0 B9R1.35 CC(=O)C1=CC(C)=CS1 5214 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.35 CC(=O)C1=CC(C)=NO1 24234 [0,0,0,0,0,0|2,0,1]=3 2 B9R1.35 CC(=O)C1=CC(Cl)=CS1 44706 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.35 CC(=O)C1=CC=C(C)O1 6971 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.35 CC(=O)C1=CC=C(C)S1 5212 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.35 CC(=O)C1=CSC(Cl)=C1 24099 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.35 CC1=CC(C(=O)O)=NO1 15552 [0,0,0,0,0,0|1,0,0]=1 7 B9R1.35 CC1=CC([N+](=O)[O-])=NN1 23724 [0,0,0,0,0,0|1,0,1]=2 8 B9R1.35 CC1=CC=C(C(=O)O)S1 5206 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.35 CC1=CN=C(C(=O)O)S1 23003 [0,0,0,0,0,0|2,0,0]=2 10 B9R1.35 CC1=CNC(C(=O)O)=C1 13375 [0,0,0,0,0,0|1,0,1]=2 11 B9R1.35 CC1=CSC(B(O)O)=C1 6437 [0,0,0,0,0,0|3,0,1]=4 12 B9R1.35 CC1=CSC(C(=O)O)=C1 9431 [0,0,0,0,0,0|2,0,0]=2 13 B9R1.35 CC1=NC=C(C(=O)O)S1 22287 [0,0,0,0,0,0|2,0,1]=3 14 B9R1.35 CC1=NN=C(C(=O)[O-])O1 27297 [0,0,0,0,0,0|1,0,2]=3 15 B9R1.35 CC1=NNC(C(=O)O)=C1 7842 [0,0,0,0,0,0|0,0,2]=2 16 B9R1.35 CN1C=C(C(=O)O)C=N1 20860 [0,0,0,0,0,0|2,0,1]=3 17 B9R1.35 CN1C=CC(C(=O)O)=C1 25790 [0,0,0,0,0,0|3,0,0]=3 18 B9R1.35 CN1C=NC(C(=O)O)=C1 9001 [0,0,0,0,0,0|2,0,0]=2 19 B9R1.35 NC1=NC(C(=O)O)=CO1 19787 [0,0,0,0,0,0|4,0,0]=4 20 B9R1.35 NC1=NC(C(=O)O)=CS1 8903 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.35 NC1=NC(C(=O)O)=CS1 9934 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.35 NC1=NC=C(C(=O)O)S1 21384 [0,0,0,0,0,0|3,0,1]=4 23 B9R1.35 O=C(O)C1=CC(Br)=CS1 5189 [0,0,0,0,0,0|3,0,0]=3 24 B9R1.35 O=C(O)C1=CC(Br)=NO1 17690 [0,0,0,0,0,0|2,0,1]=3 25 B9R1.35 O=C(O)C1=CC(O)=NO1 24875 [0,0,0,0,0,0|2,0,1]=3 26 B9R1.35 O=C(O)C1=CC=C(Br)S1 7368 [0,0,0,0,0,0|4,0,0]=4 27 B9R1.35 O=C(O)C1=CC=C(Cl)O1 31597 [0,0,0,0,0,0|4,0,0]=4 28 B9R1.35 O=C(O)C1=CC=C(Cl)S1 7380 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.35 O=C(O)C1=CN=C(Br)S1 15963 [0,0,0,0,0,0|3,0,1]=4 30 B9R1.35 O=C(O)C1=CN=C(Cl)S1 32212 [0,0,0,0,0,0|3,0,1]=4 31 B9R1.35 O=C(O)C1=CSC(Br)=N1 22900 [0,0,0,0,0,0|4,0,0]=4 32 B9R1.35 O=C(O)C1=NNC(Cl)=C1 23727 [0,0,0,0,0,0|1,0,0]=1 33 B8R1.1 CC1=CC(C=O)=CS1 34688 [1,0,0,0,0,0|2,0,0]=3 34 B8R1.1 CC1=CC(C=O)=NO1 11024 [1,0,0,0,0,0|1,0,0]=2 35 B8R1.1 CC1=CC(CCl)=NO1 8710 [1,0,0,0,0,0|2,0,1]=4 36 B8R1.1 CC1=CC(CO)=NO1 8686 [1,0,0,0,0,0|1,0,1]=3 37 B8R1.1 CC1=CC=C(C=O)O1 9971 [1,0,0,0,0,0|3,0,0]=4 38 B8R1.1 CC1=CC=C(C=O)S1 5205 [1,0,0,0,0,0|3,0,0]=4 39 B8R1.1 CC1=CSC(C=O)=N1 15253 [1,0,0,0,0,0|3,0,0]=4 40 B8R1.1 CC1=NC(C=O)=CS1 15112 [1,0,0,0,0,0|3,0,0]=4 41 B8R1.1 CC1=NNC(C=O)=C1 24109 [1,0,0,0,0,0|0,0,2]=3 42 B8R1.1 CN1C=C(C=O)C=N1 34544 [1,0,0,0,0,0|2,0,1]=4 43 B8R1.1 O=CC1=CC(Br)=CO1 3545 [1,0,0,0,0,0|3,0,0]=4 44 B8R1.1 O=CC1=CC(Br)=CS1 5188 [1,0,0,0,0,0|3,0,0]=4 45 B8R1.1 O=CC1=CSC(Br)=C1 20351 [1,0,0,0,0,0|3,0,0]=4 46 B8R1.1 O=CC1=NNC(Br)=C1 23621 [1,0,0,0,0,0|1,0,0]=2 47 B8R1.7 CC(=O)C1=CC=CN1 20915 [1,0,0,0,0,0|2,0,1]=4 48 B8R1.7 CC(=O)C1=CC=CO1 6939 [1,0,0,0,0,0|3,0,0]=4 49 B8R1.7 CC(=O)C1=CC=CS1 5172 [1,0,0,0,0,0|3,0,0]=4 50 B8R1.7 CC(=O)C1=CNC=C1 22508 [1,0,0,0,0,0|2,0,0]=3 51 B8R1.7 CC(=O)C1=CNC=N1 12484 [1,0,0,0,0,0|3,0,0]=4 52 B8R1.7 CC(=O)C1=CNN=C1 30409 [1,0,0,0,0,0|3,0,0]=4 53 B8R1.7 CC(=O)C1=CSC=C1 5220 [1,0,0,0,0,0|3,0,0]=4 54 B8R1.7 CC(=O)C1=NC=CO1 23008 [1,0,0,0,0,0|3,0,0]=4 55 B8R1.7 CC(=O)C1=NC=CS1 9940 [1,0,0,0,0,0|3,0,0]=4 56 B8R1.7 CC(=O)N1C=CC=N1 13397 [1,0,0,0,0,0|3,0,0]=4 57 B8R1.7 CC(C)C1=NNC=C1 11026 [1,0,0,0,0,0|2,0,1]=4 58 B8R1.7 NC(=O)C1=NNC=C1 14330 [1,0,0,0,0,0|1,0,0]=2 59 B8R1.7 NC(=O)C1=NNC=N1 26028 [1,0,0,0,0,0|2,0,0]=3 