0 B9R1.6 C1=CN=CC(=C1)B(O)O LN00004871 [0,0,0,0,0,0|2,0,1]=3 1 B9R1.6 CC(=C)C1=CC=CC=C1 AC190225 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.6 CC(=O)C1=CC=CN=C1 AC510735 [0,0,0,0,0,0|2,0,0]=2 3 B9R1.6 CC(=O)C1=CN=CC=N1 AC510694 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.6 CC(=O)C1=CN=CN=C1 AC050215 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.6 CC(=O)C1=NC=CC=C1 AC131564 [0,0,0,0,0,0|2,0,0]=2 6 B9R1.6 CC(=O)C1=NC=CC=N1 AC182273 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.6 CC(=O)C1=NC=NC=C1 LN00221164 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.6 CC(N)C1=CC=CN=C1 AC170099 [0,0,0,0,0,0|3,0,1]=4 9 B9R1.6 CC(N)C1=CC=NC=C1 AC170001 [0,0,0,0,0,0|3,0,1]=4 10 B9R1.6 CC(N)C1=NC=CC=C1 AC021461 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.6 CC(O)C1=NC=CC=C1 AC181953 [0,0,0,0,0,0|2,0,1]=3 12 B9R1.6 CN(C)C1=CC=NC=C1 AC131272 [0,0,0,0,0,0|4,0,0]=4 13 B9R1.6 C[C@@H](N)C1=NC=CC=C1 AC021462 [0,0,0,0,0,0|3,0,1]=4 14 B9R1.6 C[C@@H](O)C1=CC=CC=C1 AC021442 [0,0,0,0,0,0|1,0,1]=2 15 B9R1.6 C[C@H](N)C1=NC=CC=C1 AC170065 [0,0,0,0,0,0|3,0,1]=4 16 B9R1.6 ClC(=O)C1=CN=CN=C1 AC160433 [0,0,0,0,0,0|3,0,0]=3 17 B9R1.6 NC(=N)C1=CC=CC=C1 AC511551 [0,0,0,0,0,0|2,0,0]=2 18 B9R1.6 NC(=N)C1=CC=CN=C1 AC180531 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.6 NC(=N)C1=NC=CC=N1 AC021194 [0,0,0,0,0,0|4,0,0]=4 20 B9R1.6 NC(=O)C1=CC=CN=C1 HY-B0150 [0,0,0,0,0,0|2,0,0]=2 21 B9R1.6 NC(=O)C1=NC=CN=C1 HY-B0271 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.6 NC(=S)C1=NC=CC=C1 AC180667 [0,0,0,0,0,0|2,1,0]=3 23 B9R1.6 OB(O)C1=CC=CC=C1 AC130043 [0,0,0,0,0,0|1,0,1]=2 24 B9R1.6 OB(O)C1=CC=NC=C1 AC090084 [0,0,0,0,0,0|2,0,1]=3 25 B9R1.6 OB(O)C1=CN=CC=C1 AC181089 [0,0,0,0,0,0|2,0,1]=3 26 B9R1.6 OB(O)C1=CN=CN=C1 AC130009 [0,0,0,0,0,0|3,0,1]=4 27 B9R1.6 OC(=O)C1=CC=CN=C1 AC510862 [0,0,0,0,0,0|1,0,0]=1 28 B9R1.6 OC(=O)C1=CC=CN=C1 HY-B0143 [0,0,0,0,0,0|1,0,0]=1 29 B9R1.6 OC(=O)C1=CC=NN=C1 AC180268 [0,0,0,0,0,0|2,0,0]=2 30 B9R1.6 OC(=O)C1=CCCCO1 AC170089 [0,0,0,0,0,0|1,0,3]=4 31 B9R1.6 OC(=O)C1=CCNCC1 HY-100810 [0,0,0,0,0,0|1,0,3]=4 32 B9R1.6 OC(=O)C1=CN=CN=C1 AC020529 [0,0,0,0,0,0|2,0,0]=2 33 B9R1.6 OC(=O)C1=COCCC1 AC170013 [0,0,0,0,0,0|1,0,3]=4 34 B9R1.6 OC(=O)C1=NC=CC=C1 AC190264 [0,0,0,0,0,0|1,0,0]=1 35 B9R1.6 OC(=O)C1=NC=CC=N1 AC181135 [0,0,0,0,0,0|2,0,0]=2 36 B9R1.6 OC(=O)C1=NC=CN=C1 AC021096 [0,0,0,0,0,0|2,0,0]=2 37 B9R1.6 OC(=O)C1=NC=NC=C1 AC180734 [0,0,0,0,0,0|2,0,0]=2 38 B9R1.6 OC(=O)C1=NN=CC=C1 AC511154 [0,0,0,0,0,0|2,0,0]=2 39 B9R1.6 OC(=O)[C@@H]1CCC=CC1 AC310100 [0,0,0,0,0,0|0,0,4]=4 40 B9R1.6 OC(=O)[C@H]1CCC=CC1 AC310113 [0,0,0,0,0,0|0,0,4]=4 41 B9R1.6 [O-]C(=O)C1=NC=CN=N1 AC050612 [0,0,0,0,0,0|3,0,1]=4 42 B8R1.2 BrCC1=CC=CN=C1 AC190295 [1,0,0,0,0,0|2,0,1]=4 43 B8R1.2 BrCC1=CC=NC=C1 AC190236 [1,0,0,0,0,0|2,0,1]=4 44 B8R1.2 BrCC1=NC=CC=C1 AC190262 [1,0,0,0,0,0|2,0,1]=4 45 B8R1.2 C#CC1=CC=CC=N1 AC180444 [1,0,0,0,0,0|2,0,1]=4 46 B8R1.2 C#CC1=CC=CN=C1 AC500275 [1,0,0,0,0,0|2,0,1]=4 47 B8R1.2 C#CC1=CC=NC=C1 AC181543 [1,0,0,0,0,0|2,0,1]=4 48 B8R1.2 C#CC1=CC=NC=C1 AC511059 [1,0,0,0,0,0|2,0,1]=4 49 B8R1.2 CNC1=NC=CC=C1 AC500327 [1,0,0,0,0,0|3,0,0]=4 50 B8R1.2 COC1=CC=NC=C1 AC510883 [1,0,0,0,0,0|3,0,0]=4 51 B8R1.2 ClCC1=CC=CC=N1 AC510931 [1,0,0,0,0,0|2,0,1]=4 52 B8R1.2 ClCC1=CC=CN=C1 AC190048 [1,0,0,0,0,0|2,0,1]=4 53 B8R1.2 NCC1=CC=CN=C1 AC512081 [1,0,0,0,0,0|2,0,1]=4 54 B8R1.2 NCC1=CC=NC=C1 AC510741 [1,0,0,0,0,0|2,0,1]=4 55 B8R1.2 NNC1=CC=CN=C1 AC182314 [1,0,0,0,0,0|3,0,0]=4 56 B8R1.2 NNC1=CC=NC=C1 AC511160 [1,0,0,0,0,0|3,0,0]=4 57 B8R1.2 NNC1=NC=CC=C1 AC510793 [1,0,0,0,0,0|3,0,0]=4 58 B8R1.2 O=CC1=CC=CN=C1 AC170118 [1,0,0,0,0,0|1,0,0]=2 59 B8R1.2 O=CC1=CC=NC=C1 AC180162 [1,0,0,0,0,0|1,0,0]=2 60 B8R1.2 O=CC1=NC=CC=C1 AC500026 [1,0,0,0,0,0|1,0,0]=2 61 B8R1.2 OCC1=CC=CC=C1 HY-B0892 [1,0,0,0,0,0|0,0,1]=2 62 B8R1.2 OCC1=CC=CN=C1 AC500154 [1,0,0,0,0,0|1,0,1]=3 63 B8R1.2 OCC1=CC=NC=C1 AC510857 [1,0,0,0,0,0|1,0,1]=3 64 B8R1.2 OCC1=CN=CN=C1 AC170027 [1,0,0,0,0,0|2,0,1]=4 65 B8R1.2 OCC1=NC=CC=C1 AC511744 [1,0,0,0,0,0|1,0,1]=3 66 B8R1.2 OCC1=NC=CC=N1 AC182042 [1,0,0,0,0,0|2,0,1]=4 67 B8R1.2 ONC1=CC=CC=C1 AC500156 [1,0,0,0,0,0|1,0,0]=2 68 B8R1.2 SCC1=NC=CC=C1 AC100035 [1,0,0,0,0,0|1,1,1]=4 69 B10R1.13 C1=C(C=CC(=C1)Br)B(O)O LN00159009 [0,1,0,0,0,0|1,0,1]=3 70 B10R1.13 C1=C(C=CC(=C1)I)B(O)O LN00008579 [0,1,0,0,0,0|1,0,1]=3 71 B10R1.13 C1=C(C=CC(=C1)O)B(O)O LN00138842 [0,1,0,0,0,0|1,0,1]=3 72 B10R1.13 C1=CC(=N)NC=C1B(O)O LN00194883 [0,1,0,0,0,0|2,0,1]=4 73 B10R1.13 C1=CC(=NC=C1Br)C(=O)O LN00009289 [0,1,0,0,0,0|1,0,0]=2 74 B10R1.13 C1=NC(=CN=C1C(=O)O)Br LN00171312 [0,1,0,0,0,0|2,0,0]=3 75 B10R1.13 C1=NC(=CN=C1C(=O)O)N LN00159244 [0,1,0,0,0,0|2,0,0]=3 76 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 AC511499 [0,1,0,0,0,0|2,0,0]=3 77 B10R1.13 CC(=O)C1=CC=C(C)C=C1 AC511479 [0,1,0,0,0,0|1,0,0]=2 78 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 AC181609 [0,1,0,0,0,0|2,0,0]=3 79 B10R1.13 CC(=O)C1=CC=C(F)N=C1 AC182130 [0,1,0,0,0,0|2,0,0]=3 80 B10R1.13 CC(=O)C1=CC=C(N)C=C1 AC510510 [0,1,0,0,0,0|1,0,0]=2 81 B10R1.13 CC(=O)C1=CC=C(O)C=C1 AC190210 [0,1,0,0,0,0|1,0,0]=2 82 B10R1.13 CC(=O)C1=CC=C(O)N=C1 AC182574 [0,1,0,0,0,0|2,0,0]=3 83 B10R1.13 CC(=O)C1=CN=C(C=C1)Br LN00170457 [0,1,0,0,0,0|2,0,0]=3 84 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 AC181883 [0,1,0,0,0,0|2,0,0]=3 85 B10R1.13 CC(O)C1=CC=C(C)N=C1 AC020061 [0,1,0,0,0,0|2,0,1]=4 86 B10R1.13 CC1=CC=C(C=C1)B(O)O AC500015 [0,1,0,0,0,0|1,0,1]=3 87 B10R1.13 CC1=CC=C(C=C1)C(O)=O AC190159 [0,1,0,0,0,0|0,0,0]=1 88 B10R1.13 CC1=CC=C(C=C1)S([O-])=O AC510965 [0,1,0,0,0,0|1,0,1]=3 89 B10R1.13 CC1=CN=C(C=C1)C(O)=O AC181304 [0,1,0,0,0,0|1,0,0]=2 90 B10R1.13 CC1=CN=C(C=C1)[N+]([O-])=O AC180941 [0,1,0,0,0,0|2,0,1]=4 91 B10R1.13 CC1=NC=C(C=C1)B(O)O AC190074 [0,1,0,0,0,0|2,0,1]=4 92 B10R1.13 CC1=NC=C(C=C1)[N+]([O-])=O AC181800 [0,1,0,0,0,0|2,0,1]=4 93 B10R1.13 CC1=NC=C(C=N1)C(=O)O LN00156992 [0,1,0,0,0,0|2,0,0]=3 94 B10R1.13 CC1=NN=C(C=C1)C(O)=O AC182475 [0,1,0,0,0,0|2,0,0]=3 95 B10R1.13 CN(C)C1=CC=C(C=C1)O LN00220688 [0,1,0,0,0,0|3,0,0]=4 96 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 AC020028 [0,1,0,0,0,0|2,0,1]=4 97 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 AC050507 [0,1,0,0,0,0|2,0,1]=4 98 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 AC050523 [0,1,0,0,0,0|2,0,1]=4 99 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 AC020207 [0,1,0,0,0,0|2,0,1]=4 100 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 AC500284 [0,1,0,0,0,0|2,0,1]=4 101 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 AC020024 [0,1,0,0,0,0|2,0,1]=4 102 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 AC050617 [0,1,0,0,0,0|2,0,1]=4 103 B10R1.13 NC(=N)C1=CC=C(Br)C=C1 AC181036 [0,1,0,0,0,0|2,0,0]=3 104 B10R1.13 NC(=N)C1=CC=C(Cl)C=C1 AC180714 [0,1,0,0,0,0|2,0,0]=3 105 B10R1.13 NC(=N)C1=CC=C(N)C=C1 AC511622 [0,1,0,0,0,0|2,0,0]=3 106 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 AC190321 [0,1,0,0,0,0|1,0,0]=2 107 B10R1.13 NC(=O)C1=CC=C(F)C=C1 AC511804 [0,1,0,0,0,0|1,0,0]=2 108 B10R1.13 NC(=O)C1=NC=C(Cl)N=C1 AC182570 [0,1,0,0,0,0|3,0,0]=4 109 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 AC180441 [0,1,0,0,0,0|1,1,0]=3 110 B10R1.13 NC1=CC=C(C=C1)B(O)O AC090205 [0,1,0,0,0,0|1,0,1]=3 111 B10R1.13 NC1=CC=C(C=C1)C(O)=O HY-B1008 [0,1,0,0,0,0|0,0,0]=1 112 B10R1.13 NC1=CC=C(N=C1)C(O)=O AC181509 [0,1,0,0,0,0|1,0,0]=2 113 B10R1.13 NC1=NC=C(C=N1)C(O)=O AC181924 [0,1,0,0,0,0|2,0,0]=3 114 B10R1.13 NC1=NN=C(C=C1)C(O)=O AC181995 [0,1,0,0,0,0|2,0,0]=3 115 B10R1.13 OB(O)C1=CC=C(Br)C=C1 AC500010 [0,1,0,0,0,0|1,0,1]=3 116 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 AC180418 [0,1,0,0,0,0|1,0,1]=3 117 B10R1.13 OB(O)C1=CC=C(F)C=C1 AC180417 [0,1,0,0,0,0|1,0,1]=3 118 B10R1.13 OB(O)C1=CC=C(F)N=C1 AC130003 [0,1,0,0,0,0|2,0,1]=4 119 B10R1.13 OB(O)C1=CC=C(I)C=C1 AC181226 [0,1,0,0,0,0|1,0,1]=3 120 B10R1.13 OB(O)C1=CC=C(O)C=C1 AC181172 [0,1,0,0,0,0|1,0,1]=3 121 B10R1.13 OB(O)C1=CC=C(O)N=C1 AC190026 [0,1,0,0,0,0|2,0,1]=4 122 B10R1.13 OC(=O)C1=CC=C(Br)C=N1 AC180939 [0,1,0,0,0,0|1,0,0]=2 123 B10R1.13 OC(=O)C1=CC=C(Br)N=C1 AC181373 [0,1,0,0,0,0|1,0,0]=2 124 B10R1.13 OC(=O)C1=CC=C(Cl)N=C1 AC180144 [0,1,0,0,0,0|1,0,0]=2 125 B10R1.13 OC(=O)C1=CC=C(F)N=C1 AC512097 [0,1,0,0,0,0|1,0,0]=2 126 B10R1.13 OC(=O)C1=CC=C(I)C=C1 AC510881 [0,1,0,0,0,0|0,0,0]=1 127 B10R1.13 OC(=O)C1=CC=C(O)C=C1 AC190218 [0,1,0,0,0,0|0,0,0]=1 128 B10R1.13 OC(=O)C1=CC=C(O)C=N1 AC181066 [0,1,0,0,0,0|1,0,0]=2 129 B10R1.13 OC(=O)C1=CC=C(O)N=C1 AC180148 [0,1,0,0,0,0|1,0,0]=2 130 B10R1.13 OC(=O)C1=NC=C(Br)C=N1 AC511903 [0,1,0,0,0,0|2,0,0]=3 131 B10R1.13 OC(=O)C1=NC=C(Cl)C=C1 AC510981 [0,1,0,0,0,0|1,0,0]=2 132 B10R1.13 OC(=O)C1=NC=C(F)C=C1 AC181804 [0,1,0,0,0,0|1,0,0]=2 133 B10R1.13 OC(=O)C1=NC=C(O)N=C1 HY-76210 [0,1,0,0,0,0|2,0,0]=3 134 B10R1.13 OC(=O)C1=NN=C(Cl)C=C1 AC511081 [0,1,0,0,0,0|2,0,0]=3 135 B10R1.13 OC1=CC=C(C=C1)C(F)F AC512172 [0,1,0,0,0,0|2,0,1]=4 136 B10R1.13 [O-][N+](=O)C1=CC=C(Cl)C=N1 AC181532 [0,1,0,0,0,0|2,0,1]=4 137 B10R1.13 [O-][N+](=O)C1=CC=C(F)C=C1 AC500316 [0,1,0,0,0,0|1,0,1]=3 138 B10R1.13 [O-][N+](=O)C1=CN=C(Br)C=C1 AC130898 [0,1,0,0,0,0|2,0,1]=4 139 B10R1.13 [O-][N+](=O)C1=CN=C(Cl)C=C1 AC511702 [0,1,0,0,0,0|2,0,1]=4 140 B10R1.13 [O-][N+](=O)C1=CN=C(F)C=C1 AC181569 [0,1,0,0,0,0|2,0,1]=4 141 B10R1.13 [O-][N+](=O)C1=NC=C(Br)C=C1 AC180808 [0,1,0,0,0,0|2,0,1]=4 142 B10R1.13 [O-][N+](=O)C1=NC=C(F)C=C1 AC280026 [0,1,0,0,0,0|2,0,1]=4 143 B10R1.15 BrCC(=O)C1=CC=CC=C1 AC190211 [0,1,0,0,0,0|1,0,0]=2 144 B10R1.15 BrCC(=O)C1=CC=NC=C1 AC190075 [0,1,0,0,0,0|2,0,0]=3 145 B10R1.15 BrCC(=O)C1=NC=CC=C1 AC190303 [0,1,0,0,0,0|2,0,0]=3 146 B10R1.15 C/C(=N\O)C1=CC=CN=C1 AC170016 [0,1,0,0,0,0|2,0,0]=3 147 B10R1.15 C1=CC(=NC=C1)C(=O)CBr LN00004265 [0,1,0,0,0,0|2,0,0]=3 148 B10R1.15 C1=CC=C(C=C1)C(=O)CN LN00159450 [0,1,0,0,0,0|1,0,0]=2 149 B10R1.15 C1=CC=C(C=C1)[C@@H](CO)O LN00236000 [0,1,0,0,0,0|0,0,2]=3 150 B10R1.15 