0]=4 658 B10R1.59 CC(=O)C1=C(C)N=C(Br)S1 MC442176 [0,2,0,0,0,0|1,0,0]=3 659 B10R1.59 CC(=O)C1=C(C)N=C(N)S1 MC442179 [0,2,0,0,0,0|1,0,0]=3 660 B10R1.59 CC(=O)C1=C(C)SC(C)=C1 CS20462 [0,2,0,0,0,0|1,0,0]=3 661 B10R1.59 CC(=O)C1=CC(C)=NN1C CS16943 [0,2,0,0,0,0|2,0,0]=4 662 B10R1.59 CC(C)C1=C(Br)SC(N)=N1 MC113467 [0,2,0,0,0,0|2,0,0]=4 663 B10R1.59 CC1=C(C(=O)O)N=C(Br)S1 CS14381 [0,2,0,0,0,0|1,0,1]=4 664 B10R1.59 CC1=C(C(=O)O)N=C(Cl)S1 MC115914 [0,2,0,0,0,0|1,0,1]=4 665 B10R1.59 CC1=C(C(=O)O)SC(Br)=N1 CS21361 [0,2,0,0,0,0|1,0,1]=4 666 B10R1.59 CC1=C(C(=O)O)SC(N)=N1 CS21256 [0,2,0,0,0,0|1,0,1]=4 667 B10R1.59 CC1=C(C(=O)O)SC(O)=N1 CS12601 [0,2,0,0,0,0|1,0,1]=4 668 B10R1.59 CC1=C(C(C)C)N=C(N)S1 MC425695 [0,2,0,0,0,0|1,0,0]=3 669 B10R1.59 CC1=C(C(N)=O)N=C(Br)S1 MC432526 [0,2,0,0,0,0|1,0,1]=4 670 B10R1.59 CC1=C([N+](=O)[O-])SC(N)=N1 CS21285 [0,2,0,0,0,0|2,0,0]=4 671 B10R1.59 CC1=NC(C)=C(C(=O)O)O1 CS13168 [0,2,0,0,0,0|0,1,1]=4 672 B10R1.59 CC1=NC(C)=C(C(=O)O)S1 CS10099 [0,2,0,0,0,0|0,0,1]=3 673 B10R1.59 FC(F)C1=C(Cl)N=C(Cl)S1 MC115171 [0,2,0,0,0,0|2,0,0]=4 674 B10R1.130 CNCC1=C(C)OC(C)=N1 MC431496 [0,2,0,0,0,0|0,1,0]=3 675 B10R1.256 CC1=NN(C)C(C)=C1CN CS20088 [0,2,0,0,0,0|2,0,0]=4 676 B10R1.58 CC(=O)C1=CC(C)=C(Br)S1 CS16987 [0,2,0,0,0,0|2,0,0]=4 677 B10R1.58 CC1=C(C)SC(C(=O)O)=N1 MC425658 [0,2,0,0,0,0|0,0,1]=3 678 B8R1.4 CC1=CC=CC(C)=N1 CS18597 [0,0,1,1,0,0|1,0,1]=4 679 B8R1.4 CC1=CN=NC(C)=C1 MC41672 [0,0,1,1,0,0|2,0,0]=4 680 B8R1.5 CC1=CC=CN=C1C CS21050 [0,0,1,1,0,0|1,0,1]=4 681 B8R1.5 CC1=NC=CN=C1C CS10108 [0,0,1,1,0,0|1,0,1]=4 682 B10R2.2 NC1=NC2=C(CCC2)S1 MC442185 [0,1,0,1,0,0|1,0,0]=3 683 B8R1.3 CC1=CC=C(Br)N=N1 CS12937 [1,0,0,0,0,1|2,0,0]=4 684 B8R1.3 CC1=CC=C(C)C=C1 MC41551 [1,0,0,0,0,1|2,0,0]=4 685 B8R1.3 CC1=CC=C(Cl)N=N1 CS17682 [1,0,0,0,0,1|2,0,0]=4 686 B8R1.3 CC1=CC=C(I)N=N1 MC444284 [1,0,0,0,0,1|2,0,0]=4 687 B8R1.3 CC1=CC=C(N)C=N1 CS19519 [1,0,0,0,0,1|2,0,0]=4 688 B8R1.3 CC1=CC=C(N)N=N1 MC444230 [1,0,0,0,0,1|2,0,0]=4 689 B8R1.3 CC1=CC=C(O)C=N1 CS19501 [1,0,0,0,0,1|2,0,0]=4 690 B8R1.3 CC1=CC=C(O)N=N1 MC41698 [1,0,0,0,0,1|2,0,0]=4 691 B8R1.3 CC1=CN=C(Br)C=C1 CS21837 [1,0,0,0,0,1|2,0,0]=4 692 B8R1.3 CC1=CN=C(Br)N=C1 CS12207 [1,0,0,0,0,1|2,0,0]=4 693 B8R1.3 CC1=CN=C(C)C=C1 CS21154 [1,0,0,0,0,1|1,0,0]=3 694 B8R1.3 CC1=CN=C(Cl)C=C1 CS19287 [1,0,0,0,0,1|2,0,0]=4 695 B8R1.3 CC1=CN=C(Cl)C=N1 CS21471 [1,0,0,0,0,1|2,0,0]=4 696 B8R1.3 CC1=CN=C(Cl)N=C1 CS19723 [1,0,0,0,0,1|2,0,0]=4 697 B8R1.3 CC1=CN=C(F)C=C1 CS21872 [1,0,0,0,0,1|2,0,0]=4 698 B8R1.3 CC1=CN=C(I)N=C1 MC443807 [1,0,0,0,0,1|2,0,0]=4 699 B8R1.3 CC1=CN=C(N)C=C1 CS21820 [1,0,0,0,0,1|2,0,0]=4 700 B8R1.3 CC1=CN=C(N)C=N1 CS18361 [1,0,0,0,0,1|2,0,0]=4 701 B8R1.3 CC1=CN=C(N)N=C1 CS21761 [1,0,0,0,0,1|2,0,0]=4 702 B8R1.3 CC1=CN=C(O)C=C1 CS16275 [1,0,0,0,0,1|2,0,0]=4 703 B8R1.3 CC1=CN=C(O)C=N1 CS12289 [1,0,0,0,0,1|2,0,0]=4 704 B8R1.3 CC1=NC=C(Br)C=C1 CS22031 [1,0,0,0,0,1|2,0,0]=4 705 B8R1.3 CC1=NC=C(Br)C=N1 CS18474 [1,0,0,0,0,1|2,0,0]=4 706 B8R1.3 CC1=NC=C(Cl)C=N1 CS10333 [1,0,0,0,0,1|2,0,0]=4 707 B8R1.3 CC1=NC=C(F)C=C1 MC433052 [1,0,0,0,0,1|2,0,0]=4 708 B8R1.3 CC1=NC=C(F)C=N1 CS14641 [1,0,0,0,0,1|2,0,0]=4 709 B8R1.3 CC1=NC=C(I)C=C1 MC20376 [1,0,0,0,0,1|2,0,0]=4 710 B8R1.3 CC1=NC=C(N)C=N1 CS14284 [1,0,0,0,0,1|2,0,0]=4 711 B8R1.3 CC1=NC=C(O)C=N1 CS10401 [1,0,0,0,0,1|2,0,0]=4 712 B8R1.3 CC1=NNC(=O)C=C1 CS19836 [1,0,0,0,0,1|2,0,0]=4