60 B8R1.7 O=C(Cl)C1=CC=CO1 19997 [1,0,0,0,0,0|3,0,0]=4 61 B8R1.7 O=C(Cl)C1=CC=CS1 5166 [1,0,0,0,0,0|3,0,0]=4 62 B8R1.7 O=C(Cl)C1=CSC=C1 5597 [1,0,0,0,0,0|3,0,0]=4 63 B8R1.7 O=C(O)C1=CC=CN1 15698 [1,0,0,0,0,0|1,0,1]=3 64 B8R1.7 O=C(O)C1=CC=CO1 6946 [1,0,0,0,0,0|2,0,0]=3 65 B8R1.7 O=C(O)C1=CC=CS1 5157 [1,0,0,0,0,0|2,0,0]=3 66 B8R1.7 O=C(O)C1=CC=NN1 12935 [1,0,0,0,0,0|0,0,2]=3 67 B8R1.7 O=C(O)C1=CC=NN1 35926 [1,0,0,0,0,0|0,0,2]=3 68 B8R1.7 O=C(O)C1=CC=NO1 8643 [1,0,0,0,0,0|1,0,1]=3 69 B8R1.7 O=C(O)C1=CC=NS1 30427 [1,0,0,0,0,0|1,0,1]=3 70 B8R1.7 O=C(O)C1=CN=CN1 9003 [1,0,0,0,0,0|2,0,1]=4 71 B8R1.7 O=C(O)C1=CN=CS1 14533 [1,0,0,0,0,0|2,0,1]=4 72 B8R1.7 O=C(O)C1=CNC=C1 8345 [1,0,0,0,0,0|1,0,0]=2 73 B8R1.7 O=C(O)C1=CNN=C1 13293 [1,0,0,0,0,0|2,0,0]=3 74 B8R1.7 O=C(O)C1=CNN=N1 13727 [1,0,0,0,0,0|1,0,1]=3 75 B8R1.7 O=C(O)C1=COC=C1 6945 [1,0,0,0,0,0|2,0,0]=3 76 B8R1.7 O=C(O)C1=COC=N1 11025 [1,0,0,0,0,0|2,0,0]=3 77 B8R1.7 O=C(O)C1=CON=C1 8775 [1,0,0,0,0,0|2,0,1]=4 78 B8R1.7 O=C(O)C1=CSC=C1 7735 [1,0,0,0,0,0|2,0,0]=3 79 B8R1.7 O=C(O)C1=CSC=N1 35764 [1,0,0,0,0,0|2,0,0]=3 80 B8R1.7 O=C(O)C1=NC=CN1 25373 [1,0,0,0,0,0|2,0,0]=3 81 B8R1.7 O=C(O)C1=NC=CS1 16257 [1,0,0,0,0,0|2,0,0]=3 82 B8R1.7 O=C(O)C1=NN=CS1 18394 [1,0,0,0,0,0|1,0,1]=3 83 B8R1.7 O=C(O)C1=NOC=C1 12341 [1,0,0,0,0,0|1,0,0]=2 84 B8R1.7 O=C(O)C1=NSC=C1 22100 [1,0,0,0,0,0|1,0,0]=2 85 B8R1.7 O=C(O)[C-]1C=CC=C1 10724 [1,0,0,0,0,0|2,0,1]=4 86 B8R1.7 O=C(O)[C@@H]1C=CCN1 13924 [1,0,0,0,0,0|1,0,2]=4 87 B8R1.7 O=C([O-])C1=CC=CS1 32366 [1,0,0,0,0,0|2,0,1]=4 88 B8R1.7 O=[N+]([O-])C1=CNC=C1 22365 [1,0,0,0,0,0|2,0,1]=4 89 B8R1.7 O=[N+]([O-])C1=NNN=C1 17191 [1,0,0,0,0,0|2,0,1]=4 90 B8R1.7 OB(O)C1=CNC=C1 23546 [1,0,0,0,0,0|2,0,1]=4 91 B8R1.7 OB(O)C1=NNC=C1 8534 [1,0,0,0,0,0|1,0,1]=3 92 B10R1.14 COC(=O)C1=CC(Br)=CN1 13045 [0,1,0,0,0,0|2,0,1]=4 93 B10R1.14 COC(=O)C1=CC(O)=NO1 25470 [0,1,0,0,0,0|2,0,1]=4 94 B10R1.14 COC(=O)C1=CN(C)C=C1 25789 [0,1,0,0,0,0|3,0,0]=4 95 B10R1.14 COC(=O)C1=CN(C)C=N1 9002 [0,1,0,0,0,0|2,0,0]=3 96 B10R1.14 COC(=O)C1=CN(C)N=C1 23709 [0,1,0,0,0,0|2,0,1]=4 97 B10R1.14 COC(=O)C1=CN(C)N=N1 19252 [0,1,0,0,0,0|1,0,1]=3 98 B10R1.14 COC(=O)C1=COC(C)=N1 11666 [0,1,0,0,0,0|3,0,0]=4 99 B10R1.14 COC(=O)C1=CSC(Br)=C1 27871 [0,1,0,0,0,0|3,0,0]=4 100 B10R1.14 COC(=O)C1=CSC(Br)=C1 32397 [0,1,0,0,0,0|3,0,0]=4 101 B10R1.14 COC(=O)C1=NC(C)=CS1 17196 [0,1,0,0,0,0|3,0,0]=4 102 B10R1.14 COC(=O)C1=NC=C(C)S1 23005 [0,1,0,0,0,0|2,0,0]=3 103 B10R1.14 COC(=O)C1=NN=C(Br)N1 24231 [0,1,0,0,0,0|2,0,1]=4 104 B10R1.14 COC(=O)C1=NSC(N)=C1 23749 [0,1,0,0,0,0|2,0,0]=3 105 B10R1.14 COC(=O)c1cnc(C)o1 23889 [0,1,0,0,0,0|2,0,1]=4 106 B10R1.31 CCC1=CC(C(=O)O)=NO1 22635 [0,1,0,0,0,0|1,0,0]=2 107 B10R1.31 CSC1=CC=C(C(=O)O)S1 36164 [0,1,0,0,0,0|3,0,0]=4 108 B10R1.31 N#CC1=NNC(C(=O)O)=C1 23650 [0,1,0,0,0,0|0,0,3]=4 109 B10R1.55 CC1=CC(C(F)(F)F)=NN1 18777 [0,1,0,0,0,0|2,0,1]=4 110 B10R1.58 CC1=C(C)SC(C(=O)O)=C1 7743 [0,1,0,0,0,0|2,0,0]=3 111 B10R1.58 CN1N=C(C(=O)O)C=C1Br 34338 [0,1,0,0,0,0|1,0,0]=2 112 B10R1.58 O=C(O)C1=CC(Br)=C(Br)O1 29050 [0,1,0,0,0,0|3,0,0]=4 113 B10R1.58 O=C(O)C1=CC(Br)=C(Br)S1 7747 [0,1,0,0,0,0|3,0,0]=4 114 B10R1.59 CC(=O)C1=C(C)OC(C)=C1 6964 [0,1,0,0,0,0|3,0,0]=4 115 B10R1.59 CC1=CC(C(=O)Cl)=C(C)O1 6936 [0,1,0,0,0,0|3,0,0]=4 116 B10R1.59 CC1=CC(C(=O)O)=C(Cl)S1 7740 [0,1,0,0,0,0|2,0,0]=3 117 B10R1.59 CC1=CC(C)=C(C(=O)O)N1 23985 [0,1,0,0,0,0|3,0,0]=4 118 B10R1.59 CC1=NC(C)=C(C(=O)O)O1 17689 [0,1,0,0,0,0|2,0,1]=4 119 B10R1.59 CC1=NC(C)=C(C(=O)O)S1 33408 [0,1,0,0,0,0|2,0,1]=4 120 B10R1.59 CC1=NN(C)C(C(=O)O)=C1 7839 [0,1,0,0,0,0|0,0,2]=3 121 B10R1.59 O=C(O)C1=C(Br)SC(Br)=C1 32435 [0,1,0,0,0,0|3,0,0]=4 