C1=CC=NC(=C1)C(=NN)O LN00336703 [0,1,0,0,0,0|2,0,0]=3 151 B10R1.15 C1=CN=CN=C1C(=O)NN LN00337324 [0,1,0,0,0,0|3,0,0]=4 152 B10R1.15 C1=NC=C(C(=O)NN)N=C1 LN00006178 [0,1,0,0,0,0|3,0,0]=4 153 B10R1.15 CC(C=O)C1=CC=CC=C1 AC190221 [0,1,0,0,0,0|1,0,1]=3 154 B10R1.15 CCC(C1=CC=CC=C1)Br LN01357533 [0,1,0,0,0,0|2,0,1]=4 155 B10R1.15 COC(=O)C1=CC=CN=C1 AC190178 [0,1,0,0,0,0|1,0,0]=2 156 B10R1.15 COC(=O)C1=CC=NC=C1 AC180163 [0,1,0,0,0,0|1,0,0]=2 157 B10R1.15 COC(=O)C1=CC=NN=C1 AC182530 [0,1,0,0,0,0|2,0,0]=3 158 B10R1.15 COC(=O)C1=CN=CN=C1 AC050514 [0,1,0,0,0,0|2,0,0]=3 159 B10R1.15 COC(=O)C1=NC=CC=N1 AC021481 [0,1,0,0,0,0|2,0,0]=3 160 B10R1.15 NCC(=O)C1=CC=CC=C1 AC180291 [0,1,0,0,0,0|1,0,0]=2 161 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 AC510841 [0,1,0,0,0,0|1,0,1]=3 162 B10R1.15 NNC(=O)C1=CC=NC=C1 HY-B0329 [0,1,0,0,0,0|2,0,0]=3 163 B10R1.15 NNC(=O)C1=NC=CN=C1 AC190001 [0,1,0,0,0,0|3,0,0]=4 164 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 AC180222 [0,1,0,0,0,0|1,0,1]=3 165 B10R1.15 N[C@H](CO)C1=CC=CC=C1 AC131619 [0,1,0,0,0,0|1,0,1]=3 166 B10R1.15 OCC(=O)C1=CC=CC=C1 AC180446 [0,1,0,0,0,0|0,0,0]=1 167 B10R1.28 CC(C)(N)C1=CC=CC=C1 AC500102 [0,1,0,0,0,0|2,0,1]=4 168 B10R1.28 ClS(=O)(=O)C1=CC=CC=C1 AC190208 [0,1,0,0,0,0|1,0,1]=3 169 B10R1.28 ClS(=O)(=O)C1=CC=CN=C1 AC511042 [0,1,0,0,0,0|2,0,1]=4 170 B10R1.28 F[B-](F)(F)C1=CC=CC=C1 AC511097 [0,1,0,0,0,0|3,0,0]=4 171 B10R1.28 OS(=O)(=O)C1=CC=CC=C1 AC190167 [0,1,0,0,0,0|1,0,0]=2 172 B10R1.61 C1=C(C(=CN=C1)Br)C(=O)O LN00009298 [0,1,0,0,0,0|1,0,0]=2 173 B10R1.61 C1=CC(=C(C(=O)O)N=C1)F LN00173629 [0,1,0,0,0,0|1,0,0]=2 174 B10R1.61 C1=CC(=C(F)N=C1)[N+](=O)[O-] LN00011353 [0,1,0,0,0,0|2,0,1]=4 175 B10R1.61 C1=CC(=C(N)N=C1)[N+](=O)[O-] LN00010635 [0,1,0,0,0,0|2,0,1]=4 176 B10R1.61 C1=CC=C(C(=C1)C(=N)O)Br LN00236317 [0,1,0,0,0,0|1,0,0]=2 177 B10R1.61 C1=CC=C(C(=C1)C(=N)O)I LN00200183 [0,1,0,0,0,0|1,0,0]=2 178 B10R1.61 C1=NC(=C(Cl)N=C1)C(=O)O LN00009177 [0,1,0,0,0,0|2,0,0]=3 179 B10R1.61 C1=NC(=C(N=C1)O)C(=O)N LN00227281 [0,1,0,0,0,0|3,0,0]=4 180 B10R1.61 CC(=O)C1=CC=CC=C1Br AC511597 [0,1,0,0,0,0|1,0,0]=2 181 B10R1.61 CC(=O)C1=CC=CC=C1Cl AC500259 [0,1,0,0,0,0|1,0,0]=2 182 B10R1.61 CC(=O)C1=CC=CC=C1I LN00159959 [0,1,0,0,0,0|1,0,0]=2 183 B10R1.61 CC(=O)C1=CC=CC=C1N AC180212 [0,1,0,0,0,0|1,0,0]=2 184 B10R1.61 CC(=O)C1=CC=CC=C1O AC510427 [0,1,0,0,0,0|1,0,0]=2 185 B10R1.61 CC(=O)C1=CC=CN=C1Cl AC181741 [0,1,0,0,0,0|2,0,0]=3 186 B10R1.61 CC1=C(C=CC=C1)B(O)O AC130310 [0,1,0,0,0,0|1,0,1]=3 187 B10R1.61 CC1=C(C=CC=C1)C(O)=O AC511474 [0,1,0,0,0,0|0,0,0]=1 188 B10R1.61 CC1=C(C=CC=N1)[N+]([O-])=O AC181797 [0,1,0,0,0,0|2,0,1]=4 189 B10R1.61 CC1=C(C=CN=C1)C(O)=O AC270034 [0,1,0,0,0,0|1,0,0]=2 190 B10R1.61 CC1=CC=CN=C1C(O)=O AC180861 [0,1,0,0,0,0|1,0,0]=2 191 B10R1.61 CC1=CC=NC=C1C(O)=O AC180723 [0,1,0,0,0,0|1,0,0]=2 192 B10R1.61 CC1=CC=NC=C1[N+]([O-])=O AC180510 [0,1,0,0,0,0|2,0,1]=4 193 B10R1.61 CC1=NC=CC=C1C(O)=O AC180300 [0,1,0,0,0,0|1,0,0]=2 194 B10R1.61 CC1=NC=CN=C1C(O)=O AC182348 [0,1,0,0,0,0|2,0,0]=3 195 B10R1.61 CC1=NC=NC=C1C(O)=O AC050390 [0,1,0,0,0,0|2,0,0]=3 196 B10R1.61 CC1=NN=CC=C1C(O)=O AC050718 [0,1,0,0,0,0|2,0,0]=3 197 B10R1.61 CN(C)C1=CC=CC=C1N AC511923 [0,1,0,0,0,0|3,0,0]=4 198 B10R1.61 C[C@@H](O)C1=C(Cl)C=CC=C1 AC020783 [0,1,0,0,0,0|1,0,1]=3 199 B10R1.61 C[C@H](C1=CC=CC=C1Br)N LN02156247 [0,1,0,0,0,0|2,0,1]=4 200 B10R1.61 C[C@H](N)C1=CC=CC=C1F AC181536 [0,1,0,0,0,0|2,0,1]=4 201 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 AC020784 [0,1,0,0,0,0|1,0,1]=3 202 B10R1.61 C[C@H](O)C1=CC=CN=C1N AC020958 [0,1,0,0,0,0|2,0,1]=4 203 B10R1.61 FC(F)C1=CC=CC=C1Br AC010373 [0,1,0,0,0,0|2,0,1]=4 204 B10R1.61 NC(=O)C1=C(Br)C=NC=C1 AC182435 [0,1,0,0,0,0|2,0,0]=3 205 B10R1.61 NC(=O)C1=C(N)C=CC=C1 AC190185 [0,1,0,0,0,0|1,0,0]=2 206 B10R1.61 NC(=O)C1=C(N)C=NC=C1 AC511944 [0,1,0,0,0,0|2,0,0]=3 207 B10R1.61 NC(=O)C1=CC=CC=C1I AC190079 [0,1,0,0,0,0|1,0,0]=2 208 B10R1.61 NC(=O)C1=CC=CN=C1N AC180726 [0,1,0,0,0,0|2,0,0]=3 209 B10R1.61 NC(=O)C1=NC=CC=C1N AC181996 [0,1,0,0,0,0|2,0,0]=3 210 B10R1.61 NC(=O)C1=NC=CN=C1Cl AC182491 [0,1,0,0,0,0|3,0,0]=4 211 B10R1.61 NC(=O)C1=NC=CN=C1[O-] AC021296 [0,1,0,0,0,0|3,0,0]=4 212 B10R1.61 NC1=C(C=CC=C1)B(O)O AC090182 [0,1,0,0,0,0|1,0,1]=3 213 B10R1.61 NC1=C(C=CN=C1)C(O)=O AC180749 [0,1,0,0,0,0|1,0,0]=2 214 B10R1.61 NC1=C(C=NC=C1)C(O)=O AC180942 [0,1,0,0,0,0|1,0,0]=2 215 B10R1.61 NC1=C(C=NC=C1)[N+]([O-])=O AC180807 [0,1,0,0,0,0|2,0,1]=4 216 B10R1.61 NC1=CC=CC=C1B(O)O AC510975 [0,1,0,0,0,0|1,0,1]=3 217 B10R1.61 NC1=CC=CN=C1C(O)=O AC180670 [0,1,0,0,0,0|1,0,0]=2 218 B10R1.61 NC1=CC=CN=C1[N+]([O-])=O AC180471 [0,1,0,0,0,0|2,0,1]=4 219 B10R1.61 NC1=NC=CC=C1C(O)=O AC510818 [0,1,0,0,0,0|1,0,0]=2 220 B10R1.61 NC1=NC=CC=C1[N+]([O-])=O AC180153 [0,1,0,0,0,0|2,0,1]=4 221 B10R1.61 NC1=NN=CC=C1C(O)=O AC181217 [0,1,0,0,0,0|2,0,0]=3 222 B10R1.61 OB(O)C1=C(Cl)C=CC=C1 AC181084 [0,1,0,0,0,0|1,0,1]=3 223 B10R1.61 OB(O)C1=C(F)N=CC=C1 AC130013 [0,1,0,0,0,0|2,0,1]=4 224 B10R1.61 OB(O)C1=CC=CC=C1Br AC090122 [0,1,0,0,0,0|1,0,1]=3 225 B10R1.61 OB(O)C1=CC=CC=C1F AC130319 [0,1,0,0,0,0|1,0,1]=3 226 B10R1.61 OB(O)C1=CC=CC=C1O AC181170 [0,1,0,0,0,0|1,0,1]=3 227 B10R1.61 OB(O)C1=CC=CN=C1Cl AC090149 [0,1,0,0,0,0|2,0,1]=4 228 B10R1.61 OC(=O)C1=C(Br)C=CC=C1 AC510993 [0,1,0,0,0,0|0,0,0]=1 229 B10R1.61 OC(=O)C1=C(Br)N=CC=C1 AC130049 [0,1,0,0,0,0|1,0,0]=2 230 B10R1.61 OC(=O)C1=C(Cl)C=NC=C1 AC181556 [0,1,0,0,0,0|1,0,0]=2 231 B10R1.61 OC(=O)C1=C(F)C=NC=C1 AC160422 [0,1,0,0,0,0|1,0,0]=2 232 B10R1.61 OC(=O)C1=C(I)C=CC=C1 AC180035 [0,1,0,0,0,0|0,0,0]=1 233 B10R1.61 OC(=O)C1=CC=CC=C1O HY-B0167 [0,1,0,0,0,0|0,0,0]=1 234 B10R1.61 OC(=O)C1=CC=CN=C1Cl AC511646 [0,1,0,0,0,0|1,0,0]=2 235 B10R1.61 OC(=O)C1=CC=CN=C1F AC130164 [0,1,0,0,0,0|1,0,0]=2 236 B10R1.61 OC(=O)C1=CC=NC=C1Br AC180440 [0,1,0,0,0,0|1,0,0]=2 237 B10R1.61 OC(=O)C1=CC=NC=C1O AC170008 [0,1,0,0,0,0|1,0,0]=2 238 B10R1.61 OC(=O)C1=CC=NNC1=O AC181972 [0,1,0,0,0,0|2,0,0]=3 239 B10R1.61 OC(=O)C1=CN=CC=C1Cl AC180720 [0,1,0,0,0,0|1,0,0]=2 240 B10R1.61 OC(=O)C1=NC=CC=C1Br AC181228 [0,1,0,0,0,0|1,0,0]=2 241 B10R1.61 OC(=O)C1=NC=CC=C1Cl AC181291 [0,1,0,0,0,0|1,0,0]=2 242 B10R1.61 OC(=O)C1=NC=CC=C1F AC181795 [0,1,0,0,0,0|1,0,0]=2 243 B10R1.61 OC(=O)C1=NC=CC=C1O AC180151 [0,1,0,0,0,0|1,0,0]=2 244 B10R1.61 OC(=O)C1=NC=CN=C1Br AC512171 [0,1,0,0,0,0|2,0,0]=3 245 B10R1.61 OC(=O)C1=NC=CN=C1Cl AC210043 [0,1,0,0,0,0|2,0,0]=3 246 B10R1.61 OC1=C(C=NC=C1)[N+]([O-])=O AC180727 [0,1,0,0,0,0|2,0,1]=4 247 B10R1.61 OC1=CC=CC=C1C([O-])=O HY-B0167A [0,1,0,0,0,0|0,0,1]=2 248 B10R1.61 [O-][N+](=O)C1=C(Br)C=NC=C1 AC181528 [0,1,0,0,0,0|2,0,1]=4 249 B10R1.61 [O-][N+](=O)C1=C(F)C=NC=C1 AC511083 [0,1,0,0,0,0|2,0,1]=4 250 B10R1.61 [O-][N+](=O)C1=C(F)N=CC=C1 AC181572 [0,1,0,0,0,0|2,0,1]=4 251 B10R1.61 [O-][N+](=O)C1=CC=CN=C1Cl AC510833 [0,1,0,0,0,0|2,0,1]=4 252 B10R1.61 [O-][N+](=O)C1=CN=CC=C1Cl AC500191 [0,1,0,0,0,0|2,0,1]=4 253 B10R1.61 [O-][N+](=O)C1=NC=CC=C1Br AC181139 [0,1,0,0,0,0|2,0,1]=4 254 B10R1.113 C1=C(C=NC=C1C(=O)O)Cl LN00003135 [0,1,0,0,0,0|1,0,0]=2 255 B10R1.113 C1=CC(=CC(=C1)F)B(O)O LN00116374 [0,1,0,0,0,0|1,0,1]=3 256 B10R1.113 C1=CC(=NC(=C1)Br)C(=O)O LN00009301 [0,1,0,0,0,0|1,0,0]=2 257 B10R1.113 C1=CC(=NC(=C1)F)C(=O)O LN00009991 [0,1,0,0,0,0|1,0,0]=2 258 B10R1.113 C1=CN=C(C=C1[N+](=O)[O-])Br LN00010158 [0,1,0,0,0,0|2,0,1]=4 259 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 AC020983 [0,1,0,0,0,0|2,0,0]=3 260 B10R1.113 CC(=O)C1=CC=CC(=N1)Br LN00004057 [0,1,0,0,0,0|2,0,0]=3 261 B10R1.113 CC(=O)C1=CC=CC(Br)=C1 AC500258 [0,1,0,0,0,0|1,0,0]=2 262 B10R1.113 CC(=O)C1=CC=CC(F)=C1 AC180005 [0,1,0,0,0,0|1,0,0]=2 263 B10R1.113 CC(=O)C1=CN=CC(Br)=C1 AC511684 [0,1,0,0,0,0|2,0,0]=3 264 B10R1.113 CC(=O)C1=NC(Br)=CC=C1 AC180989 [0,1,0,0,0,0|2,0,0]=3 265 B10R1.113 CC(=O)C1=NC(C)=CC=C1 AC181994 [0,1,0,0,0,0|2,0,0]=3 266 B10R1.113 CC(C1=CC(=CC=C1)Br)N LN01347982 [0,1,0,0,0,0|2,0,1]=4 267 B10R1.113 CC(N)C1=CC(O)=CC=C1 AC020799 [0,1,0,0,0,0|2,0,1]=4 268 B10R1.113 CC(N)C1=CC=CC(Br)=C1 AC021480 [0,1,0,0,0,0|2,0,1]=4 269 B10R1.113 CC(N)C1=CC=CC(Br)=C1 AC182169 [0,1,0,0,0,0|2,0,1]=4 270 B10R1.113 CC1=CC(=CC=C1)B(O)O AC500109 [0,1,0,0,0,0|1,0,1]=3 271 B10R1.113 CC1=CC(=CC=N1)C(=O)O LN00011005 [0,1,0,0,0,0|1,0,0]=2 272 B10R1.113 CC1=CC(=CC=N1)[N+](=O)[O-] LN00224487 [0,1,0,0,0,0|2,0,1]=4 273 B10R1.113 CC1=CC(=CN=C1)C(O)=O AC181129 [0,1,0,0,0,0|1,0,0]=2 274 B10R1.113 CC1=CC=CC(=N1)B(O)O AC511263 [0,1,0,0,0,0|2,0,1]=4 275 B10R1.113 CC1=CC=CC(=N1)C(O)=O AC180370 [0,1,0,0,0,0|1,0,0]=2 276 B10R1.113 CC1=CN=CC(=C1)B(O)O AC181676 [0,1,0,0,0,0|2,0,1]=4 277 B10R1.113 CC1=CN=CC(=N1)C(O)=O AC182346 [0,1,0,0,0,0|2,0,0]=3 278 B10R1.113 CC1=NC(=CN=C1)C(=O)O LN00010207 [0,1,0,0,0,0|2,0,0]=3 279 B10R1.113 CC1=NC=CC(=C1)C(O)=O AC510752 [0,1,0,0,0,0|1,0,0]=2 280 B10R1.113 CC1=NC=CC(=C1)[N+]([O-])=O AC181575 [0,1,0,0,0,0|2,0,1]=4 281 B10R1.113 CN(C)C1=CC=CC(O)=C1 AC190067 [0,1,0,0,0,0|3,0,0]=4 282 B10R1.113 C[C@@H](N)C1=CC=CC(Br)=C1 AC511565 [0,1,0,0,0,0|2,0,1]=4 283 B10R1.113 C[C@H](N)C1=CC(Br)=CC=C1 AC020029 [0,1,0,0,0,0|2,0,1]=4 284 B10R1.113 NC(=N)C1=CC=CC(Br)=C1 AC181813 [0,1,0,0,0,0|2,0,0]=3 285 B10R1.113 NC(=O)C1=CC(N)=CN=C1 AC182383 [0,1,0,0,0,0|2,0,0]=3 286 B10R1.113 NC(=O)C1=CC=CC(N)=C1 HY-12022 [0,1,0,0,0,0|1,0,0]=2 287 B10R1.113 NC(=O)C1=C[N+]([O-])=CC=C1 HY-101407 [0,1,0,0,0,0|2,0,0]=3 288 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 AC181190 [0,1,0,0,0,0|2,0,0]=3 289 B10R1.113 NC1=CC(=CC=C1)B(O)O AC090217 [0,1,0,0,0,0|1,0,1]=3 290 B10R1.113 NC1=CC(=CC=N1)C(O)=O AC180915 [0,1,0,0,0,0|1,0,0]=2 291 B10R1.113 NC1=CC(=CN=C1)[N+]([O-])=O AC170005 [0,1,0,0,0,0|2,0,1]=4 292 B10R1.113 NC1=CC=CC(=C1)B(O)O AC090109 [0,1,0,0,0,0|1,0,1]=3 293 B10R1.113 NC1=CC=CC(=C1)B(O)O AC090193 [0,1,0,0,0,0|1,0,1]=3 294 B10R1.113 NC1=CC=CC(=N1)C(O)=O AC180914 [0,1,0,0,0,0|1,0,0]=2 295 B10R1.113 NC1=CN=CC(=C1)C(O)=O AC180732 [0,1,0,0,0,0|1,0,0]=2 296 B10R1.113 NC1=CN=CC(=N1)C(O)=O AC182576 [0,1,0,0,0,0|2,0,0]=3 297 B10R1.113 NC1=NC=CC(=C1)[N+]([O-])=O AC511185 [0,1,0,0,0,0|2,0,1]=4 298 B10R1.113 OB(O)C1=CC(Br)=CC=C1 AC511068 [0,1,0,0,0,0|1,0,1]=3 299 B10R1.113 OB(O)C1=CC(Cl)=CC=C1 AC180810 [0,1,0,0,0,0|1,0,1]=3 300 B10R1.113 OB(O)C1=CC(Cl)=CN=C1 AC090234 [0,1,0,0,0,0|2,0,1]=4 301 B10R1.113 OB(O)C1=CC(Cl)=NC=C1 AC090167 [0,1,0,0,0,0|2,0,1]=4 302 B10R1.113 OB(O)C1=CC(F)=CC=C1 AC180959 [0,1,0,0,0,0|1,0,1]=3 303 B10R1.113 OB(O)C1=CC(F)=CN=C1 AC050683 [0,1,0,0,0,0|2,0,1]=4 304 B10R1.113 OB(O)C1=CC(O)=CC=C1 AC181171 [0,1,0,0,0,0|1,0,1]=3 305 B10R1.113 OB(O)C1=CC=NC(F)=C1 AC090152 [0,1,0,0,0,0|2,0,1]=4 306 B10R1.113 OC(=O)C1=CC(=O)NC=C1 AC181219 [0,1,0,0,0,0|1,0,0]=2 307 B10R1.113 OC(=O)C1=CC(Cl)=CC=N1 AC180860 [0,1,0,0,0,0|1,0,0]=2 308 B10R1.113 OC(=O)C1=CC(Cl)=NC=C1 AC511765 [0,1,0,0,0,0|1,0,0]=2 309 B10R1.113 OC(=O)C1=CC(F)=CN=C1 AC511690 [0,1,0,0,0,0|1,0,0]=2 310 B10R1.113 OC(=O)C1=CC(F)=NC=C1 AC181447 [0,1,0,0,0,0|1,0,0]=2 311 B10R1.113 OC(=O)C1=CC(I)=NC=C1 AC190088 [0,1,0,0,0,0|1,0,0]=2 312 B10R1.113 OC(=O)C1=CC(O)=CC=C1 AC190160 [0,1,0,0,0,0|0,0,0]=1 313 B10R1.113 OC(=O)C1=CC=CC(=O)N1 AC180866 [0,1,0,0,0,0|1,0,0]=2 314 B10R1.113 OC(=O)C1=CC=NC(Br)=C1 AC181281 [0,1,0,0,0,0|1,0,0]=2 315 B10R1.113 OC(=O)C1=CN(=O)=CC=C1 HY-B1061 [0,1,0,0,0,0|1,0,0]=2 316 B10R1.113 OC(=O)C1=CN=CC(Cl)=C1 AC180728 [0,1,0,0,0,0|1,0,0]=2 317 B10R1.113 OC(=O)C1=CN=CC(O)=C1 AC500286 [0,1,0,0,0,0|1,0,0]=2 318 B10R1.113 OC(=O)C1=NC(Br)=CC=C1 AC510356 [0,1,0,0,0,0|1,0,0]=2 319 B10R1.113 OC(=O)C1=NC(Cl)=CC=C1 AC180794 [0,1,0,0,0,0|1,0,0]=2 320 B10R1.113 OC(=O)C1=NC=CC(Br)=C1 AC511849 [0,1,0,0,0,0|1,0,0]=2 321 B10R1.113 OC(=O)C1=NC=CC(O)=C1 AC181051 [0,1,0,0,0,0|1,0,0]=2 322 B10R1.113 [O-][N+](=O)C1=CC=CC(Cl)=N1 AC170129 [0,1,0,0,0,0|2,0,1]=4 323 B10R1.113 [O-][N+](=O)C1=CC=NC(Cl)=C1 AC511613 [0,1,0,0,0,0|2,0,1]=4 324 B10R1.113 [O-][N+](=O)C1=CN=CC(Br)=C1 AC181806 [0,1,0,0,0,0|2,0,1]=4 325 B10R1.113 [O-][N+](=O)C1=CN=CC(Cl)=C1 AC181807 [0,1,0,0,0,0|2,0,1]=4 326 B8R1.7 C1=C(C(=O)O)SN=C1 LN01368400 [0,0,0,0,1,0|2,0,0]=3 327 B8R1.7 C1=COC(=C1)B(O)O LN00004521 [0,0,0,0,1,0|2,0,1]=4 328 B8R1.7 C1=COC(=N1)C(=O)N LN02009510 [0,0,0,0,1,0|3,0,0]=4 329 B8R1.7 C1=CSC(=C1)B(O)O LN00117282 [0,0,0,0,1,0|2,0,1]=4 330 B8R1.7 C1=CSC=C1B(O)O LN00163120 [0,0,0,0,1,0|2,0,1]=4 331 B8R1.7 CC(=O)C1=CC=CS1 AC510514 [0,0,0,0,1,0|2,0,0]=3 332 B8R1.7 CC(=O)C1=CSC=C1 AC500077 [0,0,0,0,1,0|2,0,0]=3 333 B8R1.7 CC(=O)C1=NC=CN1 AC210047 [0,0,0,0,1,0|3,0,0]=4 334 B8R1.7 CC(=O)C1=NC=CS1 AC510705 [0,0,0,0,1,0|3,0,0]=4 335 B8R1.7 ClC(=O)C1=CC=CN1 AC180091 [0,0,0,0,1,0|2,0,0]=3 336 B8R1.7 NC(=O)C1=COC=N1 AC182643 [0,0,0,0,1,0|3,0,0]=4 337 B8R1.7 OB(O)C1=CC=CO1 AC130268 [0,0,0,0,1,0|2,0,1]=4 338 B8R1.7 OB(O)C1=CC=CS1 AC010326 [0,0,0,0,1,0|2,0,1]=4 339 B8R1.7 OB(O)C1=COC=C1 AC130294 [0,0,0,0,1,0|2,0,1]=4 340 B8R1.7 OB(O)C1=CSC=C1 AC130010 [0,0,0,0,1,0|2,0,1]=4 341 B8R1.7 OC(=O)C1=CC=CO1 AC510992 [0,0,0,0,1,0|1,0,0]=2 342 B8R1.7 OC(=O)C1=CC=NO1 AC050948 [0,0,0,0,1,0|2,0,0]=3 343 B8R1.7 OC(=O)C1=CCCC1 AC120012 [0,0,0,0,1,0|0,0,3]=4 344 B8R1.7 OC(=O)C1=CN=CO1 AC500181 [0,0,0,0,1,0|2,0,0]=3 345 B8R1.7 OC(=O)C1=CN=CS1 AC181678 [0,0,0,0,1,0|2,0,0]=3 346 B8R1.7 OC(=O)C1=CNC=C1 AC181119 [0,0,0,0,1,0|1,0,0]=2 347 B8R1.7 OC(=O)C1=CNC=N1 AC511460 [0,0,0,0,1,0|2,0,0]=3 348 B8R1.7 OC(=O)C1=CNN=C1 AC180266 [0,0,0,0,1,0|2,0,0]=3 349 B8R1.7 OC(=O)C1=COC=N1 AC510698 [0,0,0,0,1,0|2,0,0]=3 350 B8R1.7 OC(=O)C1=CSC=C1 AC310080 [0,0,0,0,1,0|1,0,0]=2 351 B8R1.7 OC(=O)C1=CSC=N1 AC360006 [0,0,0,0,1,0|2,0,0]=3 352 B8R1.7 OC(=O)C1=NC=CN1 AC180986 [0,0,0,0,1,0|2,0,0]=3 353 B8R1.7 OC(=O)C1=NC=CS1 AC510654 [0,0,0,0,1,0|2,0,0]=3 354 B8R1.7 OC(=O)C1=NNC=C1 AC180630 [0,0,0,0,1,0|2,0,0]=3 355 B8R1.7 OC(=O)C1=NON=C1 AC190011 [0,0,0,0,1,0|3,0,0]=4 356 B8R1.7 OC(=O)C1CC=CC1 AC180693 [0,0,0,0,1,0|0,0,3]=4 357 B8R1.7 [O-]C(=O)C1=CC=CS1 AC030126 [0,0,0,0,1,0|1,0,1]=3 358 B8R1.7 [O-][N+](=O)C1=CNC=C1 AC511749 [0,0,0,0,1,0|2,0,1]=4 359 B10R1.18 C1=C(C=CN=C1)CC(=O)O LN00224216 [0,0,0,0,0,1|1,0,0]=2 360 B10R1.18 C1=CC=C(C=C1)CC(=N)O LN00159648 [0,0,0,0,0,1|1,0,0]=2 361 B10R1.18 CC(=O)CC1=CC=NC=C1 AC180731 [0,0,0,0,0,1|2,0,0]=3 362 B10R1.18 CC(=O)CC1=NC=CC=C1 AC511843 [0,0,0,0,0,1|2,0,0]=3 363 B10R1.18 ClC(=S)OC1=CC=CC=C1 AC500117 [0,0,0,0,0,1|1,1,0]=3 364 B10R1.18 NC(=O)CC1=CC=CC=C1 AC512053 [0,0,0,0,0,1|1,0,0]=2 365 B10R1.18 OC(=O)CC1=CC=CN=C1 AC290044 [0,0,0,0,0,1|1,0,0]=2 366 B10R1.18 OC(=O)CC1=CC=NC=C1 AC180287 [0,0,0,0,0,1|1,0,0]=2 367 B7R1.3 BrC1=CC=NC=C1 AC180288 [2,0,0,0,0,0|2,0,0]=4 368 B7R1.3 BrC1=NC=CC=C1 AC130148 [2,0,0,0,0,0|2,0,0]=4 369 B7R1.3 C1=NC=NC=C1O LN00004994 [2,0,0,0,0,0|2,0,0]=4 370 B7R1.3 ClC1=CC=CN=C1 AC510157 [2,0,0,0,0,0|2,0,0]=4 371 B7R1.3 FC1=CC=CN=C1 AC510740 [2,0,0,0,0,0|2,0,0]=4 372 B7R1.3 IC1=CC=CC=C1 AC130763 [2,0,0,0,0,0|1,0,0]=3 373 B7R1.3 IC1=CC=CC=N1 AC190289 [2,0,0,0,0,0|2,0,0]=4 374 B7R1.3 IC1=CC=CN=C1 AC180371 [2,0,0,0,0,0|2,0,0]=4 375 B7R1.3 IC1=CC=NC=C1 AC181399 [2,0,0,0,0,0|2,0,0]=4 376 B7R1.3 NC1=CC=NC=C1 HY-B0604 [2,0,0,0,0,0|2,0,0]=4 377 B7R1.3 O=C1NC=CC=N1 AC180285 [2,0,0,0,0,0|2,0,0]=4 378 B7R1.3 O=C1NN=CC=C1 AC180688 [2,0,0,0,0,0|2,0,0]=4 379 B7R1.3 OC1=CC=NC=C1 AC510896 [2,0,0,0,0,0|1,0,0]=3 380 B7R1.3 OC1=NC=CC=C1 AC500203 [2,0,0,0,0,0|1,0,0]=3 381 B7R1.3 [O-][N+]1=CC=CC=C1 AC130307 [2,0,0,0,0,0|1,0,1]=4 382 B9R0.55 OC(=O)/C=C\C=C/C(O)=O AC070081 [0,1,1,0,0,0|1,0,0]=3 383 B9R1.1 BC1=CC=C(OC)C=C1 AC090165 [1,1,0,0,0,0|2,0,0]=4 384 B9R1.1 BrC1=CC=C(C=C)C=C1 AC500252 [1,1,0,0,0,0|1,0,0]=3 385 B9R1.1 BrC1=CC=C(C=C1)C#C AC310107 [1,1,0,0,0,0|1,0,1]=4 386 B9R1.1 BrC1=CC=C(C=C1)C#N AC500050 [1,1,0,0,0,0|1,0,1]=4 387 B9R1.1 BrC1=CC=C(C=O)C=C1 AC130129 [1,1,0,0,0,0|0,0,0]=2 388 B9R1.1 BrC1=CC=C(C=O)C=N1 AC181833 [1,1,0,0,0,0|1,0,0]=3 389 B9R1.1 BrC1=CC=C(C=O)N=C1 AC181786 [1,1,0,0,0,0|1,0,0]=3 390 B9R1.1 BrCC1=CC=C(Br)C=C1 AC511101 [1,1,0,0,0,0|1,0,1]=4 391 B9R1.1 BrCC1=CC=C(I)C=C1 AC511536 [1,1,0,0,0,0|1,0,1]=4 392 B9R1.1 C#CC1=CC=C(C=C1)N LN00337947 [1,1,0,0,0,0|1,0,1]=4 393 B9R1.1 C1=C(C=CC(=C1)Cl)CN LN00007551 [1,1,0,0,0,0|1,0,1]=4 394 B9R1.1 C1=C(C=CC(=C1)I)CN LN00181807 [1,1,0,0,0,0|1,0,1]=4 395 B9R1.1 C1=C(C=CC(=C1)I)CO LN00140802 [1,1,0,0,0,0|0,0,1]=3 396 B9R1.1 CC1=CC=C(C=C1)C#C AC310130 [1,1,0,0,0,0|1,0,1]=4 397 B9R1.1 CC1=CC=C(C=O)C=C1 AC131766 [1,1,0,0,0,0|0,0,0]=2 398 B9R1.1 CC1=CC=C(C=O)C=N1 AC100063 [1,1,0,0,0,0|1,0,0]=3 399 B9R1.1 CC1=CC=C(C=O)N=C1 AC511100 [1,1,0,0,0,0|1,0,0]=3 400 B9R1.1 CC1=CC=C(CO)C=N1 AC100103 [1,1,0,0,0,0|1,0,1]=4 401 B9R1.1 CC1=CC=C(NN)C=C1 AC510908 [1,1,0,0,0,0|2,0,0]=4 402 B9R1.1 CC1=NC=C(C=O)C=N1 AC190110 [1,1,0,0,0,0|2,0,0]=4 403 B9R1.1 COC1=CC=C(I)C=C1 AC190049 [1,1,0,0,0,0|2,0,0]=4 404 B9R1.1 COC1=CC=C(O)C=C1 AC130677 [1,1,0,0,0,0|2,0,0]=4 405 B9R1.1 COC1=CC=C(S)C=C1 AC130236 [1,1,0,0,0,0|2,0,0]=4 406 B9R1.1 CSC1=CC=C(O)C=C1 AC130022 [1,1,0,0,0,0|2,0,0]=4 407 B9R1.1 ClC1=CC=C(C=C1)C#C AC310131 [1,1,0,0,0,0|1,0,1]=4 408 B9R1.1 ClC1=CC=C(C=C1)C#N AC510885 [1,1,0,0,0,0|1,0,1]=4 409 B9R1.1 ClC1=CC=C(C=O)C=N1 AC020051 [1,1,0,0,0,0|1,0,0]=3 410 B9R1.1 ClC1=CN=C(C=O)C=C1 AC182265 [1,1,0,0,0,0|1,0,0]=3 411 B9R1.1 ClCC1=CC=C(Br)C=C1 AC511747 [1,1,0,0,0,0|1,0,1]=4 412 B9R1.1 FC1=CC=C(C=C1)C#C AC310126 [1,1,0,0,0,0|1,0,1]=4 413 B9R1.1 FC1=CC=C(C=C1)C#N AC180025 [1,1,0,0,0,0|1,0,1]=4 414 B9R1.1 FC1=CC=C(C=O)C=C1 AC131767 [1,1,0,0,0,0|0,0,0]=2 415 B9R1.1 FC1=CN=C(C=O)C=C1 AC511176 [1,1,0,0,0,0|1,0,0]=3 416 B9R1.1 FC1=NC=C(C=O)C=C1 AC511039 [1,1,0,0,0,0|1,0,0]=3 417 B9R1.1 IC1=CC=C(C=C1)C#N AC500297 [1,1,0,0,0,0|1,0,1]=4 418 B9R1.1 IC1=CC=C(C=O)C=C1 AC180421 [1,1,0,0,0,0|0,0,0]=2 419 B9R1.1 NC1=CC=C(C=C1)C#C AC310136 [1,1,0,0,0,0|1,0,1]=4 420 B9R1.1 NC1=CC=C(C=C1)C#N AC190216 [1,1,0,0,0,0|1,0,1]=4 421 B9R1.1 NC1=CC=C(CO)C=C1 AC510886 [1,1,0,0,0,0|0,0,1]=3 422 B9R1.1 NC1=NC=C(C=O)C=N1 AC511477 [1,1,0,0,0,0|2,0,0]=4 423 B9R1.1 NCC1=CC=C(Br)C=C1 AC500062 [1,1,0,0,0,0|1,0,1]=4 424 B9R1.1 NCC1=CC=C(Cl)C=C1 AC510625 [1,1,0,0,0,0|1,0,1]=4 425 B9R1.1 NCC1=CC=C(O)C=C1 AC190229 [1,1,0,0,0,0|1,0,1]=4 426 B9R1.1 NNC1=CC=C(Br)C=C1 AC131225 [1,1,0,0,0,0|2,0,0]=4 427 B9R1.1 OC1=CC=C(C=C1)C#N AC190204 [1,1,0,0,0,0|1,0,1]=4 428 B9R1.1 OC1=CC=C(C=O)C=C1 AC130039 [1,1,0,0,0,0|0,0,0]=2 429 B9R1.1 OC1=CC=C(C=O)C=N1 AC511193 [1,1,0,0,0,0|1,0,0]=3 430 B9R1.1 OC1=CN=C(C=O)C=C1 AC511243 [1,1,0,0,0,0|1,0,0]=3 431 B9R1.1 OCC1=CC=C(Br)C=C1 AC190199 [1,1,0,0,0,0|0,0,1]=3 432 B9R1.1 OCC1=CC=C(Cl)C=C1 AC190200 [1,1,0,0,0,0|0,0,1]=3 433 B9R1.1 OCC1=CC=C(Cl)N=C1 AC181178 [1,1,0,0,0,0|1,0,1]=4 434 B9R1.1 OCC1=CC=C(I)C=C1 AC511569 [1,1,0,0,0,0|0,0,1]=3 435 B9R1.1 OCC1=NC=C(Br)C=C1 AC181754 [1,1,0,0,0,0|1,0,1]=4 436 B9R1.1 OCC1=NC=C(O)C=C1 AC512020 [1,1,0,0,0,0|1,0,1]=4 437 B9R1.1 SC1=CC=C(C=C1)C#N AC050521 [1,1,0,0,0,0|1,0,1]=4 438 B9R1.2 BrC1=CC(=CC=C1)C#N AC190054 [1,1,0,0,0,0|1,0,1]=4 439 B9R1.2 BrC1=CC(C=O)=NC=C1 AC511173 [1,1,0,0,0,0|1,0,0]=3 440 B9R1.2 BrC1=CC=CC(C=O)=C1 AC500300 [1,1,0,0,0,0|0,0,0]=2 441 B9R1.2 BrC1=CC=CC(C=O)=N1 AC181501 [1,1,0,0,0,0|1,0,0]=3 442 B9R1.2 BrC1=CN=CC(C=O)=C1 AC181606 [1,1,0,0,0,0|1,0,0]=3 443 B9R1.2 BrCC1=CC(Br)=CC=C1 AC510964 [1,1,0,0,0,0|1,0,1]=4 444 B9R1.2 BrCC1=CC=CC(I)=C1 AC510794 [1,1,0,0,0,0|1,0,1]=4 445 B9R1.2 C1=C(C=C(Cl)N=C1)CO LN00005270 [1,1,0,0,0,0|1,0,1]=4 446 B9R1.2 C1=CC(=NC(=C1)Br)C=O LN00008017 [1,1,0,0,0,0|1,0,0]=3 447 B9R1.2 C1=CC(=NC(=C1)Br)CO LN00009570 [1,1,0,0,0,0|1,0,1]=4 448 B9R1.2 C1=CNC(=O)C=C1C=O LN00003854 [1,1,0,0,0,0|1,0,0]=3 449 B9R1.2 CC1=CC(C=O)=NC=C1 AC510820 [1,1,0,0,0,0|1,0,0]=3 450 B9R1.2 CC1=CC(CN)=CC=C1 AC500121 [1,1,0,0,0,0|1,0,1]=4 451 B9R1.2 CC1=CC=CC(C=O)=N1 AC510632 [1,1,0,0,0,0|1,0,0]=3 452 B9R1.2 CC1=NC(=CC=C1)CO LN00224223 [1,1,0,0,0,0|1,0,1]=4 453 B9R1.2 CC1=NC=CC(C=O)=C1 AC181964 [1,1,0,0,0,0|1,0,0]=3 454 B9R1.2 CNC1=CC(Br)=CC=C1 AC020132 [1,1,0,0,0,0|2,0,0]=4 455 B9R1.2 COC1=CC=CC(N)=C1 AC130321 [1,1,0,0,0,0|2,0,0]=4 456 B9R1.2 COC1=CC=CC(O)=C1 AC130088 [1,1,0,0,0,0|2,0,0]=4 457 B9R1.2 CSC1=CC(N)=CC=C1 AC500237 [1,1,0,0,0,0|2,0,0]=4 458 B9R1.2 