122 B10R1.59 O=C(O)C1=C(Cl)SC(Br)=C1 27356 [0,1,0,0,0,0|3,0,0]=4 123 B10R1.194 CC(=O)C1=CNC(Br)=C1C 22819 [0,1,0,0,0,0|3,0,0]=4 124 B10R1.194 CC1=C(C(=O)O)C=NN1C 24796 [0,1,0,0,0,0|2,0,1]=4 125 B10R1.194 CC1=C(C(=O)O)SC=C1Br 5272 [0,1,0,0,0,0|3,0,0]=4 126 B10R1.194 CC1=C(C)C(C(=O)O)=NO1 24640 [0,1,0,0,0,0|1,0,0]=2 127 B10R1.194 CN1N=CC(C(=O)O)=C1Cl 23734 [0,1,0,0,0,0|2,0,1]=4 128 B10R1.13 CC(=O)C1=CC=C(C)C=C1 3326 [0,0,0,0,0,1|3,0,0]=4 129 B10R1.13 CC(=O)C1=CC=C(Cl)N=N1 17693 [0,0,0,0,0,1|2,0,1]=4 130 B10R1.13 CC(=O)C1=CN=C(C)C=C1 14412 [0,0,0,0,0,1|2,0,1]=4 131 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 20326 [0,0,0,0,0,1|3,0,0]=4 132 B10R1.13 CC(=O)C1=NC=C(C)C=C1 16371 [0,0,0,0,0,1|2,0,0]=3 133 B10R1.13 CC(=O)C1=NC=C(N)C=C1 33797 [0,0,0,0,0,1|3,0,0]=4 134 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 15455 [0,0,0,0,0,1|3,0,0]=4 135 B10R1.13 CC1=CC=C(C(=O)O)C=C1 15433 [0,0,0,0,0,1|2,0,0]=3 136 B10R1.13 CC1=CC=C(C(=O)O)N=N1 18650 [0,0,0,0,0,1|0,0,1]=2 137 B10R1.13 CC1=CC=C(C(N)=O)C=C1 27569 [0,0,0,0,0,1|3,0,0]=4 138 B10R1.13 CC1=CC=C(C(O)=S)C=C1 10665 [0,0,0,0,0,1|2,1,0]=4 139 B10R1.13 CC1=CC=C(S(=O)O)C=C1 35986 [0,0,0,0,0,1|3,0,0]=4 140 B10R1.13 CC1=CN=C(B(O)O)C=C1 6938 [0,0,0,0,0,1|2,0,1]=4 141 B10R1.13 CC1=CN=C(C(=O)O)C=C1 22648 [0,0,0,0,0,1|1,0,0]=2 142 B10R1.13 CC1=CN=C(C(=O)O)C=N1 8550 [0,0,0,0,0,1|1,0,0]=2 143 B10R1.13 CC1=CN=C(C(=O)O)N=C1 35346 [0,0,0,0,0,1|1,0,0]=2 144 B10R1.13 CC1=NC=C(C(=O)O)C=C1 1218 [0,0,0,0,0,1|1,0,1]=3 145 B10R1.13 CC1=NC=C(C(=O)O)C=N1 13290 [0,0,0,0,0,1|1,0,1]=3 146 B10R1.13 NC(=O)C1=CC=C(Cl)N=N1 35945 [0,0,0,0,0,1|2,0,1]=4 147 B10R1.13 NC(=O)C1=NC=C(Cl)N=C1 32127 [0,0,0,0,0,1|3,0,0]=4 148 B10R1.13 NC(=O)C1=NC=C(N)C=C1 17853 [0,0,0,0,0,1|3,0,0]=4 149 B10R1.13 NC(=O)C1=NC=C(N)C=N1 25348 [0,0,0,0,0,1|3,0,0]=4 150 B10R1.13 NC(=O)C1=NC=C(N)N=C1 32178 [0,0,0,0,0,1|3,0,0]=4 151 B10R1.13 NC1=CC=C(C(=O)O)C=C1 13422 [0,0,0,0,0,1|3,0,0]=4 152 B10R1.13 NC1=CN=C(C(=O)O)C=C1 15896 [0,0,0,0,0,1|2,0,0]=3 153 B10R1.13 NC1=CN=C(C(=O)O)C=C1 17661 [0,0,0,0,0,1|2,0,0]=3 154 B10R1.13 NC1=CN=C(C(=O)O)C=N1 7866 [0,0,0,0,0,1|2,0,0]=3 155 B10R1.13 NC1=NC=C(C(=O)O)C=C1 2417 [0,0,0,0,0,1|2,0,1]=4 156 B10R1.13 NC1=NC=C(C(=O)O)C=N1 18198 [0,0,0,0,0,1|2,0,1]=4 157 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 3741 [0,0,0,0,0,1|3,0,0]=4 158 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 8985 [0,0,0,0,0,1|3,0,0]=4 159 B10R1.13 O=C(O)C1=CC=C(Cl)N=N1 17692 [0,0,0,0,0,1|1,0,1]=3 160 B10R1.13 O=C(O)C1=CC=C(F)C=C1 8221 [0,0,0,0,0,1|3,0,0]=4 161 B10R1.13 O=C(O)C1=CC=C(I)C=C1 3928 [0,0,0,0,0,1|3,0,0]=4 162 B10R1.13 O=C(O)C1=CC=C(O)C=C1 16819 [0,0,0,0,0,1|3,0,0]=4 163 B10R1.13 O=C(O)C1=CC=C(O)N=N1 16854 [0,0,0,0,0,1|1,0,1]=3 164 B10R1.13 O=C(O)C1=CC=C(S)C=C1 6842 [0,0,0,0,0,1|3,0,0]=4 165 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 1122 [0,0,0,0,0,1|2,0,1]=4 166 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 2600 [0,0,0,0,0,1|2,0,1]=4 167 B10R1.13 O=C(O)C1=CN=C(Cl)N=C1 29068 [0,0,0,0,0,1|2,0,1]=4 168 B10R1.13 O=C(O)C1=CN=C(F)C=C1 1121 [0,0,0,0,0,1|2,0,1]=4 169 B10R1.13 O=C(O)C1=CN=C(O)C=C1 15641 [0,0,0,0,0,1|2,0,1]=4 170 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 9212 [0,0,0,0,0,1|2,0,0]=3 171 B10R1.13 O=C(O)C1=NC=C(Br)C=N1 16922 [0,0,0,0,0,1|2,0,0]=3 172 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 10379 [0,0,0,0,0,1|2,0,0]=3 173 B10R1.13 O=C(O)C1=NC=C(Cl)C=N1 29199 [0,0,0,0,0,1|2,0,0]=3 174 B10R1.13 O=C(O)C1=NC=C(Cl)N=C1 24823 [0,0,0,0,0,1|2,0,0]=3 175 B10R1.13 O=C(O)C1=NC=C(F)C=C1 14387 [0,0,0,0,0,1|2,0,0]=3 176 B10R1.13 O=C(O)C1=NC=C(I)C=C1 27836 [0,0,0,0,0,1|2,0,0]=3 177 B10R1.13 O=C(O)C1=NC=C(O)C=C1 10094 [0,0,0,0,0,1|2,0,0]=3 178 B10R1.13 O=C(O)C1=NC=C(O)N=C1 24014 [0,0,0,0,0,1|2,0,0]=3 179 B10R1.13 O=C1CCC(C(=O)O)=NN1 19274 [0,0,0,0,0,1|1,0,1]=3 180 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 15626 [0,0,0,0,0,1|3,0,0]=4 181 B10R1.113 CC(=O)C1=CC(C)=CC=C1 4279 [0,0,0,0,0,1|3,0,0]=4 182 B10R1.113 CC(=O)C1=CC(C)=CN=C1 26484 [0,0,0,0,0,1|2,0,0]=3 183 B10R1.113 CC(=O)C1=CC(F)=CN=C1 34208 [0,0,0,0,0,1|3,0,0]=4 184 B10R1.113 CC(=O)C1=NC=CC(C)=C1 4045 [0,0,0,0,0,1|2,0,0]=3 185 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 19518 [0,0,0,0,0,1|3,0,0]=4 186 B10R1.113 CC1=CC(C(=O)Cl)=CN=C1 14338 [0,0,0,0,0,1|2,0,0]=3 187 B10R1.113 CC1=CC(C(=O)O)=CC=C1 15435 [0,0,0,0,0,1|2,0,0]=3 188 B10R1.113 CC1=CC(C(=O)O)=CN=C1 11961 [0,0,0,0,0,1|1,0,0]=2 189 B10R1.113 CC1=CC=CC(C(=O)Cl)=C1 15456 [0,0,0,0,0,1|3,0,0]=4 190 B10R1.113 CC1=CC=CC(C(=O)O)=N1 12414 [0,0,0,0,0,1|3,0,0]=4 191 B10R1.113 CC1=CC=CC(C(=O)O)=N1 18834 [0,0,0,0,0,1|3,0,0]=4 192 B10R1.113 CC1=CC=CC(C(O)=S)=C1 28685 [0,0,0,0,0,1|2,1,0]=4 193 B10R1.113 CC1=CN=CC(B(O)O)=C1 17082 [0,0,0,0,0,1|2,0,1]=4 194 B10R1.113 CC1=CN=CC([N+](=O)[O-])=C1 6645 [0,0,0,0,0,1|2,0,1]=4 195 B10R1.113 CC1=NC(C(=O)O)=CN=C1 29069 [0,0,0,0,0,1|2,0,0]=3 196 B10R1.113 CC1=NC=CC(C(=O)O)=C1 13978 [0,0,0,0,0,1|1,0,1]=3 197 B10R1.113 CC1=NC=CC(C(=O)O)=N1 25613 [0,0,0,0,0,1|2,0,1]=4 198 B10R1.113 NC(=O)C1=CN=CC(Br)=C1 1212 [0,0,0,0,0,1|3,0,0]=4 199 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 9223 [0,0,0,0,0,1|3,0,0]=4 200 B10R1.113 NC(=O)C1=NC=CC(F)=C1 14534 [0,0,0,0,0,1|3,0,0]=4 201 B10R1.113 NC1=CC(C(=O)O)=CN=C1 15914 [0,0,0,0,0,1|2,0,0]=3 202 B10R1.113 NC1=CC(C(=O)O)=NC=C1 22241 [0,0,0,0,0,1|2,0,0]=3 203 B10R1.113 NC1=CN=CC(C(=O)O)=N1 32113 [0,0,0,0,0,1|3,0,0]=4 204 B10R1.113 NC1=NC=CC(C(=O)O)=C1 2426 [0,0,0,0,0,1|2,0,1]=4 205 B10R1.113 O=C(O)C1=CC(Br)=CC=C1 3740 [0,0,0,0,0,1|3,0,0]=4 206 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 9211 [0,0,0,0,0,1|2,0,1]=4 207 B10R1.113 O=C(O)C1=CC(Cl)=CC=C1 8991 [0,0,0,0,0,1|3,0,0]=4 208 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 2598 [0,0,0,0,0,1|2,0,1]=4 209 B10R1.113 O=C(O)C1=CC(F)=CC=C1 3480 [0,0,0,0,0,1|3,0,0]=4 210 B10R1.113 O=C(O)C1=CC(F)=NC=C1 3548 [0,0,0,0,0,1|2,0,1]=4 211 B10R1.113 O=C(O)C1=CC(I)=CC=C1 3925 [0,0,0,0,0,1|3,0,0]=4 212 B10R1.113 O=C(O)C1=CC(I)=NC=C1 16692 [0,0,0,0,0,1|2,0,1]=4 213 B10R1.113 O=C(O)C1=CC(O)=CC=C1 9161 [0,0,0,0,0,1|3,0,0]=4 214 B10R1.113 O=C(O)C1=CC(O)=NC=C1 16780 [0,0,0,0,0,1|2,0,1]=4 215 B10R1.113 O=C(O)C1=CC(S)=CC=C1 5566 [0,0,0,0,0,1|3,0,0]=4 216 B10R1.113 O=C(O)C1=CN=CC(Br)=C1 1211 [0,0,0,0,0,1|2,0,0]=3 217 B10R1.113 O=C(O)C1=CN=CC(Cl)=C1 11089 [0,0,0,0,0,1|2,0,0]=3 218 B10R1.113 O=C(O)C1=CN=CC(F)=C1 10942 [0,0,0,0,0,1|2,0,0]=3 219 B10R1.113 O=C(O)C1=CN=CC(O)=C1 2415 [0,0,0,0,0,1|2,0,0]=3 220 B10R1.113 O=C(O)C1=NC(Br)=CN=C1 27951 [0,0,0,0,0,1|3,0,0]=4 221 B10R1.113 O=C(O)C1=NC(Cl)=CN=C1 16687 [0,0,0,0,0,1|3,0,0]=4 222 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 4064 [0,0,0,0,0,1|2,0,0]=3 223 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 12731 [0,0,0,0,0,1|2,0,0]=3 224 B10R1.113 O=C(O)C1=NC=CC(Cl)=N1 22102 [0,0,0,0,0,1|3,0,0]=4 225 B10R1.113 O=C(O)C1=NC=CC(I)=C1 27885 [0,0,0,0,0,1|2,0,0]=3 226 B10R1.113 O=C(O)C1=NC=CC(O)=C1 17131 [0,0,0,0,0,1|2,0,0]=3 227 B10R1.113 O=C(O)C1=NC=NC(Cl)=C1 23631 [0,0,0,0,0,1|1,0,1]=3 228 B10R1.113 O=C(O)C1=NC=NC(O)=C1 12436 [0,0,0,0,0,1|1,0,1]=3 229 B10R1.113 O=C([O-])C1=NC=CC(I)=C1 26798 [0,0,0,0,0,1|2,0,1]=4 230 B10R1.113 O=C1C=C(C(=O)O)C=NN1 22764 [0,0,0,0,0,1|1,0,0]=2 