ClC1=CC(=CC=C1)C#C AC190257 [1,1,0,0,0,0|1,0,1]=4 459 B9R1.2 ClC1=CC(=CC=C1)C#N AC511790 [1,1,0,0,0,0|1,0,1]=4 460 B9R1.2 ClC1=CC(C=O)=CC=C1 AC511323 [1,1,0,0,0,0|0,0,0]=2 461 B9R1.2 ClC1=CC(C=O)=NC=C1 AC182139 [1,1,0,0,0,0|1,0,0]=3 462 B9R1.2 ClC1=CC(CBr)=CC=C1 AC180010 [1,1,0,0,0,0|1,0,1]=4 463 B9R1.2 ClC1=NC=CC(C=O)=C1 AC511448 [1,1,0,0,0,0|1,0,0]=3 464 B9R1.2 FC1=CC(=CC=C1)C#C AC510708 [1,1,0,0,0,0|1,0,1]=4 465 B9R1.2 FC1=CC(C=O)=CC=C1 AC511704 [1,1,0,0,0,0|0,0,0]=2 466 B9R1.2 FC1=CC(C=O)=CN=C1 AC512032 [1,1,0,0,0,0|1,0,0]=3 467 B9R1.2 FC1=CC=CC(CBr)=C1 AC510779 [1,1,0,0,0,0|1,0,1]=4 468 B9R1.2 FC1=CC=CC(CCl)=C1 AC180011 [1,1,0,0,0,0|1,0,1]=4 469 B9R1.2 FC1=NC(C=O)=CC=C1 AC181585 [1,1,0,0,0,0|1,0,0]=3 470 B9R1.2 IC1=CC(C=O)=CC=C1 AC511778 [1,1,0,0,0,0|0,0,0]=2 471 B9R1.2 NC1=CC(=CC=C1)C#C AC500091 [1,1,0,0,0,0|1,0,1]=4 472 B9R1.2 NC1=CC=CC(CO)=N1 AC190007 [1,1,0,0,0,0|1,0,1]=4 473 B9R1.2 NC1=NC=CC(CO)=C1 AC181723 [1,1,0,0,0,0|1,0,1]=4 474 B9R1.2 NCC1=CC(Cl)=CC=C1 AC510764 [1,1,0,0,0,0|1,0,1]=4 475 B9R1.2 NCC1=CC=CC(Br)=C1 AC181165 [1,1,0,0,0,0|1,0,1]=4 476 B9R1.2 NCC1=CC=CC(I)=C1 AC180290 [1,1,0,0,0,0|1,0,1]=4 477 B9R1.2 NNC1=CC(Br)=CC=C1 AC511632 [1,1,0,0,0,0|2,0,0]=4 478 B9R1.2 NNC1=CC=CC(F)=C1 AC500291 [1,1,0,0,0,0|2,0,0]=4 479 B9R1.2 OC1=CC(=CC=C1)C#N AC190275 [1,1,0,0,0,0|1,0,1]=4 480 B9R1.2 OC1=CC=CC(C=O)=C1 AC130074 [1,1,0,0,0,0|0,0,0]=2 481 B9R1.2 OCC1=CC(Br)=CN=C1 AC500329 [1,1,0,0,0,0|1,0,1]=4 482 B9R1.2 OCC1=CC(Br)=NC=C1 AC070124 [1,1,0,0,0,0|1,0,1]=4 483 B9R1.2 OCC1=CC(Cl)=NC=C1 AC182075 [1,1,0,0,0,0|1,0,1]=4 484 B9R1.2 OCC1=CC=CC(Br)=C1 AC511533 [1,1,0,0,0,0|0,0,1]=3 485 B9R1.2 OCC1=CC=CC(Br)=N1 AC181774 [1,1,0,0,0,0|1,0,1]=4 486 B9R1.2 OCC1=NC(Cl)=CC=C1 AC182154 [1,1,0,0,0,0|1,0,1]=4 487 B9R1.2 OCC1=NC(Cl)=CC=C1 AC182330 [1,1,0,0,0,0|1,0,1]=4 488 B9R1.2 OCC1=NC=CC(Cl)=C1 AC182138 [1,1,0,0,0,0|1,0,1]=4 489 B9R1.8 BrC#CC1=CC=CC=C1 AC511272 [1,1,0,0,0,0|1,0,1]=4 490 B9R1.8 CNCC1=CC=CC=C1 AC500163 [1,1,0,0,0,0|1,0,1]=4 491 B9R1.8 NNCC1=CC=CC=C1 AC500254 [1,1,0,0,0,0|1,0,1]=4 492 B9R1.8 OCCC1=CC=NC=C1 AC511725 [1,1,0,0,0,0|1,0,1]=4 493 B9R1.8 ONCC1=CC=CC=C1 AC180467 [1,1,0,0,0,0|0,0,1]=3 494 B9R1.15 BrC1=C(C=O)C=CC=C1 AC190053 [1,1,0,0,0,0|0,0,0]=2 495 B9R1.15 BrC1=C(C=O)C=CN=C1 AC511781 [1,1,0,0,0,0|1,0,0]=3 496 B9R1.15 BrC1=CC=CC=C1C#N AC500253 [1,1,0,0,0,0|1,0,1]=4 497 B9R1.15 BrC1=CC=NC=C1C=O AC290066 [1,1,0,0,0,0|1,0,0]=3 498 B9R1.15 BrC1=NC=CC=C1C=O AC130168 [1,1,0,0,0,0|1,0,0]=3 499 B9R1.15 BrCC1=C(Br)C=CC=C1 AC500309 [1,1,0,0,0,0|1,0,1]=4 500 B9R1.15 BrCC1=C(I)C=CC=C1 AC510755 [1,1,0,0,0,0|1,0,1]=4 501 B9R1.15 C1=CC(=C(C=O)N=C1)O LN00121425 [1,1,0,0,0,0|1,0,0]=3 502 B9R1.15 C1=CC=C(C(=C1)CO)Br LN00009848 [1,1,0,0,0,0|0,0,1]=3 503 B9R1.15 CC1=CC=CC=C1C=O AC511038 [1,1,0,0,0,0|0,0,0]=2 504 B9R1.15 CC1=CC=CC=C1CN AC190306 [1,1,0,0,0,0|1,0,1]=4 505 B9R1.15 CC1=CC=CN=C1C=O AC181444 [1,1,0,0,0,0|1,0,0]=3 506 B9R1.15 CC1=NC=CC=C1CO LN00004952 [1,1,0,0,0,0|1,0,1]=4 507 B9R1.15 CCC1=CC=CC=C1Br AC500247 [1,1,0,0,0,0|1,0,1]=4 508 B9R1.15 CNC1=C(O)C=CC=C1 AC512071 [1,1,0,0,0,0|2,0,0]=4 509 B9R1.15 CNC1=CC=CC=C1N AC511708 [1,1,0,0,0,0|2,0,0]=4 510 B9R1.15 CNC1=CC=CC=C1N LN01309502 [1,1,0,0,0,0|2,0,0]=4 511 B9R1.15 COC1=C(Br)C=CC=C1 AC510848 [1,1,0,0,0,0|2,0,0]=4 512 B9R1.15 COC1=C(I)C=CC=C1 AC510814 [1,1,0,0,0,0|2,0,0]=4 513 B9R1.15 COC1=CC=CC=C1O AC190186 [1,1,0,0,0,0|2,0,0]=4 514 B9R1.15 ClC1=C(C=CC=C1)C#C AC180982 [1,1,0,0,0,0|1,0,1]=4 515 B9R1.15 ClC1=C(C=O)C=CN=C1 AC510941 [1,1,0,0,0,0|1,0,0]=3 516 B9R1.15 ClC1=CC=CC=C1C=O AC190062 [1,1,0,0,0,0|0,0,0]=2 517 B9R1.15 ClC1=CC=CC=C1CBr AC180009 [1,1,0,0,0,0|1,0,1]=4 518 B9R1.15 ClC1=CC=CN=C1C=O AC511242 [1,1,0,0,0,0|1,0,0]=3 519 B9R1.15 FC1=C(C=CC=C1)C#N AC511685 [1,1,0,0,0,0|1,0,1]=4 520 B9R1.15 FC1=C(CBr)C=CC=C1 AC510775 [1,1,0,0,0,0|1,0,1]=4 521 B9R1.15 FC1=CC=CC=C1C=O AC510338 [1,1,0,0,0,0|0,0,0]=2 522 B9R1.15 FC1=CC=CN=C1C=O AC100101 [1,1,0,0,0,0|1,0,0]=3 523 B9R1.15 FC1=NC=CC=C1C=O AC512030 [1,1,0,0,0,0|1,0,0]=3 524 B9R1.15 NC1=C(C=O)C=CC=C1 AC510813 [1,1,0,0,0,0|0,0,0]=2 525 B9R1.15 NC1=C(CO)C=CC=N1 AC181888 [1,1,0,0,0,0|1,0,1]=4 526 B9R1.15 NC1=CC=CC=C1CO AC511831 [1,1,0,0,0,0|0,0,1]=3 527 B9R1.15 NC1=NC=CC=C1C=O AC020960 [1,1,0,0,0,0|1,0,0]=3 528 B9R1.15 NCC1=C(Br)C=CC=C1 AC500061 [1,1,0,0,0,0|1,0,1]=4 529 B9R1.15 NCC1=C(F)C=CC=C1 AC190246 [1,1,0,0,0,0|1,0,1]=4 530 B9R1.15 NCC1=CC=CC=C1O AC181137 [1,1,0,0,0,0|1,0,1]=4 531 B9R1.15 NNC1=CC=CC=C1Cl AC180294 [1,1,0,0,0,0|2,0,0]=4 532 B9R1.15 O=CC1=CC=CNC1=O AC182145 [1,1,0,0,0,0|1,0,0]=3 533 B9R1.15 OC1=C(C=CC=C1)C#N AC511758 [1,1,0,0,0,0|1,0,1]=4 534 B9R1.15 OC1=C(C=O)C=CC=C1 AC190207 [1,1,0,0,0,0|0,0,0]=2 535 B9R1.15 OC1=C(C=O)C=CN=C1 AC511223 [1,1,0,0,0,0|1,0,0]=3 536 B9R1.15 OC1=CC=CN=C1C=O AC270030 [1,1,0,0,0,0|1,0,0]=3 537 B9R1.15 OCC1=C(Br)C=NC=C1 AC182666 [1,1,0,0,0,0|1,0,1]=4 538 B9R1.15 OCC1=C(F)C=NC=C1 AC160575 [1,1,0,0,0,0|1,0,1]=4 539 B9R1.15 OCC1=CC=CC=C1Br AC230033 [1,1,0,0,0,0|0,0,1]=3 540 B9R1.15 OCC1=CC=CC=C1I AC511037 [1,1,0,0,0,0|0,0,1]=3 541 B9R1.15 OCC1=CC=CC=C1O HY-B1419 [1,1,0,0,0,0|0,0,1]=3 542 B9R1.15 OCC1=CC=CN=C1Cl AC181378 [1,1,0,0,0,0|1,0,1]=4 543 B9R1.15 OCC1=CC=CN=C1F AC181533 [1,1,0,0,0,0|1,0,1]=4 544 B9R1.11 COC(=O)C1=CC=CN1 AC511475 [0,1,0,0,1,0|1,0,0]=3 545 B9R1.11 COC(=O)C1=CC=CS1 LN00186303 [0,1,0,0,1,0|1,0,0]=3 546 B9R1.11 COC(=O)C1=CN=CN1 AC180901 [0,1,0,0,1,0|2,0,0]=4 547 B9R1.11 COC(=O)C1=CN=CN1 LN00009425 [0,1,0,0,1,0|2,0,0]=4 548 B9R1.11 COC(=O)C1=CN=CS1 AC021342 [0,1,0,0,1,0|2,0,0]=4 549 B9R1.11 COC(=O)C1=CNC=C1 AC511033 [0,1,0,0,1,0|1,0,0]=3 550 B9R1.11 COC(=O)C1=COC=N1 AC050400 [0,1,0,0,1,0|2,0,0]=4 551 B9R1.11 COC(=O)C1=CSC=C1 AC500266 [0,1,0,0,1,0|1,0,0]=3 552 B9R1.11 COC(=O)C1=CSC=N1 AC181967 [0,1,0,0,1,0|2,0,0]=4 553 B9R1.11 COC(=O)C1=NC=CN1 AC131054 [0,1,0,0,1,0|2,0,0]=4 554 B9R1.11 COC(=O)C1=NNC=C1 AC510661 [0,1,0,0,1,0|2,0,0]=4 555 B9R1.11 NNC(=O)C1=CC=CO1 AC021398 [0,1,0,0,1,0|2,0,0]=4 556 B9R1.35 C1=C(C(=O)O)SC(=C1)Br LN00009121 [0,1,0,0,1,0|1,0,0]=3 557 B9R1.35 CC(=O)C1=CC=C(C)S1 AC180308 [0,1,0,0,1,0|2,0,0]=4 558 B9R1.35 CC1=CC(=NO1)C(O)=O AC500307 [0,1,0,0,1,0|2,0,0]=4 559 B9R1.35 CC1=CC=C(O1)C(O)=O AC180680 [0,1,0,0,1,0|1,0,0]=3 560 B9R1.35 CC1=CC=C(S1)C(O)=O AC511071 [0,1,0,0,1,0|1,0,0]=3 561 B9R1.35 CC1=NC=C(C(=O)O)O1 LN00214770 [0,1,0,0,1,0|2,0,0]=4 562 B9R1.35 CC1=NC=C(S1)C(O)=O AC181314 [0,1,0,0,1,0|2,0,0]=4 563 B9R1.35 CC1=NNC(=C1)C(O)=O AC190259 [0,1,0,0,1,0|2,0,0]=4 564 B9R1.35 CN1C=CC(=C1)C(O)=O AC182631 [0,1,0,0,1,0|1,0,0]=3 565 B9R1.35 CN1C=CC(=N1)C(O)=O AC181030 [0,1,0,0,1,0|2,0,0]=4 566 B9R1.35 CN1C=NC(=C1)C(O)=O AC181435 [0,1,0,0,1,0|2,0,0]=4 567 B9R1.35 ClC(=O)C1=CC=C(Cl)S1 AC180470 [0,1,0,0,1,0|2,0,0]=4 568 B9R1.35 NC1=NC=C(S1)C(O)=O AC181939 [0,1,0,0,1,0|2,0,0]=4 569 B9R1.35 OC(=O)C1=CC(Br)=CS1 AC181641 [0,1,0,0,1,0|1,0,0]=3 570 B9R1.35 OC(=O)C1=CC=C(Br)O1 AC130080 [0,1,0,0,1,0|1,0,0]=3 571 B9R1.35 OC(=O)C1=CC=C(Br)S1 AC020591 [0,1,0,0,1,0|1,0,0]=3 572 B9R1.35 OC(=O)C1=CC=C(Cl)O1 AC511241 [0,1,0,0,1,0|1,0,0]=3 573 B9R1.35 OC(=O)C1=CC=C(Cl)S1 AC021211 [0,1,0,0,1,0|1,0,0]=3 574 B9R1.35 OC(=O)C1=CN=C(Br)S1 AC511727 [0,1,0,0,1,0|2,0,0]=4 575 B9R1.35 OC(=O)C1=CSC(Br)=C1 AC051032 [0,1,0,0,1,0|1,0,0]=3 576 B9R1.35 OC(=O)C1=CSC(Br)=N1 AC181839 [0,1,0,0,1,0|2,0,0]=4 577 B9R1.35 OC(=O)C1=NNC(Cl)=C1 AC182427 [0,1,0,0,1,0|2,0,0]=4 578 B9R1.41 C1=NSC(=C1Cl)C(=O)O LN01263820 [0,1,0,0,1,0|2,0,0]=4 579 B9R1.41 CC(=O)C1=CNC=C1C AC330027 [0,1,0,0,1,0|2,0,0]=4 580 B9R1.41 CC1=C(C(=O)O)NC=C1 LN01237182 [0,1,0,0,1,0|1,0,0]=3 581 B9R1.41 CC1=C(OC=N1)C(O)=O AC511624 [0,1,0,0,1,0|2,0,0]=4 582 B9R1.41 CC1=NNC=C1C(O)=O AC181056 [0,1,0,0,1,0|2,0,0]=4 583 B9R1.41 CC1=NOC=C1C(O)=O AC181215 [0,1,0,0,1,0|2,0,0]=4 584 B9R1.41 CN1C=CC=C1C(=O)O LN00149766 [0,1,0,0,1,0|1,0,0]=3 585 B9R1.41 CN1C=CN=C1C(O)=O AC511055 [0,1,0,0,1,0|2,0,0]=4 586 B9R1.41 CN1C=NC=C1C(=O)O LN00003167 [0,1,0,0,1,0|2,0,0]=4 587 B9R1.41 CN1C=NC=C1C(O)=O AC181144 [0,1,0,0,1,0|2,0,0]=4 588 B9R1.41 CN1N=CC=C1C(O)=O AC181029 [0,1,0,0,1,0|2,0,0]=4 589 B9R1.41 NC(=O)C1=C(N)SC=C1 AC511070 [0,1,0,0,1,0|2,0,0]=4 590 B9R1.41 NN1C=CC=C1C(N)=O AC182612 [0,1,0,0,1,0|2,0,0]=4 591 B9R1.41 OC(=O)C1=C(Br)SC=C1 AC100025 [0,1,0,0,1,0|1,0,0]=3 592 B9R1.41 OC(=O)C1=C(F)C=CS1 AC181662 [0,1,0,0,1,0|1,0,0]=3 593 B9R1.41 OC(=O)C1=CSC=C1Br AC050399 [0,1,0,0,1,0|1,0,0]=3 594 B9R1.41 OC(=O)C1=NNC=C1Br AC181234 [0,1,0,0,1,0|2,0,0]=4 595 B11R1.20 CC(=NC1=CC=C(C=C1)I)O LN01092551 [0,1,0,0,0,1|1,0,0]=3 596 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 AC180006 [0,1,0,0,0,1|1,0,0]=3 597 B11R1.20 CC(=O)NC1=CC=C(I)C=C1 AC190309 [0,1,0,0,0,1|1,0,0]=3 598 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 HY-66005 [0,1,0,0,0,1|1,0,0]=3 599 B11R1.20 CC(=O)OC1=CC=C(N)C=C1 AC021568 [0,1,0,0,0,1|1,0,0]=3 600 B11R1.20 CC(=O)OC1=CC=C(O)C=C1 AC020469 [0,1,0,0,0,1|1,0,0]=3 601 B11R1.20 NC(=S)NC1=CC=C(F)C=C1 AC160443 [0,1,0,0,0,1|1,1,0]=4 602 B11R1.20 NC1=CC=C(CC(O)=O)C=C1 AC500183 [0,1,0,0,0,1|0,0,0]=2 603 B11R1.20 OC(=O)CC1=CC=C(Br)C=C1 AC130091 [0,1,0,0,0,1|0,0,0]=2 604 B11R1.20 OC(=O)CC1=CC=C(F)C=C1 AC180075 [0,1,0,0,0,1|0,0,0]=2 605 B11R1.20 OC(=O)CC1=CC=C(I)C=C1 AC180656 [0,1,0,0,0,1|0,0,0]=2 606 B11R1.20 OC(=O)CC1=CC=C(O)C=C1 AC130027 [0,1,0,0,0,1|0,0,0]=2 607 B11R1.20 OC(=O)CC1=CC=C(S)C=C1 AC130028 [0,1,0,0,0,1|0,0,0]=2 608 B11R1.20 OC(=O)CC1=CN=C(Cl)C=C1 AC130212 [0,1,0,0,0,1|1,0,0]=3 609 B11R1.36 C1=CC=C(C=C1)[C@H](C(=N)O)N LN00176320 [0,1,0,0,0,1|1,0,0]=3 610 B11R1.36 CC(C(O)=O)C1=CC=CC=C1 AC510790 [0,1,0,0,0,1|0,0,0]=2 611 B11R1.36 C[C@@H](C(O)=O)C1=CC=CC=C1 AC190251 [0,1,0,0,0,1|0,0,0]=2 612 B11R1.36 C[C@H](C(O)=O)C1=CC=CC=C1 AC180569 [0,1,0,0,0,1|0,0,0]=2 613 B11R1.36 OC(=O)C(=C)C1=CC=CC=C1 AC021026 [0,1,0,0,0,1|0,0,0]=2 614 B11R1.36 O[C@H](C(O)=O)C1=CC=CC=C1 AC180081 [0,1,0,0,0,1|0,0,0]=2 615 B11R1.40 BrCC(=O)NC1=CC=CC=C1 AC050571 [0,1,0,0,0,1|1,0,0]=3 616 B11R1.40 C1=CC=C(C=C1)C[C@@H](CO)N LN00008763 [0,1,0,0,0,1|1,0,1]=4 617 B11R1.40 