231 B7R0.6 O=C(O)\C=C\C(=O)O 21784 [1,0,1,0,0,0|2,0,0]=4 232 B7R1.1 BrCC1=NNC=C1 14336 [2,0,0,0,0,0|1,0,1]=4 233 B7R1.1 ClCC1=NNC=C1 27656 [2,0,0,0,0,0|1,0,1]=4 234 B7R1.1 N#CC1=NNC=C1 14331 [2,0,0,0,0,0|1,0,1]=4 235 B7R1.1 O=CC1=CC=CN1 28928 [2,0,0,0,0,0|1,0,1]=4 236 B7R1.1 O=CC1=CC=CN1 9140 [2,0,0,0,0,0|1,0,1]=4 237 B7R1.1 O=CC1=CC=CO1 24739 [2,0,0,0,0,0|2,0,0]=4 238 B7R1.1 O=CC1=CC=CS1 5153 [2,0,0,0,0,0|2,0,0]=4 239 B7R1.1 O=CC1=CNC=C1 18051 [2,0,0,0,0,0|1,0,0]=3 240 B7R1.1 O=CC1=CNC=N1 8980 [2,0,0,0,0,0|2,0,0]=4 241 B7R1.1 O=CC1=CNN=C1 23658 [2,0,0,0,0,0|2,0,0]=4 242 B7R1.1 O=CC1=CNN=C1 36037 [2,0,0,0,0,0|2,0,0]=4 243 B7R1.1 O=CC1=CNN=C1 36038 [2,0,0,0,0,0|2,0,0]=4 244 B7R1.1 O=CC1=COC=C1 6948 [2,0,0,0,0,0|2,0,0]=4 245 B7R1.1 O=CC1=CSC=C1 5176 [2,0,0,0,0,0|2,0,0]=4 246 B7R1.1 O=CC1=CSC=N1 13812 [2,0,0,0,0,0|2,0,0]=4 247 B7R1.1 O=CC1=NC=CN1 8045 [2,0,0,0,0,0|2,0,0]=4 248 B7R1.1 O=CC1=NC=CO1 17600 [2,0,0,0,0,0|2,0,0]=4 249 B7R1.1 O=CC1=NC=CS1 9929 [2,0,0,0,0,0|2,0,0]=4 250 B7R1.1 O=CC1=NNC=C1 14337 [2,0,0,0,0,0|0,0,0]=2 251 B7R1.1 O=CC1=NOC=C1 14352 [2,0,0,0,0,0|1,0,0]=3 252 B7R1.1 OCC1=NNC=C1 14333 [2,0,0,0,0,0|0,0,1]=3 253 B7R1.1 OCC1=NOC=C1 24952 [2,0,0,0,0,0|1,0,1]=4 254 B7R1.2 CC1=CC(=O)CC1 25608 [2,0,0,0,0,0|2,0,0]=4 255 B7R1.2 CC1=CC(Br)=NN1 23660 [2,0,0,0,0,0|1,0,0]=3 256 B7R1.2 CC1=CC(Br)=NO1 22265 [2,0,0,0,0,0|2,0,0]=4 257 B7R1.2 CC1=CC(C)=NN1 13256 [2,0,0,0,0,0|0,0,1]=3 258 B7R1.2 CC1=CC(C)=NO1 8641 [2,0,0,0,0,0|1,0,1]=4 259 B7R1.2 CC1=CC(N)=NN1 9406 [2,0,0,0,0,0|1,0,0]=3 260 B7R1.2 CC1=CC(N)=NO1 8646 [2,0,0,0,0,0|2,0,0]=4 261 B7R1.2 CC1=CC(O)=NO1 8647 [2,0,0,0,0,0|1,0,0]=3 262 B7R1.2 CC1=CNC(C)=C1 24003 [2,0,0,0,0,0|1,0,1]=4 263 B7R1.2 CC1=COC(O)=C1 22255 [2,0,0,0,0,0|2,0,0]=4 264 B7R1.2 NC1=NNC(O)=C1 11239 [2,0,0,0,0,0|2,0,0]=4 265 B7R1.2 NC1=NNC(O)=C1 16906 [2,0,0,0,0,0|2,0,0]=4 266 B9R1.22 CC1=NN(C)C(C=O)=C1 27254 [1,1,0,0,0,0|0,0,2]=4 267 B9R1.23 CC1=C(C)SC(C=O)=C1 20559 [1,1,0,0,0,0|2,0,0]=4 268 B9R1.11 COC(=O)C1=CC=CN1 9141 [1,1,0,0,0,0|1,0,1]=4 269 B9R1.11 COC(=O)C1=CC=CO1 7090 [1,1,0,0,0,0|2,0,0]=4 270 B9R1.11 COC(=O)C1=CC=CS1 19955 [1,1,0,0,0,0|2,0,0]=4 271 B9R1.11 COC(=O)C1=CNC=C1 22507 [1,1,0,0,0,0|1,0,0]=3 272 B9R1.11 COC(=O)C1=CNC=N1 16142 [1,1,0,0,0,0|2,0,0]=4 273 B9R1.11 COC(=O)C1=CNN=N1 19241 [1,1,0,0,0,0|1,0,1]=4 274 B9R1.11 COC(=O)C1=CSC=N1 15784 [1,1,0,0,0,0|2,0,0]=4 275 B9R1.11 COC(=O)C1=NC=CN1 23680 [1,1,0,0,0,0|2,0,0]=4 276 B9R1.11 COC(=O)C1=NN=CN1 26175 [1,1,0,0,0,0|1,0,1]=4 277 B9R1.11 COC(=O)C1=NNC=C1 14332 [1,1,0,0,0,0|0,0,0]=2 278 B9R1.41 CC(=O)C1=CNC=C1C 22818 [1,1,0,0,0,0|2,0,0]=4 279 B9R1.41 CC1=C(C(=O)O)N=NN1 33658 [1,1,0,0,0,0|1,0,1]=4 280 B9R1.41 CC1=C(C(=O)O)SC=C1 5182 [1,1,0,0,0,0|2,0,0]=4 281 B9R1.41 CC1=CNN=C1C(=O)O 19201 [1,1,0,0,0,0|0,0,0]=2 282 B9R1.41 CC1=CSC=C1C(=O)O 24253 [1,1,0,0,0,0|2,0,0]=4 283 B9R1.41 CN1C=CC=C1C(=O)O 9181 [1,1,0,0,0,0|1,0,1]=4 284 B9R1.41 CN1C=CN=C1C(=O)O 8048 [1,1,0,0,0,0|2,0,0]=4 285 B9R1.41 CN1N=CC=C1C(=O)O 16306 [1,1,0,0,0,0|0,0,2]=4 286 B9R1.41 NC1=NNC=C1C(=O)O 11081 [1,1,0,0,0,0|2,0,0]=4 287 B9R1.41 NC1=NON=C1C(=O)O 22294 [1,1,0,0,0,0|2,0,0]=4 288 B9R1.41 O=C(O)C1=C(Br)C=CS1 10096 [1,1,0,0,0,0|2,0,0]=4 289 B9R1.41 O=C(O)C1=C(Br)SC=C1 32434 [1,1,0,0,0,0|2,0,0]=4 290 B9R1.41 O=C(O)C1=C(Br)SC=N1 8916 [1,1,0,0,0,0|2,0,0]=4 291 B9R1.41 O=C(O)C1=C(Cl)C=CS1 5491 [1,1,0,0,0,0|2,0,0]=4 292 B9R1.41 O=C(O)C1=C(Cl)SC=C1 32436 [1,1,0,0,0,0|2,0,0]=4 293 B9R1.41 O=C(O)C1=CSC=C1Br 33364 [1,1,0,0,0,0|2,0,0]=4 294 B11R1.3 CCC1=CN=C(C(=O)O)C=C1 27848 [0,1,0,0,0,1|1,0,0]=3 295 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 4517 [0,1,0,0,0,1|2,0,0]=4 296 B11R1.3 COC1=CC=C(C(=O)O)C=C1 23856 [0,1,0,0,0,1|2,0,0]=4 297 B11R1.3 COC1=CN=C(C(=O)O)C=C1 15176 [0,1,0,0,0,1|1,0,0]=3 298 B11R1.3 COC1=CN=C(C(=O)O)C=N1 32117 [0,1,0,0,0,1|1,0,0]=3 299 B11R1.3 COC1=NC=C(C(=O)O)C=C1 15177 [0,1,0,0,0,1|1,0,1]=4 300 B11R1.3 N#CC1=CN=C(C(=O)O)C=C1 16740 [0,1,0,0,0,1|1,0,1]=4 301 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 5815 [0,1,0,0,0,1|2,0,0]=4 302 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 28146 [0,1,0,0,0,1|2,0,0]=4 303 B11R1.3 O=C(O)C1=CC=C(CCl)C=C1 15446 [0,1,0,0,0,1|2,0,0]=4 304 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 12790 [0,1,0,0,0,1|2,0,0]=4 305 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=C1 3806 [0,1,0,0,0,1|2,0,0]=4 306 B11R1.21 CC1=C(C)C=C(C(=O)O)C=C1 14893 [0,1,0,0,0,1|2,0,0]=4 307 B11R1.21 CC1=C(Cl)C=C(C(=O)O)C=C1 4569 [0,1,0,0,0,1|2,0,0]=4 308 B11R1.21 CC1=C(F)C=C(C(=O)O)C=C1 1330 [0,1,0,0,0,1|2,0,0]=4 309 B11R1.21 CC1=C(I)C=C(C(=O)O)C=C1 3947 [0,1,0,0,0,1|2,0,0]=4 310 B11R1.21 CC1=C(N)C=C(C(=O)O)C=C1 8194 [0,1,0,0,0,1|2,0,0]=4 311 B11R1.21 CC1=C(O)C=C(C(=O)O)C=C1 3890 [0,1,0,0,0,1|2,0,0]=4 312 B11R1.21 CC1=CN=C(C(=O)O)C=[N+]1[O-] 8885 [0,1,0,0,0,1|1,0,0]=3 313 B11R1.21 O=C(O)C1=CC=C(Br)C(Br)=N1 29226 [0,1,0,0,0,1|2,0,0]=4 314 B11R1.21 O=C(O)C1=CC=C(Br)C(Cl)=N1 29224 [0,1,0,0,0,1|2,0,0]=4 315 B11R1.21 O=C(O)C1=CC=C(Cl)C(Cl)=N1 29225 [0,1,0,0,0,1|2,0,0]=4 316 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=N1 29097 [0,1,0,0,0,1|2,0,0]=4 317 B11R1.22 COC(=O)C1=CC=C(C)C=C1 15479 [0,1,0,0,0,1|2,0,0]=4 318 B11R1.22 COC(=O)C1=CC=C(C)N=N1 18664 [0,1,0,0,0,1|0,0,1]=3 319 B11R1.22 COC(=O)C1=CC=C(Cl)N=N1 36193 [0,1,0,0,0,1|1,0,1]=4 320 B11R1.22 COC(=O)C1=CN=C(C)C=C1 13718 [0,1,0,0,0,1|1,0,1]=4 321 B11R1.22 COC(=O)C1=CN=C(C)N=C1 21597 [0,1,0,0,0,1|1,0,1]=4 322 B11R1.22 COC(=O)C1=CNC(=O)N=C1 34673 [0,1,0,0,0,1|2,0,0]=4 323 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 10589 [0,1,0,0,0,1|2,0,0]=4 324 B11R1.22 COC(=O)C1=NC=C(Br)C=N1 21032 [0,1,0,0,0,1|2,0,0]=4 325 B11R1.22 COC(=O)C1=NC=C(Cl)N=C1 21394 [0,1,0,0,0,1|2,0,0]=4 326 B11R1.22 COC(=O)C1=NC=C(N)N=C1 32171 [0,1,0,0,0,1|2,0,0]=4 327 B11R1.22 COC(=O)C1=NC=C(O)N=C1 9107 [0,1,0,0,0,1|2,0,0]=4 328 B11R1.22 COC(=O)C1=NNC(=O)C=C1 19275 [0,1,0,0,0,1|1,0,0]=3 329 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 4719 [0,1,0,0,0,1|2,0,0]=4 330 B11R1.166 CC1=CC(C)=C(C(=O)O)C=C1 15441 [0,1,0,0,0,1|2,0,0]=4 331 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=C1 4567 [0,1,0,0,0,1|2,0,0]=4 332 B11R1.166 CC1=CC(F)=C(C(=O)O)C=C1 1395 [0,1,0,0,0,1|2,0,0]=4 333 B11R1.166 CC1=CC(I)=C(C(=O)O)C=C1 30572 [0,1,0,0,0,1|2,0,0]=4 334 B11R1.166 CC1=CC(N)=C(C(=O)O)C=C1 4952 [0,1,0,0,0,1|2,0,0]=4 335 B11R1.166 CC1=CC=C(C(=O)O)C(O)=C1 18270 [0,1,0,0,0,1|2,0,0]=4 336 B11R1.166 CC1=CC=C(C(=O)O)C(O)=N1 26524 [0,1,0,0,0,1|1,0,1]=4 337 B11R1.166 CC1=NC(Cl)=C(C(=O)O)C=C1 11019 [0,1,0,0,0,1|1,0,1]=4 338 B11R1.166 CC1=NC=C(C(=O)O)C(Cl)=N1 34358 [0,1,0,0,0,1|1,0,1]=4 339 B11R1.166 NC1=NC=C(C(=O)O)C(=O)N1 33343 [0,1,0,0,0,1|2,0,0]=4 340 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Br 17568 [0,1,0,0,0,1|2,0,0]=4 341 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Cl 17527 [0,1,0,0,0,1|2,0,0]=4 342 B11R1.166 O=C(O)C1=NC=C(Br)C=C1O 23193 [0,1,0,0,0,1|2,0,0]=4 343 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Cl 4005 [0,1,0,0,0,1|2,0,0]=4 344 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1F 17534 [0,1,0,0,0,1|2,0,0]=4 345 B11R1.166 O=C(O)C1=NC=C(Cl)N=C1Cl 27639 [0,1,0,0,0,1|2,0,0]=4 346 B11R1.166 O=C1NC=C(C(=O)O)C(=O)N1 23556 [0,1,0,0,0,1|2,0,0]=4 347 