COC(=O)CC1=CC=CC=C1 AC500158 [0,1,0,0,0,1|0,0,0]=2 618 B11R1.40 COC(=O)CC1=CN=CC=C1 LN00214372 [0,1,0,0,0,1|1,0,0]=3 619 B11R1.40 COC(=O)CC1=NC=CN=C1 AC051082 [0,1,0,0,0,1|2,0,0]=4 620 B11R1.40 NC(CO)CC1=CC=CC=C1 AC512047 [0,1,0,0,0,1|1,0,1]=4 621 B11R1.40 NCC(O)CC1=CC=CC=C1 AC050560 [0,1,0,0,0,1|1,0,1]=4 622 B11R1.40 NNC(=O)CC1=CC=NC=C1 AC190156 [0,1,0,0,0,1|2,0,0]=4 623 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 AC180085 [0,1,0,0,0,1|1,0,1]=4 624 B11R1.86 C1=CC=C(C(=C1)CC(=N)N)Cl LN00242261 [0,1,0,0,0,1|2,0,0]=4 625 B11R1.86 C1=CC=C(C(=C1)CC(=O)O)Br LN00124676 [0,1,0,0,0,1|0,0,0]=2 626 B11R1.86 CC(=NC1=CC=CC=C1N)O LN00141995 [0,1,0,0,0,1|1,0,0]=3 627 B11R1.86 CC(=O)CC1=CC=CC=C1Br AC511603 [0,1,0,0,0,1|1,0,0]=3 628 B11R1.86 OC(=O)CC1=C(I)C=CC=C1 AC510681 [0,1,0,0,0,1|0,0,0]=2 629 B11R1.86 OC(=O)CC1=C(O)C=CC=C1 AC130768 [0,1,0,0,0,1|0,0,0]=2 630 B11R1.157 CC(=NC1=CC=CC(=N)N1)O LN00337588 [0,1,0,0,0,1|2,0,0]=4 631 B11R1.157 CC(=O)CC1=CC=CC(Br)=C1 AC020586 [0,1,0,0,0,1|1,0,0]=3 632 B11R1.157 CC(=O)NC1=NC(N)=CC=C1 AC181194 [0,1,0,0,0,1|2,0,0]=4 633 B11R1.157 CC(=O)OC1=CC=CC(C)=C1 HY-B0948 [0,1,0,0,0,1|1,0,0]=3 634 B11R1.157 CC(=O)OC1=CC=CC(O)=C1 HY-B0894 [0,1,0,0,0,1|1,0,0]=3 635 B11R1.157 OC(=O)CC1=CC(O)=CC=C1 AC130034 [0,1,0,0,0,1|0,0,0]=2 636 B11R1.157 OC(=O)CC1=CC=CC(Br)=C1 AC511114 [0,1,0,0,0,1|0,0,0]=2 637 B11R1.157 OC(=O)CC1=CC=CC(Cl)=C1 AC500241 [0,1,0,0,0,1|0,0,0]=2 638 B11R1.157 OC(=O)CC1=CC=CC(F)=C1 AC511141 [0,1,0,0,0,1|0,0,0]=2 639 B11R1.157 OC(=O)CC1=CC=CC(I)=C1 AC511575 [0,1,0,0,0,1|0,0,0]=2 640 B11R1.509 ClS(=O)(=O)CC1=CC=CC=C1 AC180205 [0,1,0,0,0,1|1,0,1]=4 641 B11R1.509 FS(=O)(=O)CC1=CC=CC=C1 HY-B0496 [0,1,0,0,0,1|1,0,1]=4 642 B11R1.3 C#CC1=CC=C(C=C1)[N+](=O)[O-] LN00335623 [0,2,0,0,0,0|1,0,1]=4 643 B11R1.3 C=CC1=CC=C(C=C1)C(=O)O LN00115884 [0,2,0,0,0,0|0,0,0]=2 644 B11R1.3 C=CC1=CC=C(C=C1)[N+](=O)[O-] LN00150310 [0,2,0,0,0,0|1,0,1]=4 645 B11R1.3 CC(=O)C1=CC=C(C=C1)C#N AC180027 [0,2,0,0,0,0|1,0,0]=3 646 B11R1.3 CC(=O)C1=CC=C(CBr)C=C1 AC511182 [0,2,0,0,0,0|1,0,0]=3 647 B11R1.3 CC(=O)C1=CN=C(C=C1)OC LN00220760 [0,2,0,0,0,0|2,0,0]=4 648 B11R1.3 COC1=CC=C(C=C1)B(O)O AC180419 [0,2,0,0,0,0|1,0,1]=4 649 B11R1.3 COC1=CC=C(C=N1)C(N)=O AC040095 [0,2,0,0,0,0|2,0,0]=4 650 B11R1.3 COC1=CN=C(C=C1)C(O)=O AC500082 [0,2,0,0,0,0|1,0,0]=3 651 B11R1.3 COC1=CN=C(C=N1)C(=O)O LN00011206 [0,2,0,0,0,0|2,0,0]=4 652 B11R1.3 COC1=NC=C(C=C1)C(C)=O AC510693 [0,2,0,0,0,0|2,0,0]=4 653 B11R1.3 COC1=NC=C(C=C1)C(O)=O AC511139 [0,2,0,0,0,0|1,0,0]=3 654 B11R1.3 CSC1=CC=C(C=C1)B(O)O AC090245 [0,2,0,0,0,0|1,0,1]=4 655 B11R1.3 CSC1=NC=C(C=N1)C(O)=O AC070104 [0,2,0,0,0,0|2,0,0]=4 656 B11R1.3 NC(=N)C1=CC=C(C=C1)C#N AC360001 [0,2,0,0,0,0|2,0,0]=4 657 B11R1.3 NCC1=CC=C(C=C1)C(O)=O HY-B1258 [0,2,0,0,0,0|0,0,0]=2 658 B11R1.3 NNC1=CC=C(C=C1)[N+]([O-])=O AC511770 [0,2,0,0,0,0|1,0,1]=4 659 B11R1.3 NNC1=NC=C(C=C1)C(O)=O AC181712 [0,2,0,0,0,0|1,0,0]=3 660 B11R1.3 OB(O)C1=CC=C(C=C)C=C1 AC310132 [0,2,0,0,0,0|1,0,1]=4 661 B11R1.3 OB(O)C1=CC=C(C=C1)C#N AC020052 [0,2,0,0,0,0|1,0,1]=4 662 B11R1.3 OB(O)C1=CC=C(C=O)C=C1 AC500008 [0,2,0,0,0,0|1,0,1]=4 663 B11R1.3 OB(O)C1=CC=C(CBr)C=C1 AC090194 [0,2,0,0,0,0|1,0,1]=4 664 B11R1.3 OC(=O)C1=CC=C(C=C)C=C1 AC510627 [0,2,0,0,0,0|0,0,0]=2 665 B11R1.3 OC(=O)C1=CC=C(C=C1)C#C AC500166 [0,2,0,0,0,0|0,0,0]=2 666 B11R1.3 OC(=O)C1=CC=C(C=O)C=C1 AC510882 [0,2,0,0,0,0|0,0,0]=2 667 B11R1.3 OC(=O)C1=CC=C(N=C1)C#N AC181213 [0,2,0,0,0,0|1,0,0]=3 668 B11R1.3 OCC1=CC=C(C=C1)B(O)O AC090183 [0,2,0,0,0,0|1,0,1]=4 669 B11R1.3 OCC1=CC=C(C=C1)C(O)=O AC511649 [0,2,0,0,0,0|0,0,0]=2 670 B11R1.3 OCC1=CC=C(C=C1)[N+]([O-])=O AC511761 [0,2,0,0,0,0|1,0,1]=4 671 B11R1.3 [O-][N+](=O)C1=CC=C(C=C)C=C1 AC270041 [0,2,0,0,0,0|1,0,1]=4 672 B11R1.3 [O-][N+](=O)C1=CC=C(C=C1)C#C AC511032 [0,2,0,0,0,0|1,0,1]=4 673 B11R1.3 [O-][N+](=O)C1=CC=C(C=O)C=C1 AC510508 [0,2,0,0,0,0|1,0,1]=4 674 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O LN00194072 [0,2,0,0,0,0|1,0,0]=3 675 B11R1.19 CC1=CC=C(C=C1)S(Cl)(=O)=O AC190162 [0,2,0,0,0,0|1,0,1]=4 676 B11R1.19 CC1=CC=C(C=C1)S(O)(=O)=O AC021526 [0,2,0,0,0,0|1,0,0]=3 677 B11R1.19 CC1=CC=C(C=C1)S(O)(=O)=O AC050314 [0,2,0,0,0,0|1,0,0]=3 678 B11R1.19 CC1=CC=C(C=C1)S(O)(=O)=O AC051052 [0,2,0,0,0,0|1,0,0]=3 679 B11R1.19 CC1=CC=C(C=C1)S(O)(=O)=O AC130238 [0,2,0,0,0,0|1,0,0]=3 680 B11R1.19 CC1=CC=C(C=C1)S([O-])(=O)=O AC190158 [0,2,0,0,0,0|1,0,1]=4 681 B11R1.19 CS(=O)(=O)C1=CC=C(Br)C=C1 AC130923 [0,2,0,0,0,0|1,0,1]=4 682 B11R1.19 CS(=O)(=O)C1=CC=C(F)C=C1 AC180425 [0,2,0,0,0,0|1,0,1]=4 683 B11R1.19 CS(=O)(=O)C1=CC=C(I)C=C1 AC190146 [0,2,0,0,0,0|1,0,1]=4 684 B11R1.19 ClC1=CC=C(C=C1)S(Cl)(=O)=O AC190318 [0,2,0,0,0,0|1,0,1]=4 685 B11R1.19 NC1=CC=C(C=C1)S(N)(=O)=O HY-B0242 [0,2,0,0,0,0|1,0,1]=4 686 B11R1.19 NS(=O)(=O)C1=CC=C(Br)C=C1 AC190319 [0,2,0,0,0,0|1,0,1]=4 687 B11R1.21 C1=CC(=C(C=C1B(O)O)Cl)Cl LN00118281 [0,2,0,0,0,0|1,0,1]=4 688 B11R1.21 C1=CC(=C(C=C1C(=O)O)F)Br LN00009079 [0,2,0,0,0,0|0,0,0]=2 689 B11R1.21 C1=CC(=C(C=C1[N+](=O)[O-])I)N LN00009890 [0,2,0,0,0,0|1,0,1]=4 690 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)O LN01360918 [0,2,0,0,0,0|1,0,0]=3 691 B11R1.21 CC(=O)C1=CC(F)=C(O)C=C1 AC180895 [0,2,0,0,0,0|1,0,0]=3 692 B11R1.21 CC(=O)C1=CC=C(F)C(Cl)=C1 AC511644 [0,2,0,0,0,0|1,0,0]=3 693 B11R1.21 CC(=O)C1=CC=C(F)C(F)=C1 AC511682 [0,2,0,0,0,0|1,0,0]=3 694 B11R1.21 CC(=O)C1=CC=C(O)C(C)=C1 AC160576 [0,2,0,0,0,0|1,0,0]=3 695 B11R1.21 CC1=C(Br)C=C(C=C1)[N+]([O-])=O AC511797 [0,2,0,0,0,0|1,0,1]=4 696 B11R1.21 CC1=C(Br)C=CC(=C1)C(O)=O AC180420 [0,2,0,0,0,0|0,0,0]=2 697 B11R1.21 CC1=C(C=C(C=C1)C(=O)Cl)I LN01356961 [0,2,0,0,0,0|1,0,0]=3 698 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)I LN00009376 [0,2,0,0,0,0|0,0,0]=2 699 B11R1.21 CC1=C(C=C(C=N1)C(=O)O)Br LN01322628 [0,2,0,0,0,0|1,0,0]=3 700 B11R1.21 CC1=C(F)C=C(C=C1)C(O)=O AC180041 [0,2,0,0,0,0|0,0,0]=2 701 B11R1.21 CC1=C(F)C=CC(=C1)C(O)=O AC510753 [0,2,0,0,0,0|0,0,0]=2 702 B11R1.21 CC1=CC(=CC=C1F)B(O)O AC090059 [0,2,0,0,0,0|1,0,1]=4 703 B11R1.21 CC1=CC(=CC=C1O)C(O)=O AC180983 [0,2,0,0,0,0|0,0,0]=2 704 B11R1.21 CC1=CC(=CN=C1O)C(=O)O LN00279505 [0,2,0,0,0,0|1,0,0]=3 705 B11R1.21 CC1=CC(=NC=C1Br)C(O)=O AC182131 [0,2,0,0,0,0|1,0,0]=3 706 B11R1.21 CC1=CC=C(C=C1Br)C(O)=O AC511792 [0,2,0,0,0,0|0,0,0]=2 707 B11R1.21 CC1=CC=C(C=C1C)B(O)O AC090180 [0,2,0,0,0,0|1,0,1]=4 708 B11R1.21 CC1=CC=C(C=C1O)[N+]([O-])=O AC511728 [0,2,0,0,0,0|1,0,1]=4 709 B11R1.21 CC1=NC=C(C=C1Br)C(O)=O AC050264 [0,2,0,0,0,0|1,0,0]=3 710 B11R1.21 CC1=[N+]([O-])C=C(N=C1)C(O)=O HY-B0283 [0,2,0,0,0,0|2,0,0]=4 711 B11R1.21 FC1=C(F)C=C(C=C1)C(Cl)=O AC021119 [0,2,0,0,0,0|1,0,0]=3 712 B11R1.21 NC1=C(Br)C=CC(=C1)[N+]([O-])=O AC180505 [0,2,0,0,0,0|1,0,1]=4 713 B11R1.21 NC1=C(F)C=C(C=C1)[N+]([O-])=O AC180397 [0,2,0,0,0,0|1,0,1]=4 714 B11R1.21 NC1=C(F)C=CC(=C1)[N+]([O-])=O AC511683 [0,2,0,0,0,0|1,0,1]=4 715 B11R1.21 NC1=C(N)C=C(C=C1)C(O)=O AC200130 [0,2,0,0,0,0|0,0,0]=2 716 B11R1.21 NC1=CC=C(C=C1F)C(O)=O AC511703 [0,2,0,0,0,0|0,0,0]=2 717 B11R1.21 NC1=CC=C(C=C1O)C(O)=O AC180334 [0,2,0,0,0,0|0,0,0]=2 718 B11R1.21 OB(O)C1=CC(Cl)=C(F)C=C1 AC511508 [0,2,0,0,0,0|1,0,1]=4 719 B11R1.21 OB(O)C1=CC(Cl)=C(O)C=C1 AC511884 [0,2,0,0,0,0|1,0,1]=4 720 B11R1.21 OB(O)C1=CC(F)=C(Cl)C=C1 AC070113 [0,2,0,0,0,0|1,0,1]=4 721 B11R1.21 OB(O)C1=CC(F)=C(F)C=C1 AC181124 [0,2,0,0,0,0|1,0,1]=4 722 B11R1.21 OB(O)C1=CC=C(Cl)C(Cl)=C1 AC500215 [0,2,0,0,0,0|1,0,1]=4 723 B11R1.21 OC(=O)C1=CC(Br)=C(F)C=C1 AC511159 [0,2,0,0,0,0|0,0,0]=2 724 B11R1.21 OC(=O)C1=CC(Cl)=C(Cl)N=C1 AC510765 [0,2,0,0,0,0|1,0,0]=3 725 B11R1.21 OC(=O)C1=CC(Cl)=C(F)C=C1 AC511282 [0,2,0,0,0,0|0,0,0]=2 726 B11R1.21 OC(=O)C1=CC(F)=C(Cl)N=C1 AC010390 [0,2,0,0,0,0|1,0,0]=3 727 B11R1.21 OC(=O)C1=CC(F)=C(I)C=C1 AC182155 [0,2,0,0,0,0|0,0,0]=2 728 B11R1.21 OC(=O)C1=CC=C(Br)C(F)=C1 AC181079 [0,2,0,0,0,0|0,0,0]=2 729 B11R1.21 OC(=O)C1=CC=C(Br)C(O)=C1 AC182195 [0,2,0,0,0,0|0,0,0]=2 730 B11R1.21 OC(=O)C1=CC=C(Cl)C(O)=C1 AC511937 [0,2,0,0,0,0|0,0,0]=2 731 B11R1.21 OC(=O)C1=CC=C(I)C(O)=C1 AC131761 [0,2,0,0,0,0|0,0,0]=2 732 B11R1.21 OC(=O)C1=CC=C(O)C(O)=C1 HY-N0294 [0,2,0,0,0,0|0,0,0]=2 733 B11R1.21 OC(=O)C1=CN=C(Cl)C(Br)=C1 AC181372 [0,2,0,0,0,0|1,0,0]=3 734 B11R1.21 OC(=O)C1=CN=C(O)C(Cl)=C1 AC180523 [0,2,0,0,0,0|1,0,0]=3 735 B11R1.21 OC(=O)C1=CNC(=O)C(Br)=C1 AC182236 [0,2,0,0,0,0|1,0,0]=3 736 B11R1.21 OC(=O)C1=NC(Br)=C(F)C=C1 AC020158 [0,2,0,0,0,0|1,0,0]=3 737 B11R1.21 OC1=C(F)C=C(C=C1)[N+]([O-])=O AC511058 [0,2,0,0,0,0|1,0,1]=4 738 B11R1.21 OC1=CC=C(C=C1Br)[N+]([O-])=O AC511741 [0,2,0,0,0,0|1,0,1]=4 739 B11R1.21 [O-][N+](=O)C1=CC=C(Cl)C(Br)=C1 AC511549 [0,2,0,0,0,0|1,0,1]=4 740 B11R1.21 [O-][N+](=O)C1=CC=C(Cl)C(F)=C1 AC180892 [0,2,0,0,0,0|1,0,1]=4 741 B11R1.21 [O-][N+](=O)C1=CC=C(Cl)C(I)=C1 AC021173 [0,2,0,0,0,0|1,0,1]=4 742 B11R1.21 [O-][N+](=O)C1=CC=C(F)C(Br)=C1 AC130403 [0,2,0,0,0,0|1,0,1]=4 743 B11R1.22 C1=C(C=CC(=C1)Br)C(=O)CN LN00146620 [0,2,0,0,0,0|1,0,0]=3 744 B11R1.22 C1=C(C=CC(=C1)Cl)[C@@H](CO)N LN02185263 [0,2,0,0,0,0|1,0,1]=4 745 B11R1.22 C1=C(C=CC(=C1)F)C(=O)NN LN00116928 [0,2,0,0,0,0|1,0,0]=3 746 B11R1.22 C1=C(C=CC(=C1)F)[C@H](CO)N LN01359282 [0,2,0,0,0,0|1,0,1]=4 747 B11R1.22 CC1=CC=C(C=C1)C(=O)CBr AC500028 [0,2,0,0,0,0|1,0,0]=3 748 B11R1.22 CC1=CC=C(C=C1)[C@@H](CO)N LN02185267 [0,2,0,0,0,0|1,0,1]=4 749 B11R1.22 CCC(=O)C1=CC=C(C=C1)Br LN00225179 [0,2,0,0,0,0|1,0,0]=3 750 B11R1.22 COC(=O)C1=CC=C(Br)C=N1 AC181779 [0,2,0,0,0,0|1,0,0]=3 751 B11R1.22 COC(=O)C1=CC=C(Br)N=C1 AC181863 [0,2,0,0,0,0|1,0,0]=3 752 B11R1.22 COC(=O)C1=CC=C(C)C=C1 AC021180 [0,2,0,0,0,0|0,0,0]=2 753 B11R1.22 COC(=O)C1=CC=C(Cl)N=C1 AC190192 [0,2,0,0,0,0|1,0,0]=3 754 B11R1.22 COC(=O)C1=CC=C(F)N=C1 AC510655 [0,2,0,0,0,0|1,0,0]=3 755 B11R1.22 COC(=O)C1=CC=C(I)C=C1 AC130758 [0,2,0,0,0,0|0,0,0]=2 756 B11R1.22 COC(=O)C1=CC=C(N)C=C1 AC500030 [0,2,0,0,0,0|0,0,0]=2 757 B11R1.22 COC(=O)C1=CC=C(O)C=C1 AC190171 [0,2,0,0,0,0|0,0,0]=2 758 B11R1.22 COC(=O)C1=CN=C(C)C=C1 AC021708 [0,2,0,0,0,0|1,0,0]=3 759 B11R1.22 COC(=O)C1=CN=C(Cl)C=N1 AC511665 [0,2,0,0,0,0|2,0,0]=4 760 B11R1.22 COC(=O)C1=CN=C(N)C=C1 AC181104 [0,2,0,0,0,0|1,0,0]=3 761 B11R1.22 COC(=O)C1=NC=C(Br)C=N1 AC511168 [0,2,0,0,0,0|2,0,0]=4 762 B11R1.22 COC(=O)C1=NC=C(C)C=N1 AC051089 [0,2,0,0,0,0|2,0,0]=4 763 B11R1.22 COC(=O)C1=NC=C(Cl)C=C1 AC512123 [0,2,0,0,0,0|1,0,0]=3 764 B11R1.22 COC(=O)C1=NC=C(N)C=C1 AC160157 [0,2,0,0,0,0|1,0,0]=3 765 B11R1.22 COC(=O)C1=NC=C(N)N=C1 AC182456 [0,2,0,0,0,0|2,0,0]=4 766 B11R1.22 COC(=O)C1=NN=C(Cl)C=C1 AC511897 [0,2,0,0,0,0|2,0,0]=4 767 B11R1.22 FC1=CC=C(C=C1)C(=O)CBr AC510754 [0,2,0,0,0,0|1,0,0]=3 768 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 AC512178 [0,2,0,0,0,0|1,0,0]=3 769 B11R1.22 NCC(O)C1=CC=C(O)C=C1 HY-B0528A [0,2,0,0,0,0|1,0,1]=4 770 B11R1.22 NNC(=O)C1=CNC(=O)C=C1 AC070108 [0,2,0,0,0,0|2,0,0]=4 771 B11R1.22 O/N=C(\Cl)C1=CC=C(Br)C=C1 AC050902 [0,2,0,0,0,0|1,0,0]=3 772 B11R1.166 C1=CC(=C(C=C1Br)F)C(=O)O LN00008566 [0,2,0,0,0,0|0,0,0]=2 773 B11R1.166 C1=CC(=C(C=C1F)Br)[N+](=O)[O-] LN00009950 [0,2,0,0,0,0|1,0,1]=4 774 B11R1.166 C1=CC(=C(C=C1O)Br)C(=O)O LN01038895 [0,2,0,0,0,0|0,0,0]=2 775 B11R1.166 C1=CC(=C(C=C1O)F)[N+](=O)[O-] LN00116278 [0,2,0,0,0,0|1,0,1]=4 776 B11R1.166 CC(=O)C1=C(C=C(C=C1)N)Cl LN01796470 [0,2,0,0,0,0|1,0,0]=3 777 B11R1.166 CC(=O)C1=C(F)C=C(Br)C=C1 AC220119 [0,2,0,0,0,0|1,0,0]=3 778 B11R1.166 CC(=O)C1=CC=C(Br)C=C1O AC181677 [0,2,0,0,0,0|1,0,0]=3 779 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1Br AC511164 [0,2,0,0,0,0|1,0,0]=3 780 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1Cl AC500263 [0,2,0,0,0,0|1,0,0]=3 781 B11R1.166 CC(=O)C1=CC=C(N)C=C1O AC511889 [0,2,0,0,0,0|1,0,0]=3 782 B11R1.166 CC(=O)C1=CC=C(O)C=C1F AC021126 [0,2,0,0,0,0|1,0,0]=3 783 B11R1.166 CC(=O)C1=NC=C(F)C=C1F AC050224 [0,2,0,0,0,0|2,0,0]=4 784 B11R1.166 CC1=C(C=CC(Cl)=C1)[N+]([O-])=O AC180382 [0,2,0,0,0,0|1,0,1]=4 785 B11R1.166 CC1=C(N=CC(Br)=C1)C(O)=O AC182133 [0,2,0,0,0,0|1,0,0]=3 786 B11R1.166 CC1=CC(Br)=CC=C1C(O)=O AC250047 [0,2,0,0,0,0|0,0,0]=2 787 B11R1.166 CC1=CC(Br)=CC=C1[N+]([O-])=O AC050901 [0,2,0,0,0,0|1,0,1]=4 788 B11R1.166 CC1=CC(Cl)=C(C=C1)[N+]([O-])=O AC181490 [0,2,0,0,0,0|1,0,1]=4 789 B11R1.166 CC1=CC(Cl)=CN=C1C(O)=O AC182134 [0,2,0,0,0,0|1,0,0]=3 790 B11R1.166 CC1=CC(F)=C(C=C1)C(O)=O AC181531 [0,2,0,0,0,0|0,0,0]=2 791 B11R1.166 CC1=CC(F)=C(C=C1)[N+]([O-])=O AC180188 [0,2,0,0,0,0|1,0,1]=4 792 B11R1.166 CC1=CC(N)=CC=C1C(O)=O AC181976 [0,2,0,0,0,0|0,0,0]=2 793 B11R1.166 CC1=CC(O)=C(C=N1)C(O)=O AC181761 [0,2,0,0,0,0|1,0,0]=3 794 B11R1.166 CC1=CC(O)=CC=C1B(O)O AC090175 [0,2,0,0,0,0|1,0,1]=4 795 B11R1.166 CC1=CC=C(B(O)O)C(Cl)=C1 AC181625 [0,2,0,0,0,0|1,0,1]=4 796 B11R1.166 CC1=CC=C(B(O)O)C(F)=C1 AC181906 [0,2,0,0,0,0|1,0,1]=4 797 B11R1.166 CC1=CC=C(C(O)=O)C(Br)=C1 AC511793 [0,2,0,0,0,0|0,0,0]=2 798 B11R1.166 CC1=CC=C(C(O)=O)C(Cl)=N1 AC020050 [0,2,0,0,0,0|1,0,0]=3 799 B11R1.166 CC1=CC=C(C(O)=O)C(N)=C1 AC511862 [0,2,0,0,0,0|0,0,0]=2 800 B11R1.166 CC1=NC(=C(C=C1)C(=O)O)C LN00181449 [0,2,0,0,0,0|1,0,0]=3 801 B11R1.166 CC1=NC(=C(C=C1)C(=O)O)Cl LN00131032 [0,2,0,0,0,0|1,0,0]=3 802 B11R1.166 NC(=N)C1=CC=C(Br)C=C1F AC021555 [0,2,0,0,0,0|2,0,0]=4 803 B11R1.166 NC(=O)C1=C(N)N=C(Cl)C=C1 AC020634 [0,2,0,0,0,0|2,0,0]=4 804 B11R1.166 NC(=O)C1=CC=C(Cl)C=C1N AC182388 [0,2,0,0,0,0|1,0,0]=3 805 B11R1.166 NC1=C(C=CC(Cl)=C1)C(O)=O AC180214 [0,2,0,0,0,0|0,0,0]=2 806 B11R1.166 NC1=C(C=CC(Cl)=C1)[N+]([O-])=O AC500225 [0,2,0,0,0,0|1,0,1]=4 807 B11R1.166 NC1=C(C=CC(Cl)=N1)C(O)=O AC020633 [0,2,0,0,0,0|1,0,0]=3 808 B11R1.166 NC1=CC(Br)=CC=C1C(O)=O AC181692 [0,2,0,0,0,0|0,0,0]=2 809 B11R1.166 NC1=CC(Br)=CC=C1[N+]([O-])=O AC182391 [0,2,0,0,0,0|1,0,1]=4 810 B11R1.166 NC1=CC(Cl)=C(C=C1)C(O)=O AC511619 [0,2,0,0,0,0|0,0,0]=2 811 B11R1.166 NC1=CC(F)=CC=C1[N+]([O-])=O AC130073 [0,2,0,0,0,0|1,0,1]=4 812 B11R1.166 NC1=CC(I)=CC=C1C(O)=O AC182459 [0,2,0,0,0,0|0,0,0]=2 813 B11R1.166 NC1=CC=C(C(Br)=C1)[N+]([O-])=O AC512057 [0,2,0,0,0,0|1,0,1]=4 814 B11R1.166 NC1=CC=C(C(F)=C1)[N+]([O-])=O AC181633 [0,2,0,0,0,0|1,0,1]=4 815 B11R1.166 NC1=CC=C(C(O)=O)C(F)=C1 AC511347 [0,2,0,0,0,0|0,0,0]=2 816 B11R1.166 NC1=CC=C(C(O)=O)C(O)=C1 HY-B1048 [0,2,0,0,0,0|0,0,0]=2 817 B11R1.166 OB(O)C1=C(F)C=C(Cl)C=C1 AC181506 [0,2,0,0,0,0|1,0,1]=4 818 B11R1.166 OB(O)C1=CC=C(Cl)C=C1Cl AC180305 [0,2,0,0,0,0|1,0,1]=4 819 B11R1.166 OB(O)C1=CC=C(F)C=C1Cl AC181507 [0,2,0,0,0,0|1,0,1]=4 820 B11R1.166 OB(O)C1=CC=C(F)C=C1F AC030052 [0,2,0,0,0,0|1,0,1]=4 821 B11R1.166 OC(=O)C1=C(Br)C=C(Cl)C=C1 AC181078 [0,2,0,0,0,0|0,0,0]=2 822 B11R1.166 OC(=O)C1=C(Br)C=C(F)C=C1 AC180537 [0,2,0,0,0,0|0,0,0]=2 823 B11R1.166 OC(=O)C1=C(Br)N=C(F)C=C1 AC050995 [0,2,0,0,0,0|1,0,0]=3 824 B11R1.166 OC(=O)C1=C(Cl)C=C(Cl)C=C1 AC510802 [0,2,0,0,0,0|0,0,0]=2 825 B11R1.166 OC(=O)C1=C(Cl)C=C(F)C=C1 AC200135 [0,2,0,0,0,0|0,0,0]=2 826 B11R1.166 OC(=O)C1=C(F)C=C(Br)C=C1 AC511019 [0,2,0,0,0,0|0,0,0]=2 827 B11R1.166 OC(=O)C1=C(F)C=C(Cl)C=C1 AC510774 [0,2,0,0,0,0|0,0,0]=2 828 B11R1.166 OC(=O)C1=C(F)C=C(F)C=C1 AC180271 [0,2,0,0,0,0|0,0,0]=2 829 B11R1.166 OC(=O)C1=C(F)C=C(I)C=C1 AC181546 [0,2,0,0,0,0|0,0,0]=2 830 B11R1.166 OC(=O)C1=C(F)N=C(Br)C=C1 AC050280 [0,2,0,0,0,0|1,0,0]=3 831 B11R1.166 OC(=O)C1=C(O)C=C(Br)C=C1 AC500228 [0,2,0,0,0,0|0,0,0]=2 832 B11R1.166 OC(=O)C1=CC=C(Br)C=C1Cl AC180439 [0,2,0,0,0,0|0,0,0]=2 833 B11R1.166 OC(=O)C1=CC=C(Cl)C=C1I AC511491 [0,2,0,0,0,0|0,0,0]=2 834 B11R1.166 OC(=O)C1=CC=C(Cl)N=C1Cl AC180623 [0,2,0,0,0,0|1,0,0]=3 835 B11R1.166 OC(=O)C1=CC=C(F)C=C1O AC511669 [0,2,0,0,0,0|0,0,0]=2 836 B11R1.166 OC(=O)C1=CC=C(O)C=C1F AC181201 [0,2,0,0,0,0|0,0,0]=2 837 B11R1.166 OC(=O)C1=CN=C(Br)C=C1Cl AC050221 [0,2,0,0,0,0|1,0,0]=3 838 B11R1.166 OC(=O)C1=CN=C(Cl)C=C1Cl AC180938 [0,2,0,0,0,0|1,0,0]=3 839 B11R1.166 OC(=O)C1=CN=C(Cl)N=C1Cl AC182553 [0,2,0,0,0,0|2,0,0]=4 840 B11R1.166 OC(=O)C1=CN=C(O)N=C1O AC180624 [0,2,0,0,0,0|2,0,0]=4 841 B11R1.166 OC(=O)C1=NC=C(Br)C=C1Cl AC182704 [0,2,0,0,0,0|1,0,0]=3 842 B11R1.166 OC(=O)C1=NC=C(Cl)C=C1Cl AC181600 [0,2,0,0,0,0|1,0,0]=3 843 B11R1.166 OC(=O)C1=NC=C(Cl)N=C1Cl AC512007 [0,2,0,0,0,0|2,0,0]=4 844 B11R1.166 OC(=O)C1=NC=C(F)C=C1F AC510952 [0,2,0,0,0,0|1,0,0]=3 845 B11R1.166 OC1=C(C=CC(Br)=C1)[N+]([O-])=O AC181565 [0,2,0,0,0,0|1,0,1]=4 846 B11R1.166 OC1=C(C=CC(F)=C1)[N+]([O-])=O AC130685 [0,2,0,0,0,0|1,0,1]=4 847 B11R1.166 OC1=CC(Cl)=CC=C1[N+]([O-])=O AC182400 [0,2,0,0,0,0|1,0,1]=4 848 B11R1.166 OC1=CC=C(C(Br)=C1)[N+]([O-])=O AC182511 [0,2,0,0,0,0|1,0,1]=4 849 B11R1.166 OC1=CC=C(C(I)=C1)[N+]([O-])=O AC512128 [0,2,0,0,0,0|1,0,1]=4 850 B11R1.166 [O-][N+](=O)C1=C(Br)C=C(Br)C=C1 AC181472 [0,2,0,0,0,0|1,0,1]=4 851 B11R1.166 [O-][N+](=O)C1=C(F)C=C(Br)C=C1 AC130114 [0,2,0,0,0,0|1,0,1]=4 852 B11R1.166 [O-][N+](=O)C1=CC=C(Cl)C=C1F AC180450 [0,2,0,0,0,0|1,0,1]=4 853 B11R1.166 [O-][N+](=O)C1=CC=C(F)C=C1Br AC181099 [0,2,0,0,0,0|1,0,1]=4 854 B11R1.166 [O-][N+](=O)C1=CC=C(F)C=C1Cl AC181631 [0,2,0,0,0,0|1,0,1]=4 855 B11R1.7 BrCS(=O)(=O)C1=CC=CC=C1 AC030196 [0,2,0,0,0,0|1,0,1]=4 856 B11R1.12 OCC(CO)C1=CC=CC=C1 AC511844 [0,2,0,0,0,0|0,0,2]=4 857 B11R1.16 C1=CC=C(C=C1)[C@@H](CCO)N LN00219910 [0,2,0,0,0,0|1,0,1]=4 858 B11R1.16 CCOC(=O)C1=CC=CC=N1 LN00174068 [0,2,0,0,0,0|1,0,0]=3 859 B11R1.16 CCOC(=O)C1=CC=NC=N1 AC182470 [0,2,0,0,0,0|2,0,0]=4 860 B11R1.16 ClCOC(=O)C1=CC=CC=C1 AC511140 [0,2,0,0,0,0|0,0,0]=2 861 B11R1.16 NC(CCO)C1=CC=CC=C1 AC181123 [0,2,0,0,0,0|1,0,1]=4 862 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 AC181203 [0,2,0,0,0,0|1,0,1]=4 863 B11R1.16 O=C(CC#N)C1=CC=CC=C1 AC500022 [0,2,0,0,0,0|1,0,0]=3 864 B11R1.16 O=C(CC#N)C1=CC=CN=C1 AC182272 [0,2,0,0,0,0|2,0,0]=4 865 B11R1.16 O=C(CC#N)C1=NC=CC=C1 AC160466 [0,2,0,0,0,0|2,0,0]=4 866 B11R1.16 O[C@H](CCCl)C1=CC=CC=C1 AC180615 [0,2,0,0,0,0|1,0,1]=4 867 B11R1.23 C1=CC(=CC(=C1)Br)[C@@H](CO)N LN02151667 [0,2,0,0,0,0|1,0,1]=4 868 B11R1.23 C1=CC(=CC(=C1)Cl)C(=O)CBr LN00145927 [0,2,0,0,0,0|1,0,0]=3 869 B11R1.23 CC1=CC(=CC=N1)C(=O)OC LN00222103 [0,2,0,0,0,0|1,0,0]=3 870 B11R1.23 CNC(=O)C1=CC(Cl)=CC=N1 AC021408 [0,2,0,0,0,0|2,0,0]=4 871 B11R1.23 CNC(=O)C1=NC=CC(Cl)=C1 AC021409 [0,2,0,0,0,0|2,0,0]=4 872 B11R1.23 COC(=O)C1=CC(=O)N=CN1 AC181043 [0,2,0,0,0,0|2,0,0]=4 873 B11R1.23 COC(=O)C1=CC(=O)NC=C1 AC182395 [0,2,0,0,0,0|1,0,0]=3 874 B11R1.23 COC(=O)C1=CC(Br)=CN=C1 AC500293 [0,2,0,0,0,0|1,0,0]=3 875 B11R1.23 COC(=O)C1=CC(Br)=NC=C1 AC130905 [0,2,0,0,0,0|1,0,0]=3 876 B11R1.23 COC(=O)C1=CC(C)=NC=C1 AC030128 [0,2,0,0,0,0|1,0,0]=3 877 B11R1.23 COC(=O)C1=CC(Cl)=CC=N1 AC500112 [0,2,0,0,0,0|1,0,0]=3 878 B11R1.23 COC(=O)C1=CC(N)=NC=C1 AC181772 [0,2,0,0,0,0|1,0,0]=3 879 B11R1.23 COC(=O)C1=CC=CC(Br)=N1 AC021134 [0,2,0,0,0,0|1,0,0]=3 880 B11R1.23 COC(=O)C1=CC=CC(Cl)=N1 AC180795 [0,2,0,0,0,0|1,0,0]=3 881 B11R1.23 COC(=O)C1=CC=CC(I)=C1 AC130759 [0,2,0,0,0,0|0,0,0]=2 882 B11R1.23 COC(=O)C1=CC=CC(O)=C1 AC021635 [0,2,0,0,0,0|0,0,0]=2 883 B11R1.23 COC(=O)C1=CN=CC(Cl)=N1 AC182569 [0,2,0,0,0,0|2,0,0]=4 884 B11R1.23 COC(=O)C1=CN=CC(O)=C1 AC160383 [0,2,0,0,0,0|1,0,0]=3 885 B11R1.23 COC(=O)C1=NC(=CN=C1)Br LN00175851 [0,2,0,0,0,0|2,0,0]=4 886 B11R1.23 COC(=O)C1=NC(=NC=C1)Br LN02009581 [0,2,0,0,0,0|2,0,0]=4 887 B11R1.23 COC(=O)C1=NC(Br)=CN=C1 AC512098 [0,2,0,0,0,0|2,0,0]=4 888 B11R1.23 COC(=O)C1=NC(C)=CC=C1 AC181940 [0,2,0,0,0,0|1,0,0]=3 889 B11R1.23 COC(=O)C1=NC(Cl)=NC=C1 AC511221 [0,2,0,0,0,0|2,0,0]=4 890 B11R1.23 COC(=O)C1=NC(N)=CC=C1 AC131427 [0,2,0,0,0,0|1,0,0]=3 891 B11R1.23 COC(=O)C1=NC(N)=CN=C1 AC182575 [0,2,0,0,0,0|2,0,0]=4 892 B11R1.23 COC(=O)C1=NC=CC(Br)=C1 AC511026 [0,2,0,0,0,0|1,0,0]=3 893 B11R1.23 COC(=O)C1=NC=CC(N)=C1 AC160525 [0,2,0,0,0,0|1,0,0]=3 894 B11R1.23 COC(=O)C1=NC=NC(Cl)=C1 AC182325 [0,2,0,0,0,0|2,0,0]=4 895 B11R1.23 ClC1=CC(=CC=C1)C(=O)CBr AC181101 [0,2,0,0,0,0|1,0,0]=3 896 B11R1.23 NC(CO)C1=CC(Cl)=CC=C1 AC021444 [0,2,0,0,0,0|1,0,1]=4 897 B11R1.23 NNC(=O)C1=NC(N)=CC=C1 AC030076 [0,2,0,0,0,0|2,0,0]=4 898 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 AC020507 [0,2,0,0,0,0|1,0,1]=4 899 B11R1.23 N[C@H](CO)C1=CC=CC(Cl)=C1 AC020501 [0,2,0,0,0,0|1,0,1]=4 900 B11R1.222 