B11R1.23 COC(=O)C1=CC(=O)NC=C1 23888 [0,1,0,0,0,1|2,0,0]=4 348 B11R1.23 COC(=O)C1=CC(=O)NC=N1 23276 [0,1,0,0,0,1|1,0,0]=3 349 B11R1.23 COC(=O)C1=CC=CC(C)=C1 15491 [0,1,0,0,0,1|2,0,0]=4 350 B11R1.23 COC(=O)C1=CN=CC(Br)=C1 22051 [0,1,0,0,0,1|2,0,0]=4 351 B11R1.23 COC(=O)C1=CN=CC(C)=C1 27511 [0,1,0,0,0,1|1,0,0]=3 352 B11R1.23 COC(=O)C1=NC(C)=CN=C1 32142 [0,1,0,0,0,1|2,0,0]=4 353 B11R1.23 COC(=O)C1=NC=CC(Br)=C1 12733 [0,1,0,0,0,1|2,0,0]=4 354 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 9224 [0,1,0,0,0,1|2,0,0]=4 355 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 9577 [0,1,0,0,0,1|2,0,0]=4 356 B11R1.23 COC(=O)C1=NC=CC(I)=C1 25750 [0,1,0,0,0,1|2,0,0]=4 357 B11R1.23 COC(=O)C1=NC=CC(N)=C1 26057 [0,1,0,0,0,1|2,0,0]=4 358 B11R1.23 COC(=O)C1=NC=NC(Cl)=C1 23630 [0,1,0,0,0,1|1,0,1]=4 359 B11R1.74 CC1=CC(C(=O)O)=CC(Br)=C1 30472 [0,1,0,0,0,1|2,0,0]=4 360 B11R1.74 CC1=CC(C(=O)O)=CC(C)=N1 14397 [0,1,0,0,0,1|1,0,1]=4 361 B11R1.74 CC1=CC(C(=O)O)=CC(Cl)=N1 17665 [0,1,0,0,0,1|1,0,1]=4 362 B11R1.74 CC1=CC(C(=O)O)=CC(F)=C1 1396 [0,1,0,0,0,1|2,0,0]=4 363 B11R1.74 CC1=CC(C(=O)O)=CC(O)=C1 18175 [0,1,0,0,0,1|2,0,0]=4 364 B11R1.74 CC1=CC(C)=CC(C(=O)O)=C1 15440 [0,1,0,0,0,1|2,0,0]=4 365 B11R1.74 CC1=CC(N)=CC(C(=O)O)=C1 4979 [0,1,0,0,0,1|2,0,0]=4 366 B11R1.74 O=C(O)C1=NC(Br)=CC(Br)=C1 33329 [0,1,0,0,0,1|2,0,0]=4 367 B11R1.74 O=C(O)C1=NC(Br)=CC(Cl)=C1 33330 [0,1,0,0,0,1|2,0,0]=4 368 B11R1.74 O=C(O)C1=NC(Cl)=CC(Br)=C1 33328 [0,1,0,0,0,1|2,0,0]=4 369 B11R1.74 O=C(O)C1=NC(Cl)=NC(Cl)=C1 36034 [0,1,0,0,0,1|1,0,1]=4 370 B11R1.74 O=C1C=C(C(=O)O)NC(=O)N1 22281 [0,1,0,0,0,1|1,0,1]=4 371 B11R1.155 CC1=CN=CC(S(=O)(=O)O)=C1 16071 [0,1,0,0,0,1|2,0,0]=4 372 B11R1.159 CC1=C(Cl)C=CN=C1C(=O)O 33666 [0,1,0,0,0,1|2,0,0]=4 373 B11R1.159 CC1=CC=CC(C(=O)O)=C1Br 3805 [0,1,0,0,0,1|2,0,0]=4 374 B11R1.159 CC1=CC=CC(C(=O)O)=C1C 2549 [0,1,0,0,0,1|2,0,0]=4 375 B11R1.159 CC1=CC=CC(C(=O)O)=C1Cl 4566 [0,1,0,0,0,1|2,0,0]=4 376 B11R1.159 CC1=CC=CC(C(=O)O)=C1F 1328 [0,1,0,0,0,1|2,0,0]=4 377 B11R1.159 CC1=CC=CC(C(=O)O)=C1I 12741 [0,1,0,0,0,1|2,0,0]=4 378 B11R1.159 CC1=CC=CC(C(=O)O)=C1N 4950 [0,1,0,0,0,1|2,0,0]=4 379 B11R1.159 NC1=C(Br)C=NC=C1C(=O)O 6655 [0,1,0,0,0,1|2,0,0]=4 380 B11R1.159 NC1=C(Cl)C=NC=C1C(=O)O 6656 [0,1,0,0,0,1|2,0,0]=4 381 B11R1.159 O=C(O)C1=NC=CC(Cl)=C1Cl 27725 [0,1,0,0,0,1|2,0,0]=4 382 B11R1.167 CC(=O)C1=CC(C)=CN=C1Cl 27246 [0,1,0,0,0,1|2,0,0]=4 383 B11R1.167 CC1=CC(C(=O)O)=C(Br)C=C1 2166 [0,1,0,0,0,1|2,0,0]=4 384 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 28638 [0,1,0,0,0,1|2,0,0]=4 385 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=C1 12501 [0,1,0,0,0,1|2,0,0]=4 386 B11R1.167 CC1=CC(C(=O)O)=C(Cl)N=C1 33728 [0,1,0,0,0,1|1,0,0]=3 387 B11R1.167 CC1=CC(C(=O)O)=C(F)C=C1 4750 [0,1,0,0,0,1|2,0,0]=4 388 B11R1.167 CC1=CC(C(=O)O)=C(I)C=C1 4975 [0,1,0,0,0,1|2,0,0]=4 389 B11R1.167 CC1=CC(C(=O)O)=C(N)C=C1 4954 [0,1,0,0,0,1|2,0,0]=4 390 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=N1 5708 [0,1,0,0,0,1|2,0,0]=4 391 B11R1.167 NC1=C(C(=O)O)C=C(Cl)C=N1 5716 [0,1,0,0,0,1|2,0,0]=4 392 B11R1.167 NC1=CC(C(=O)O)=C(Cl)N=C1 34240 [0,1,0,0,0,1|2,0,0]=4 393 B11R1.167 O=C(O)C1=C(Br)N=CC(Br)=C1 20950 [0,1,0,0,0,1|2,0,0]=4 394 B11R1.167 O=C(O)C1=C(Br)N=CC(F)=C1 19483 [0,1,0,0,0,1|2,0,0]=4 395 B11R1.167 O=C(O)C1=C(Cl)N=CC(Br)=C1 12967 [0,1,0,0,0,1|2,0,0]=4 396 B11R1.167 O=C(O)C1=C(Cl)N=CC(Cl)=C1 2601 [0,1,0,0,0,1|2,0,0]=4 397 B11R1.167 O=C(O)C1=C(Cl)N=CC(F)=C1 9827 [0,1,0,0,0,1|2,0,0]=4 398 B11R1.167 O=C(O)C1=C(Cl)N=CC(O)=C1 32399 [0,1,0,0,0,1|2,0,0]=4 399 B11R1.167 O=C(O)C1=C(Cl)N=NC(Cl)=C1 9529 [0,1,0,0,0,1|1,0,1]=4 400 B11R1.167 O=C(O)C1=C(F)N=CC(Br)=C1 