C1=CC=C(C(=C1)[C@@H](CO)N)Cl LN02026918 [0,2,0,0,0,0|1,0,1]=4 901 B11R1.222 CCC(=O)C1=C(Cl)C=CC=C1 AC060049 [0,2,0,0,0,0|1,0,0]=3 902 B11R1.222 CNC(=O)C1=C(O)C=CC=C1 AC030031 [0,2,0,0,0,0|1,0,0]=3 903 B11R1.222 COC(=O)C1=C(Br)C=CC=N1 AC130237 [0,2,0,0,0,0|1,0,0]=3 904 B11R1.222 COC(=O)C1=C(F)N=CC=C1 AC181573 [0,2,0,0,0,0|1,0,0]=3 905 B11R1.222 COC(=O)C1=C(F)N=CC=C1 LN00171755 [0,2,0,0,0,0|1,0,0]=3 906 B11R1.222 COC(=O)C1=C(I)C=CC=C1 AC130757 [0,2,0,0,0,0|0,0,0]=2 907 B11R1.222 COC(=O)C1=C(N)C=NC=C1 AC181387 [0,2,0,0,0,0|1,0,0]=3 908 B11R1.222 COC(=O)C1=C(O)C=NC=C1 AC181065 [0,2,0,0,0,0|1,0,0]=3 909 B11R1.222 COC(=O)C1=C(O)N=CN=C1 AC181268 [0,2,0,0,0,0|2,0,0]=4 910 B11R1.222 COC(=O)C1=CC=CN=C1C AC180513 [0,2,0,0,0,0|1,0,0]=3 911 B11R1.222 COC(=O)C1=CC=CN=C1N AC021174 [0,2,0,0,0,0|1,0,0]=3 912 B11R1.222 COC(=O)C1=CC=NC=C1F AC160577 [0,2,0,0,0,0|1,0,0]=3 913 B11R1.222 COC(=O)C1=CN=CC=C1C AC182396 [0,2,0,0,0,0|1,0,0]=3 914 B11R1.222 COC(=O)C1=CN=CC=C1N AC170093 [0,2,0,0,0,0|1,0,0]=3 915 B11R1.222 COC(=O)C1=NC=CN=C1Br AC210044 [0,2,0,0,0,0|2,0,0]=4 916 B11R1.222 COC(=O)C1=NC=CN=C1N AC180244 [0,2,0,0,0,0|2,0,0]=4 917 B11R1.222 FC1=CC=CC=C1C(=O)CBr AC190234 [0,2,0,0,0,0|1,0,0]=3 918 B11R1.222 NNC(=O)C1=CC=CC=C1O AC190220 [0,2,0,0,0,0|1,0,0]=3 919 B11R1.87 CC1=CC=CC=C1S(O)(=O)=O AC180434 [0,2,0,0,0,0|1,0,0]=3 920 B11R1.87 CP(C)(=O)C1=CC=CC=C1N AC511962 [0,2,0,0,0,0|2,0,0]=4 921 B11R1.87 NS(=O)(=O)C1=CC=CC=C1F AC510719 [0,2,0,0,0,0|1,0,1]=4 922 B11R1.155 ClS(=O)(=O)C1=CC(Br)=CC=C1 AC500083 [0,2,0,0,0,0|1,0,1]=4 923 B11R1.155 FC1=CC=CC(=C1)S(Cl)(=O)=O AC190267 [0,2,0,0,0,0|1,0,1]=4 924 B11R1.155 NS(=O)(=O)C1=CC=CC(Br)=C1 AC190294 [0,2,0,0,0,0|1,0,1]=4 925 B11R1.53 C=CC1=CC=CC=C1B(O)O LN00227200 [0,2,0,0,0,0|1,0,1]=4 926 B11R1.53 CC(=O)C1=CC=CC=C1C#N AC511890 [0,2,0,0,0,0|1,0,0]=3 927 B11R1.53 CCC1=C(C=CC=N1)C(=O)O LN00337936 [0,2,0,0,0,0|1,0,0]=3 928 B11R1.53 CCC1=CC=CC=C1C(O)=O AC220178 [0,2,0,0,0,0|0,0,0]=2 929 B11R1.53 COC1=C(C=CC=C1)B(O)O AC180960 [0,2,0,0,0,0|1,0,1]=4 930 B11R1.53 COC1=C(C=CN=C1)C(O)=O AC182097 [0,2,0,0,0,0|1,0,0]=3 931 B11R1.53 COC1=NC=CC=C1C(O)=O AC512049 [0,2,0,0,0,0|1,0,0]=3 932 B11R1.53 COC1=NC=CN=C1C(O)=O AC512126 [0,2,0,0,0,0|2,0,0]=4 933 B11R1.53 CSC1=C(C=CC=C1)B(O)O AC090083 [0,2,0,0,0,0|1,0,1]=4 934 B11R1.53 NNC1=CC=CC=C1[N+]([O-])=O AC180549 [0,2,0,0,0,0|1,0,1]=4 935 B11R1.53 OB(O)C1=C(C=O)C=CC=C1 AC500080 [0,2,0,0,0,0|1,0,1]=4 936 B11R1.53 OB(O)C1=CC=CC=C1C#N AC070097 [0,2,0,0,0,0|1,0,1]=4 937 B11R1.53 OB(O)C1=CC=CC=C1CBr AC090241 [0,2,0,0,0,0|1,0,1]=4 938 B11R1.53 OC(=O)C1=C(C=O)C=CC=C1 AC180060 [0,2,0,0,0,0|0,0,0]=2 939 B11R1.53 OCC1=C(C=CC=C1)[N+]([O-])=O AC511759 [0,2,0,0,0,0|1,0,1]=4 940 B11R1.53 OCC1=CC=CC=C1B(O)O AC090231 [0,2,0,0,0,0|1,0,1]=4 941 B11R1.53 [O-][N+](=O)C1=CC=CC=C1C=O AC510835 [0,2,0,0,0,0|1,0,1]=4 942 B11R1.53 [O-][N+](=O)C1=CC=CC=C1CBr AC180199 [0,2,0,0,0,0|1,0,1]=4 943 B11R1.156 C1=CC(=C(C(=C1)I)C(=O)O)Br LN01103640 [0,2,0,0,0,0|0,0,0]=2 944 B11R1.156 CC(=O)C1=C(F)C=CC=C1F AC180004 [0,2,0,0,0,0|1,0,0]=3 945 B11R1.156 CC1=C(C(=CC=C1)C)B(O)O LN00140465 [0,2,0,0,0,0|1,0,1]=4 946 B11R1.156 CC1=C(C(=CC=C1)C)C(=O)O LN00180777 [0,2,0,0,0,0|0,0,0]=2 947 B11R1.156 CC1=C(C(O)=O)C(Br)=CC=C1 AC510997 [0,2,0,0,0,0|0,0,0]=2 948 B11R1.156 CC1=C(C(O)=O)C(Cl)=CC=C1 AC180479 [0,2,0,0,0,0|0,0,0]=2 949 B11R1.156 CC1=CC=CC(C)=C1B(O)O AC181162 [0,2,0,0,0,0|1,0,1]=4 950 B11R1.156 CC1=CC=CC(Cl)=C1[N+]([O-])=O AC181852 [0,2,0,0,0,0|1,0,1]=4 951 B11R1.156 CC1=CC=CC(N)=C1C(O)=O AC180216 [0,2,0,0,0,0|0,0,0]=2 952 B11R1.156 CC1=CC=CC(O)=C1C(O)=O AC181197 [0,2,0,0,0,0|0,0,0]=2 953 B11R1.156 NC1=C(C(O)=O)C(Cl)=CC=C1 AC180503 [0,2,0,0,0,0|0,0,0]=2 954 B11R1.156 NC1=CC=CC(Br)=C1C(O)=O AC181693 [0,2,0,0,0,0|0,0,0]=2 955 B11R1.156 NC1=CC=CC(F)=C1C(O)=O AC130111 [0,2,0,0,0,0|0,0,0]=2 956 B11R1.156 NC1=CC=CC(F)=C1[N+]([O-])=O AC130183 [0,2,0,0,0,0|1,0,1]=4 957 B11R1.156 OB(O)C1=C(Cl)C=CC=C1Cl AC090198 [0,2,0,0,0,0|1,0,1]=4 958 B11R1.156 OC(=O)C1=C(Cl)C=NC=C1Cl AC510651 [0,2,0,0,0,0|1,0,0]=3 959 B11R1.156 OC(=O)C1=C(Cl)N=CC=C1Cl AC130184 [0,2,0,0,0,0|1,0,0]=3 960 B11R1.156 OC(=O)C1=C(Cl)N=CC=C1F AC131137 [0,2,0,0,0,0|1,0,0]=3 961 B11R1.156 OC(=O)C1=C(Cl)N=CC=C1I AC190122 [0,2,0,0,0,0|1,0,0]=3 962 B11R1.156 OC(=O)C1=C(F)C=CC=C1Br AC181254 [0,2,0,0,0,0|0,0,0]=2 963 B11R1.156 OC(=O)C1=C(F)C=CC=C1F AC020998 [0,2,0,0,0,0|0,0,0]=2 964 B11R1.156 OC(=O)C1=C(F)C=NC=C1F AC512102 [0,2,0,0,0,0|1,0,0]=3 965 B11R1.156 OC(=O)C1=C(O)C=CC=C1F AC511776 [0,2,0,0,0,0|0,0,0]=2 966 B11R1.156 OC1=CC=CC(O)=C1[N+]([O-])=O AC511751 [0,2,0,0,0,0|1,0,1]=4 967 B11R1.156 [O-][N+](=O)C1=C(Cl)C=CC=C1F AC181993 [0,2,0,0,0,0|1,0,1]=4 968 B11R1.156 [O-][N+](=O)C1=C(F)C=CC=C1Br AC511218 [0,2,0,0,0,0|1,0,1]=4 969 B11R1.156 [O-][N+](=O)C1=C(F)C=CC=C1F AC180865 [0,2,0,0,0,0|1,0,1]=4 970 B11R1.159 C1=CC(=C(C(=C1)Cl)Br)C(=O)O LN00204324 [0,2,0,0,0,0|0,0,0]=2 971 B11R1.159 C1=CC(=C(C(=C1)F)Br)C(=O)O LN01316525 [0,2,0,0,0,0|0,0,0]=2 972 B11R1.159 C1=CC(=C(C(=C1)F)F)B(O)O LN00117880 [0,2,0,0,0,0|1,0,1]=4 973 B11R1.159 CC(=O)C1=C(O)C(Br)=CC=C1 AC182239 [0,2,0,0,0,0|1,0,0]=3 974 B11R1.159 CC1=C(Br)C=CC=C1C(O)=O AC130042 [0,2,0,0,0,0|0,0,0]=2 975 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)I LN00116621 [0,2,0,0,0,0|0,0,0]=2 976 B11R1.159 CC1=C(C=CC=C1Cl)C(O)=O AC180528 [0,2,0,0,0,0|0,0,0]=2 977 B11R1.159 CC1=C(C=CC=C1F)C(O)=O AC510933 [0,2,0,0,0,0|0,0,0]=2 978 B11R1.159 CC1=C(Cl)C(=CC=C1)[N+]([O-])=O AC180745 [0,2,0,0,0,0|1,0,1]=4 979 B11R1.159 CC1=C(Cl)C=CC=C1B(O)O AC090131 [0,2,0,0,0,0|1,0,1]=4 980 B11R1.159 CC1=C(I)C(=CC=C1)C(O)=O AC510630 [0,2,0,0,0,0|0,0,0]=2 981 B11R1.159 CC1=C(N)C(=CC=C1)[N+]([O-])=O AC510582 [0,2,0,0,0,0|1,0,1]=4 982 B11R1.159 CC1=C(N)C=CC=C1[N+]([O-])=O AC020807 [0,2,0,0,0,0|1,0,1]=4 983 B11R1.159 CC1=C(O)C(=CC=C1)C(O)=O HY-B1399 [0,2,0,0,0,0|0,0,0]=2 984 B11R1.159 CC1=CC=CC(=C1Br)[N+]([O-])=O AC180743 [0,2,0,0,0,0|1,0,1]=4 985 B11R1.159 CC1=CC=CC(=C1F)[N+]([O-])=O AC181634 [0,2,0,0,0,0|1,0,1]=4 986 B11R1.159 CC1=CC=CC(=C1O)[N+]([O-])=O AC180392 [0,2,0,0,0,0|1,0,1]=4 987 B11R1.159 CC1=CC=CC(C(O)=O)=C1Br AC510821 [0,2,0,0,0,0|0,0,0]=2 988 B11R1.159 CC1=CC=CC(C(O)=O)=C1C AC021104 [0,2,0,0,0,0|0,0,0]=2 989 B11R1.159 CC1=CC=CC(C(O)=O)=C1N AC511696 [0,2,0,0,0,0|0,0,0]=2 990 B11R1.159 NC1=C(Br)C=CC=C1C(O)=O AC181691 [0,2,0,0,0,0|0,0,0]=2 991 B11R1.159 NC1=C(C=CC=C1Cl)C(O)=O AC180742 [0,2,0,0,0,0|0,0,0]=2 992 B11R1.159 NC1=C(Cl)C(=CC=C1)[N+]([O-])=O AC050166 [0,2,0,0,0,0|1,0,1]=4 993 B11R1.159 NC1=C(F)C=CC=C1C(O)=O AC181251 [0,2,0,0,0,0|0,0,0]=2 994 B11R1.159 NC1=C(F)C=CC=C1[N+]([O-])=O AC181791 [0,2,0,0,0,0|1,0,1]=4 995 B11R1.159 NC1=C(O)C=CC=C1C(O)=O AC130201 [0,2,0,0,0,0|0,0,0]=2 996 B11R1.159 NC1=C(O)C=CC=C1[N+]([O-])=O AC510866 [0,2,0,0,0,0|1,0,1]=4 997 B11R1.159 OB(O)C1=C(Cl)C(Cl)=CC=C1 AC181183 [0,2,0,0,0,0|1,0,1]=4 998 B11R1.159 OB(O)C1=C(F)C(O)=CC=C1 AC090010 [0,2,0,0,0,0|1,0,1]=4 999 B11R1.159 OB(O)C1=CC=CC(F)=C1Cl AC511813 [0,2,0,0,0,0|1,0,1]=4 1000 B11R1.159 OC(=O)C1=C(Br)C(F)=CC=C1 AC130173 [0,2,0,0,0,0|0,0,0]=2 1001 B11R1.159 OC(=O)C1=C(Cl)C(Cl)=NC=C1 AC181344 [0,2,0,0,0,0|1,0,0]=3 1002 B11R1.159 OC(=O)C1=C(F)C(Cl)=NC=C1 AC181762 [0,2,0,0,0,0|1,0,0]=3 1003 B11R1.159 OC(=O)C1=CC=CC(Br)=C1O AC511188 [0,2,0,0,0,0|0,0,0]=2 1004 B11R1.159 OC(=O)C1=CC=NC(Br)=C1F AC182721 [0,2,0,0,0,0|1,0,0]=3 1005 B11R1.159 OC1=CC=CC(=C1Cl)[N+]([O-])=O AC020526 [0,2,0,0,0,0|1,0,1]=4 1006 B11R1.159 [O-][N+](=O)C1=CC=CC(F)=C1F AC181013 [0,2,0,0,0,0|1,0,1]=4 1007 B11R1.167 C1=C(C=NC(=C1C(=O)O)N)Br LN00008839 [0,2,0,0,0,0|1,0,0]=3 1008 B11R1.167 C1=CC(=C(C=C1F)C(=O)O)Br LN00008719 [0,2,0,0,0,0|0,0,0]=2 1009 B11R1.167 C1=CC(=C(C=C1I)C(=O)O)Cl LN00007888 [0,2,0,0,0,0|0,0,0]=2 1010 B11R1.167 CC(=O)C1=C(Cl)C=CC(F)=C1 AC180460 [0,2,0,0,0,0|1,0,0]=3 1011 B11R1.167 CC(=O)C1=C(F)C=CC(Br)=N1 AC050927 [0,2,0,0,0,0|2,0,0]=4 1012 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 AC130204 [0,2,0,0,0,0|1,0,0]=3 1013 B11R1.167 CC(=O)C1=CC(Br)=CC=C1F AC182638 [0,2,0,0,0,0|1,0,0]=3 1014 B11R1.167 CC(=O)C1=CC(Br)=CC=C1N AC511145 [0,2,0,0,0,0|1,0,0]=3 1015 B11R1.167 CC(=O)C1=CC(Br)=CC=C1O AC510656 [0,2,0,0,0,0|1,0,0]=3 1016 B11R1.167 CC(=O)C1=CC(Cl)=CC=C1Cl AC020882 [0,2,0,0,0,0|1,0,0]=3 1017 B11R1.167 CC(=O)C1=CC(F)=CC=C1O AC510745 [0,2,0,0,0,0|1,0,0]=3 1018 B11R1.167 CC1=C(C=C(C=C1)Br)[N+](=O)[O-] LN00174237 [0,2,0,0,0,0|1,0,1]=4 1019 B11R1.167 CC1=C(C=C(I)C=C1)C(O)=O AC181258 [0,2,0,0,0,0|0,0,0]=2 1020 B11R1.167 CC1=C(C=C(N)C=C1)C(O)=O AC181945 [0,2,0,0,0,0|0,0,0]=2 1021 B11R1.167 CC1=C(C=C(O)C=C1)[N+]([O-])=O AC180200 [0,2,0,0,0,0|1,0,1]=4 1022 B11R1.167 CC1=CC(=C(C=C1)I)C(=O)O LN00117409 [0,2,0,0,0,0|0,0,0]=2 1023 B11R1.167 CC1=CC(=C(C=C1)O)B(O)O LN02136315 [0,2,0,0,0,0|1,0,1]=4 1024 B11R1.167 CC1=CC(=C(I)C=C1)[N+]([O-])=O AC180379 [0,2,0,0,0,0|1,0,1]=4 1025 B11R1.167 CC1=CC(B(O)O)=C(O)C=C1 AC100052 [0,2,0,0,0,0|1,0,1]=4 1026 B11R1.167 CC1=CC=C(Br)C=C1C(O)=O AC511799 [0,2,0,0,0,0|0,0,0]=2 1027 B11R1.167 CC1=CC=C(C)C(=C1)B(O)O AC190064 [0,2,0,0,0,0|1,0,1]=4 1028 B11R1.167 CC1=CC=C(Cl)C(=C1)C(O)=O AC511767 [0,2,0,0,0,0|0,0,0]=2 1029 B11R1.167 CC1=CC=C(Cl)C=C1B(O)O AC090069 [0,2,0,0,0,0|1,0,1]=4 1030 B11R1.167 CC1=CC=C(Cl)N=C1C(O)=O AC050269 [0,2,0,0,0,0|1,0,0]=3 1031 B11R1.167 CC1=CC=C(F)C(=C1)[N+]([O-])=O AC180189 [0,2,0,0,0,0|1,0,1]=4 1032 B11R1.167 CC1=CC=C(I)C=C1[N+]([O-])=O AC180498 [0,2,0,0,0,0|1,0,1]=4 1033 B11R1.167 CC1=CC=C(N)C(=C1)C(O)=O AC180220 [0,2,0,0,0,0|0,0,0]=2 1034 B11R1.167 NC(=N)C1=C(F)C=CC(F)=C1 AC190144 [0,2,0,0,0,0|2,0,0]=4 1035 B11R1.167 NC(=O)C1=C(Cl)N=CC(Cl)=C1 AC180875 [0,2,0,0,0,0|2,0,0]=4 1036 B11R1.167 NC(=O)C1=C(N)N=CC(Br)=C1 AC050591 [0,2,0,0,0,0|2,0,0]=4 1037 B11R1.167 NC1=C(C=C(Br)C=C1)C(O)=O AC510850 [0,2,0,0,0,0|0,0,0]=2 1038 B11R1.167 NC1=C(C=C(Br)C=C1)[N+]([O-])=O AC510988 [0,2,0,0,0,0|1,0,1]=4 1039 B11R1.167 NC1=C(C=C(Br)C=N1)C(O)=O AC181326 [0,2,0,0,0,0|1,0,0]=3 1040 B11R1.167 NC1=C(C=C(F)C=C1)C(O)=O AC512093 [0,2,0,0,0,0|0,0,0]=2 1041 B11R1.167 