17103 [0,1,0,0,0,1|2,0,0]=4 401 B11R1.167 O=C(O)C1=C(F)N=CC(Cl)=C1 14328 [0,1,0,0,0,1|2,0,0]=4 402 B11R1.167 O=C(O)C1=C(F)N=CC(F)=C1 22311 [0,1,0,0,0,1|2,0,0]=4 403 B11R1.167 O=C(O)C1=C(O)N=CC(Br)=C1 2602 [0,1,0,0,0,1|2,0,0]=4 404 B11R1.167 O=C(O)C1=C(O)N=CC(Cl)=C1 12990 [0,1,0,0,0,1|2,0,0]=4 405 B11R1.167 O=C(O)C1=C(O)N=CC(F)=C1 10622 [0,1,0,0,0,1|2,0,0]=4 406 B11R1.167 O=C1C=C(C(=O)O)C(O)=CN1 23617 [0,1,0,0,0,1|2,0,0]=4 407 B11R1.266 COC1=CC(C(=O)O)=CN=C1 27158 [0,1,0,0,0,1|1,0,0]=3 408 B11R1.266 COC1=CC(C(=O)O)=NC=C1 16686 [0,1,0,0,0,1|1,0,0]=3 409 B11R1.266 COC1=CC(C(=O)O)=NC=N1 27976 [0,1,0,0,0,1|0,0,1]=3 410 B11R1.266 COC1=CC(C(C)=O)=NC=C1 33636 [0,1,0,0,0,1|2,0,0]=4 411 B11R1.266 COC1=CC(C(N)=O)=NC=C1 9294 [0,1,0,0,0,1|2,0,0]=4 412 B11R1.266 COC1=CC=CC(C(=O)O)=C1 9012 [0,1,0,0,0,1|2,0,0]=4 413 B11R1.266 COC1=CN=CC(C(=O)O)=N1 27952 [0,1,0,0,0,1|2,0,0]=4 414 B11R1.266 COC1=NC=CC(C(=O)O)=C1 9293 [0,1,0,0,0,1|1,0,1]=4 415 B11R1.266 CSC1=CC=CC(C(=O)O)=C1 10679 [0,1,0,0,0,1|2,0,0]=4 416 B11R1.266 CSC1=CC=CC(C(=O)O)=C1 20970 [0,1,0,0,0,1|2,0,0]=4 417 B11R1.266 N#CC1=CC(C(=O)O)=NC=C1 32221 [0,1,0,0,0,1|1,0,1]=4 418 B11R1.266 NCC1=CC=CC(C(=O)O)=C1 14415 [0,1,0,0,0,1|2,0,0]=4 419 B11R1.266 O=C(O)C1=CC(CBr)=CC=C1 9744 [0,1,0,0,0,1|2,0,0]=4 420 B11R1.266 O=C(O)C1=CC(CCl)=CC=C1 7446 [0,1,0,0,0,1|2,0,0]=4 421 B11R1.15 CCOC(=O)C1=CC(C)=CN1 22960 [0,2,0,0,0,0|1,0,1]=4 422 B11R1.15 CCOC(=O)C1=CC(C)=NN1 7843 [0,2,0,0,0,0|0,0,2]=4 423 B11R1.15 CCOC(=O)C1=NNC(N)=C1 24642 [0,2,0,0,0,0|1,0,0]=3 424 B11R1.15 CCOC(=O)C1=NNC(O)=C1 20550 [0,2,0,0,0,0|1,0,0]=3 425 B11R1.15 CCOC(=O)C1=NOC(C)=C1 8773 [0,2,0,0,0,0|1,0,0]=3 426 B11R1.225 COC(=O)C1=C(C)NC(C)=C1 27986 [0,2,0,0,0,0|1,0,0]=3 427 B11R1.225 COC(=O)C1=CC(C)=NN1N 14869 [0,2,0,0,0,0|0,0,2]=4 428 B11R1.226 COC(=O)C1=NN(C)C(Br)=C1 34339 [0,2,0,0,0,0|1,0,0]=3 429 B11R1.226 COC(=O)C1=NN(C)C(O)=C1 13503 [0,2,0,0,0,0|1,0,0]=3 430 B11R1.865 COC(=O)C1=C(N)C(C)=CS1 5555 [0,2,0,0,0,0|2,0,0]=4 431 B11R1.50 CCC1=NC(C(=O)O)=C(C)N1 16038 [0,2,0,0,0,0|2,0,0]=4 432 B11R1.50 CCC1=NC(C(=O)O)=C(C)N1 17030 [0,2,0,0,0,0|2,0,0]=4 433 B11R1.175 CC(C)C1=CC(C(=O)O)=NO1 36281 [0,2,0,0,0,0|1,0,0]=3 434 B11R1.175 NC(=O)C1=NNC([N+](=O)[O-])=C1 44905 [0,2,0,0,0,0|2,0,0]=4 435 B11R1.175 O=C(O)C1=CC(C(=O)O)=NN1 25364 [0,2,0,0,0,0|0,0,1]=3 436 B11R1.175 O=C(O)C1=NSC([N+](=O)[O-])=C1 19290 [0,2,0,0,0,0|2,0,0]=4 437 B11R1.49 CCN1N=C(C)C=C1C(=O)O 35143 [0,2,0,0,0,0|0,0,2]=4 438 B9R1.6 O=C(O)C1=CC=CN=N1 22109 [0,0,1,1,0,0|0,0,2]=4 439 B9R1.6 O=C(O)C1=NC=CC=C1 9774 [0,0,1,1,0,0|1,0,1]=4 440 B9R1.6 O=C(O)C1=NC=CN=C1 8602 [0,0,1,1,0,0|2,0,0]=4 441 B9R1.2 CC1=CC(C=O)=CC=C1 15513 [1,0,0,0,0,1|2,0,0]=4 442 B9R1.2 CC1=CC(C=O)=NC=C1 17166 [1,0,0,0,0,1|1,0,0]=3 443 B9R1.2 CC1=CN=CC(CO)=C1 22640 [1,0,0,0,0,1|1,0,1]=4 444 B9R1.2 O=CC1=CC(Br)=CN=C1 7706 [1,0,0,0,0,1|2,0,0]=4 445 B9R1.2 O=CC1=CC(O)=CN=C1 23673 [1,0,0,0,0,1|2,0,0]=4 446 B9R1.2 O=CC1=CN=CC(Br)=C1 16604 [1,0,0,0,0,1|2,0,0]=4 447 B9R1.2 O=CC1=CN=CC(Cl)=C1 16702 [1,0,0,0,0,1|2,0,0]=4 448 B9R1.2 O=CC1=CN=CC(F)=C1 5151 [1,0,0,0,0,1|2,0,0]=4 449 B9R1.2 O=CC1=CN=CC(I)=C1 16653 [1,0,0,0,0,1|2,0,0]=4 450 B9R1.2 O=CC1=NC=CC(Cl)=C1 24779 [1,0,0,0,0,1|2,0,0]=4 451 B9R1.13 O=C(O)CC1=CC=CO1 17310 [1,0,0,0,0,1|2,0,0]=4 452 B9R1.13 O=C(O)CC1=CC=CS1 5168 [1,0,0,0,0,1|2,0,0]=4 453 B9R1.13 O=C(O)CC1=CSC=C1 5586 [1,0,0,0,0,1|2,0,0]=4 454 B9R1.13 O=C(O)CC1=NC=CN1 18001 [1,0,0,0,0,1|2,0,0]=4 455 B11R1.20 NC1=CN=C(CC(=O)O)C=C1 32286 [0,0,0,0,0,2|2,0,0]=4 456 B11R1.157 CC(=O)NC1=NC=CC(C)=C1 16556 [0,0,0,0,0,2|2,0,0]=4 457 B11R1.157 CC1=CC=CC(CC(=O)O)=C1 28872 [0,0,0,0,0,2|2,0,0]=4