NC1=C(C=C(I)C=C1)C(O)=O AC180218 [0,2,0,0,0,0|0,0,0]=2 1042 B11R1.167 NC1=C(C=C(O)C=C1)C(O)=O AC180219 [0,2,0,0,0,0|0,0,0]=2 1043 B11R1.167 NC1=CC(C(O)=O)=C(O)C=C1 HY-15027 [0,2,0,0,0,0|0,0,0]=2 1044 B11R1.167 NC1=CC=C(Cl)N=C1C(O)=O AC182417 [0,2,0,0,0,0|1,0,0]=3 1045 B11R1.167 NC1=CC=C(O)C=C1[N+]([O-])=O AC130220 [0,2,0,0,0,0|1,0,1]=4 1046 B11R1.167 NC1=CN=C(Cl)C=C1C(O)=O AC511065 [0,2,0,0,0,0|1,0,0]=3 1047 B11R1.167 NC1=NC=C(Br)C(=C1)C(O)=O AC182498 [0,2,0,0,0,0|1,0,0]=3 1048 B11R1.167 NC1=NC=C(Br)N=C1C(O)=O AC511230 [0,2,0,0,0,0|2,0,0]=4 1049 B11R1.167 OB(O)C1=CC(Cl)=CC=C1Cl AC090054 [0,2,0,0,0,0|1,0,1]=4 1050 B11R1.167 OB(O)C1=CC(Cl)=CC=C1F AC181905 [0,2,0,0,0,0|1,0,1]=4 1051 B11R1.167 OC(=O)C1=C(Br)C=CC(O)=C1 AC512094 [0,2,0,0,0,0|0,0,0]=2 1052 B11R1.167 OC(=O)C1=C(Br)N=CC(Cl)=C1 AC182442 [0,2,0,0,0,0|1,0,0]=3 1053 B11R1.167 OC(=O)C1=C(Cl)C=CC(F)=C1 AC180797 [0,2,0,0,0,0|0,0,0]=2 1054 B11R1.167 OC(=O)C1=C(Cl)C=NC(Br)=C1 AC050570 [0,2,0,0,0,0|1,0,0]=3 1055 B11R1.167 OC(=O)C1=C(Cl)N=CC(F)=C1 AC500330 [0,2,0,0,0,0|1,0,0]=3 1056 B11R1.167 OC(=O)C1=C(F)N=CC(Br)=C1 AC182057 [0,2,0,0,0,0|1,0,0]=3 1057 B11R1.167 OC(=O)C1=C(O)C=CC(O)=C1 AC130216 [0,2,0,0,0,0|0,0,0]=2 1058 B11R1.167 OC(=O)C1=CC(Br)=CC=C1Br AC180318 [0,2,0,0,0,0|0,0,0]=2 1059 B11R1.167 OC(=O)C1=CC(Br)=CC=C1Cl AC511599 [0,2,0,0,0,0|0,0,0]=2 1060 B11R1.167 OC(=O)C1=CC(Br)=CC=C1I AC180644 [0,2,0,0,0,0|0,0,0]=2 1061 B11R1.167 OC(=O)C1=CC(Br)=CN=C1Cl AC181748 [0,2,0,0,0,0|1,0,0]=3 1062 B11R1.167 OC(=O)C1=CC(Br)=CN=C1O AC020330 [0,2,0,0,0,0|1,0,0]=3 1063 B11R1.167 OC(=O)C1=CC(Br)=NC=C1F AC040200 [0,2,0,0,0,0|1,0,0]=3 1064 B11R1.167 OC(=O)C1=CC(Cl)=CC=C1F AC181071 [0,2,0,0,0,0|0,0,0]=2 1065 B11R1.167 OC(=O)C1=CC(Cl)=CC=C1O AC500101 [0,2,0,0,0,0|0,0,0]=2 1066 B11R1.167 OC(=O)C1=CC(Cl)=CN=C1Cl AC181345 [0,2,0,0,0,0|1,0,0]=3 1067 B11R1.167 OC(=O)C1=CC(Cl)=CN=C1O AC180874 [0,2,0,0,0,0|1,0,0]=3 1068 B11R1.167 OC(=O)C1=CC(Cl)=NC=C1Cl AC181039 [0,2,0,0,0,0|1,0,0]=3 1069 B11R1.167 OC(=O)C1=CC(Cl)=NC=C1F AC181864 [0,2,0,0,0,0|1,0,0]=3 1070 B11R1.167 OC(=O)C1=CC(Cl)=NN=C1Cl AC130163 [0,2,0,0,0,0|2,0,0]=4 1071 B11R1.167 OC(=O)C1=CC(I)=CC=C1Br AC180643 [0,2,0,0,0,0|0,0,0]=2 1072 B11R1.167 OC(=O)C1=CC(I)=CC=C1Cl AC180645 [0,2,0,0,0,0|0,0,0]=2 1073 B11R1.167 OC(=O)C1=CC(I)=CC=C1F AC500186 [0,2,0,0,0,0|0,0,0]=2 1074 B11R1.167 OC(=O)C1=NC(Cl)=CC=C1F AC512028 [0,2,0,0,0,0|1,0,0]=3 1075 B11R1.167 OC1=C(C=C(Br)C=C1)[N+]([O-])=O AC511791 [0,2,0,0,0,0|1,0,1]=4 1076 B11R1.167 OC1=CC=C(Br)C(=C1)[N+]([O-])=O AC511874 [0,2,0,0,0,0|1,0,1]=4 1077 B11R1.167 OC1=CC=C(F)C(=C1)[N+]([O-])=O AC511186 [0,2,0,0,0,0|1,0,1]=4 1078 B11R1.167 [O-][N+](=O)C1=C(Br)C=CC(Br)=C1 AC180187 [0,2,0,0,0,0|1,0,1]=4 1079 B11R1.167 [O-][N+](=O)C1=C(F)C=CC(Cl)=C1 AC512044 [0,2,0,0,0,0|1,0,1]=4 1080 B11R1.167 [O-][N+](=O)C1=CC(Br)=CC=C1F AC130117 [0,2,0,0,0,0|1,0,1]=4 1081 B11R1.167 [O-][N+](=O)C1=CC(Cl)=CC=C1Br AC180381 [0,2,0,0,0,0|1,0,1]=4 1082 B11R1.167 [O-][N+](=O)C1=CC(F)=CC=C1Br AC180538 [0,2,0,0,0,0|1,0,1]=4 1083 B11R1.167 [O-][N+](=O)C1=CC(F)=CC=C1Cl AC180658 [0,2,0,0,0,0|1,0,1]=4 1084 B11R1.167 [O-][N+](=O)C1=CC(F)=CC=C1F AC511680 [0,2,0,0,0,0|1,0,1]=4 1085 B11R1.74 C1=C(C=C(C=C1Cl)Cl)B(O)O LN00116565 [0,2,0,0,0,0|1,0,1]=4 1086 B11R1.74 C1=C(C=C(C=C1F)F)C(=O)O LN00116557 [0,2,0,0,0,0|0,0,0]=2 1087 B11R1.74 CC(=O)C1=CC(=CC(=C1)F)F LN00117061 [0,2,0,0,0,0|1,0,0]=3 1088 B11R1.74 CC(=O)C1=CC(Br)=CC(Br)=C1 AC180640 [0,2,0,0,0,0|1,0,0]=3 1089 B11R1.74 CC(=O)C1=CC(C)=CC(C)=C1 AC310106 [0,2,0,0,0,0|1,0,0]=3 1090 B11R1.74 CC1=CC(=CC(C)=C1)B(O)O AC090089 [0,2,0,0,0,0|1,0,1]=4 1091 B11R1.74 CC1=CC(=CC(Cl)=N1)C(O)=O AC180520 [0,2,0,0,0,0|1,0,0]=3 1092 B11R1.74 CC1=CC(=NC(Cl)=C1)C(O)=O AC512065 [0,2,0,0,0,0|1,0,0]=3 1093 B11R1.74 CC1=CC(Br)=CC(=C1)B(O)O AC090215 [0,2,0,0,0,0|1,0,1]=4 1094 B11R1.74 CC1=CC(Cl)=CC(=C1)C(O)=O AC182586 [0,2,0,0,0,0|0,0,0]=2 1095 B11R1.74 CC1=CC(F)=CC(=C1)C(O)=O AC181548 [0,2,0,0,0,0|0,0,0]=2 1096 B11R1.74 CC1=CC(N)=CC(=C1)[N+]([O-])=O AC511998 [0,2,0,0,0,0|1,0,1]=4 1097 B11R1.74 NC1=CC(=CC(O)=C1)C(O)=O AC180469 [0,2,0,0,0,0|0,0,0]=2 1098 B11R1.74 NC1=CC(Br)=CC(=C1)C(O)=O AC180910 [0,2,0,0,0,0|0,0,0]=2 1099 B11R1.74 OB(O)C1=CC(Br)=CC(Br)=C1 AC090043 [0,2,0,0,0,0|1,0,1]=4 1100 B11R1.74 OB(O)C1=CC(Cl)=CC(Cl)=C1 AC180511 [0,2,0,0,0,0|1,0,1]=4 1101 B11R1.74 OB(O)C1=CC(F)=CC(Cl)=C1 AC182065 [0,2,0,0,0,0|1,0,1]=4 1102 B11R1.74 OB(O)C1=CC(F)=CC(F)=C1 AC130099 [0,2,0,0,0,0|1,0,1]=4 1103 B11R1.74 OB(O)C1=CC(O)=CC(F)=C1 AC090230 [0,2,0,0,0,0|1,0,1]=4 1104 B11R1.74 OC(=O)C1=CC(=O)NC(=O)N1 HY-N0157 [0,2,0,0,0,0|2,0,0]=4 1105 B11R1.74 OC(=O)C1=CC(Br)=CC(Cl)=C1 AC511869 [0,2,0,0,0,0|0,0,0]=2 1106 B11R1.74 OC(=O)C1=CC(Br)=CC(F)=C1 AC181255 [0,2,0,0,0,0|0,0,0]=2 1107 B11R1.74 OC(=O)C1=CC(Br)=NC(Br)=C1 AC182443 [0,2,0,0,0,0|1,0,0]=3 1108 B11R1.74 OC(=O)C1=CC(Cl)=CC(Cl)=C1 AC180042 [0,2,0,0,0,0|0,0,0]=2 1109 B11R1.74 OC(=O)C1=CC(F)=CC(F)=C1 AC510561 [0,2,0,0,0,0|0,0,0]=2 1110 B11R1.74 OC(=O)C1=NC(Cl)=CC(Cl)=C1 AC512109 [0,2,0,0,0,0|1,0,0]=3 1111 B11R1.74 OC1=CC(Br)=CC(=C1)[N+]([O-])=O AC512002 [0,2,0,0,0,0|1,0,1]=4 1112 B11R1.74 [O-][N+](=O)C1=CC(Br)=CC(Br)=C1 AC130059 [0,2,0,0,0,0|1,0,1]=4 1113 B11R1.266 C#CC1=CC(=CC=C1)[N+](=O)[O-] LN00173713 [0,2,0,0,0,0|1,0,1]=4 1114 B11R1.266 C1=CC(=CC(=C1)C(=O)O)C#N LN00180819 [0,2,0,0,0,0|0,0,0]=2 1115 B11R1.266 C1=CC(=CC(=C1)[N+](=O)[O-])CN LN00010824 [0,2,0,0,0,0|1,0,1]=4 1116 B11R1.266 CC(=O)C1=CC(=CC=C1)C#N AC250032 [0,2,0,0,0,0|1,0,0]=3 1117 B11R1.266 COC1=CC(=CC=C1)C(N)=N AC181812 [0,2,0,0,0,0|2,0,0]=4 1118 B11R1.266 COC1=CC(=CN=C1)C(O)=O AC160339 [0,2,0,0,0,0|1,0,0]=3 1119 B11R1.266 COC1=CC(=NC=C1)C(O)=O AC511198 [0,2,0,0,0,0|1,0,0]=3 1120 B11R1.266 COC1=CC=CC(=C1)B(O)O AC090036 [0,2,0,0,0,0|1,0,1]=4 1121 B11R1.266 COC1=CC=CC(=C1)C(O)=O AC180043 [0,2,0,0,0,0|0,0,0]=2 1122 B11R1.266 COC1=CC=CC(=N1)C(=O)O LN00222703 [0,2,0,0,0,0|1,0,0]=3 1123 B11R1.266 COC1=CC=CC(=N1)C(O)=O AC182063 [0,2,0,0,0,0|1,0,0]=3 1124 B11R1.266 CSC1=CC(=CC=C1)B(O)O AC090049 [0,2,0,0,0,0|1,0,1]=4 1125 B11R1.266 CSC1=NC=CC(=N1)C(O)=O AC182479 [0,2,0,0,0,0|2,0,0]=4 1126 B11R1.266 NC(=O)C1=NC(CO)=CC=C1 AC200020 [0,2,0,0,0,0|2,0,0]=4 1127 B11R1.266 NCC1=CC(=CC=C1)C(O)=O AC170057 [0,2,0,0,0,0|0,0,0]=2 1128 B11R1.266 OB(O)C1=CC(=CC=C1)C#N AC500108 [0,2,0,0,0,0|1,0,1]=4 1129 B11R1.266 OB(O)C1=CC(C=O)=CC=C1 AC180811 [0,2,0,0,0,0|1,0,1]=4 1130 B11R1.266 OC(=O)C1=CC(=CC=C1)C#N AC180040 [0,2,0,0,0,0|0,0,0]=2 1131 B11R1.266 OC(=O)C1=CC(C=O)=CC=C1 AC160494 [0,2,0,0,0,0|0,0,0]=2 1132 B11R1.266 OC(=O)C1=CC=CC(CBr)=C1 AC511772 [0,2,0,0,0,0|0,0,0]=2 1133 B11R1.266 OCC1=CC=CC(=C1)B(O)O AC500088 [0,2,0,0,0,0|1,0,1]=4 1134 B11R1.266 [O-][N+](=O)C1=CC(=CC=C1)C#C AC220180 [0,2,0,0,0,0|1,0,1]=4 1135 B11R1.266 [O-][N+](=O)C1=CC=CC(C=O)=C1 AC511821 [0,2,0,0,0,0|1,0,1]=4 1136 B11R1.266 [O-][N+](=O)C1=CC=CC(CBr)=C1 AC510747 [0,2,0,0,0,0|1,0,1]=4 1137 B9R1.13 OC(=O)CC1=CC=CS1 AC130136 [0,0,1,1,0,0|1,0,1]=4 1138 B9R1.13 OC(=O)CC1=CSC=C1 AC130133 [0,0,1,1,0,0|1,0,1]=4 1139 B11R2.10 BrC1=CC2=C(C1)C=CC=C2 AC182055 [0,0,0,1,0,1|2,0,0]=4 1140 B11R2.10 BrC1=NC2=CC=CC=C2N1 AC060010 [0,0,0,1,0,1|2,0,0]=4 1141 B11R2.10 BrC1=NC2=CC=CC=C2S1 AC511041 [0,0,0,1,0,1|1,1,0]=4 1142 B11R2.10 CC1=CC2=C(N1)C=CC=C2 AC511008 [0,0,0,1,0,1|2,0,0]=4 1143 B11R2.10 NC1=NC2=C(N1)C=CC=C2 AC190065 [0,0,0,1,0,1|2,0,0]=4 1144 B11R2.10 NC1=NC2=CC=CC=C2O1 AC510780 [0,0,0,1,0,1|1,0,0]=3 1145 B11R2.10 O=C1CC2=C(N1)C=CC=C2 AC021698 [0,0,0,1,0,1|1,0,0]=3 1146 B11R2.10 O=C1CC2=C(O1)C=CC=C2 AC021054 [0,0,0,1,0,1|0,0,0]=2 1147 B11R2.10 O=C1NC2=CC=CN=C2N1 AC181035 [0,0,0,1,0,1|2,0,0]=4 1148 B11R2.10 OC1=NN2C=CC=CC2=C1 AC051002 [0,0,0,1,0,1|2,0,0]=4 1149 B11R2.10 OC1CC2=C(C1)C=CC=C2 AC511852 [0,0,0,1,0,1|1,0,1]=4 1150 B11R2.10 SC1=NC2=CC=CC=C2S1 AC510659 [0,0,0,1,0,1|0,2,0]=4 1151 B11R2.1 BrC1=NNC2=C1C=CC=C2 AC510758 [0,1,0,1,0,0|2,0,0]=4 1152 B11R2.1 CC1=CNC2=C1C=CC=C2 AC500066 [0,1,0,1,0,0|2,0,0]=4 1153 B11R2.1 IC1=NNC2=C1C=CC=C2 AC181868 [0,1,0,1,0,0|2,0,0]=4 1154 B11R2.1 NC1=NNC2=C1C=CC=C2 AC180839 [0,1,0,1,0,0|2,0,0]=4 1155 B11R2.1 O=C1CCC2=C1C=CC=C2 AC220153 [0,1,0,1,0,0|1,0,0]=3 1156 B11R2.1 O=C1CCC2=CC=CN=C12 AC182161 [0,1,0,1,0,0|2,0,0]=4 1157 B11R2.1 O=C1CCC2=NC=CC=C12 AC511871 [0,1,0,1,0,0|2,0,0]=4 1158 B11R2.1 O=C1COC2=C1C=CC=C2 AC130193 [0,1,0,1,0,0|0,0,0]=2 1159 B11R2.1 O=C1CSC2=CC=CC=C12 AC182209 [0,1,0,1,0,0|0,1,0]=3 1160 B11R2.1 O=C1NCC2=CC=CC=C12 AC511115 [0,1,0,1,0,0|1,0,0]=3 1161 B11R2.1 ON1N=NC2=C1C=CC=C2 AC131609 [0,1,0,1,0,0|2,0,0]=4 1162 B7R1.1 C1=CC=C([CH-]1)CO LN02135120 [1,0,0,0,1,0|0,0,2]=4 1163 B7R1.1 C1=CNC(=C1)C=O LN00008368 [1,0,0,0,1,0|1,0,0]=3 1164 B7R1.1 O=CC1=CC=CN1 AC180090 [1,0,0,0,1,0|1,0,0]=3 1165 B7R1.1 O=CC1=CC=CS1 AC511013 [1,0,0,0,1,0|1,0,0]=3 1166 B7R1.1 O=CC1=CN=CO1 AC051098 [1,0,0,0,1,0|2,0,0]=4 1167 B7R1.1 O=CC1=CN=CS1 AC181432 [1,0,0,0,1,0|2,0,0]=4 1168 B7R1.1 O=CC1=CNC=C1 AC280042 [1,0,0,0,1,0|1,0,0]=3 1169 B7R1.1 O=CC1=CNC=N1 AC180818 [1,0,0,0,1,0|2,0,0]=4 1170 B7R1.1 O=CC1=CNN=C1 AC030123 [1,0,0,0,1,0|2,0,0]=4 1171 B7R1.1 O=CC1=CSC=C1 AC180098 [1,0,0,0,1,0|1,0,0]=3 1172 B7R1.1 O=CC1=CSC=N1 AC511667 [1,0,0,0,1,0|2,0,0]=4 1173 B7R1.1 O=CC1=NC=CS1 AC180755 [1,0,0,0,1,0|2,0,0]=4 1174 B7R1.1 O=CC1=NNC=C1 AC200098 [1,0,0,0,1,0|2,0,0]=4 1175 B7R1.1 OCC1=COC=C1 AC510770 [1,0,0,0,1,0|1,0,1]=4 1176 B7R1.1 OCC1=CSC=C1 AC180309 [1,0,0,0,1,0|1,0,1]=4 1177 B11R1.91 C1=CC(=CN=C1)C=CC(=O)O LN02139389 [0,0,0,0,0,2|1,0,0]=3 1178 B11R1.91 C1=CC=C(C=C1)CCC(=N)O LN01357216 [0,0,0,0,0,2|1,0,0]=3 1179 B11R1.91 C1=CC=NC(=C1)C=CC(=O)O LN02138687 [0,0,0,0,0,2|1,0,0]=3 1180 B11R1.91 CC(=O)C#CC1=CC=CC=C1 AC270040 [0,0,0,0,0,2|1,0,0]=3 1181 B11R1.91 CC(O)COC1=CC=CC=C1 AC130345 [0,0,0,0,0,2|1,0,1]=4 1182 B11R1.91 NC(=O)OCC1=CC=CC=C1 AC511867 [0,0,0,0,0,2|1,0,0]=3 1183 B11R1.91 OB(O)CCC1=CC=CC=C1 AC090136 [0,0,0,0,0,2|1,0,1]=4 1184 B11R1.91 OC(=O)C#CC1=CC=CC=C1 AC500012 [0,0,0,0,0,2|0,0,0]=2 1185 B11R1.91 [O-][N+](=O)/C=C/C1=CC=CC=C1 AC510806 [0,0,0,0,0,2|1,0,1]=4