0 B10R1.61 C1=C(C(=CN=C1)Br)C(=O)O LN00009298 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.61 C1=CC(=C(C(=O)O)N=C1)F LN00173629 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.61 C1=CC(=C(F)N=C1)[N+](=O)[O-] LN00011353 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.61 C1=CC(=C(N)N=C1)[N+](=O)[O-] LN00010635 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.61 C1=CC=C(C(=C1)C(=N)O)Br LN00236317 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.61 C1=CC=C(C(=C1)C(=N)O)I LN00200183 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.61 C1=NC(=C(Cl)N=C1)C(=O)O LN00009177 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.61 C1=NC(=C(N=C1)O)C(=O)N LN00227281 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.61 CC(=O)C1=CC=CC=C1Br AC511597 [0,0,0,0,0,0|1,0,0]=1 9 B10R1.61 CC(=O)C1=CC=CC=C1Cl AC500259 [0,0,0,0,0,0|1,0,0]=1 10 B10R1.61 CC(=O)C1=CC=CC=C1I LN00159959 [0,0,0,0,0,0|1,0,0]=1 11 B10R1.61 CC(=O)C1=CC=CC=C1N AC180212 [0,0,0,0,0,0|0,0,0]=0 12 B10R1.61 CC(=O)C1=CC=CC=C1O AC510427 [0,0,0,0,0,0|1,0,0]=1 13 B10R1.61 CC(=O)C1=CC=CN=C1Cl AC181741 [0,0,0,0,0,0|2,0,0]=2 14 B10R1.61 CC(C)C1=C(N)N=CC=C1 AC010483 [0,0,0,0,0,0|2,0,1]=3 15 B10R1.61 CC1=C(C=CC=C1)B(O)O AC130310 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.61 CC1=C(C=CC=C1)C(O)=O AC511474 [0,0,0,0,0,0|2,0,0]=2 17 B10R1.61 CC1=C(C=CC=N1)[N+]([O-])=O AC181797 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.61 CC1=C(C=CN=C1)C(O)=O AC270034 [0,0,0,0,0,0|3,0,0]=3 19 B10R1.61 CC1=CC=CN=C1C(O)=O AC180861 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.61 CC1=CC=NC=C1C(O)=O AC180723 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.61 CC1=CC=NC=C1[N+]([O-])=O AC180510 [0,0,0,0,0,0|4,0,0]=4 22 B10R1.61 CC1=NC=CC=C1C(O)=O AC180300 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.61 CC1=NC=CN=C1C(O)=O AC182348 [0,0,0,0,0,0|4,0,0]=4 24 B10R1.61 CC1=NC=NC=C1C(O)=O AC050390 [0,0,0,0,0,0|4,0,0]=4 25 B10R1.61 CC1=NN=CC=C1C(O)=O AC050718 [0,0,0,0,0,0|4,0,0]=4 26 B10R1.61 CN(C)C1=CC=CC=C1N AC511923 [0,0,0,0,0,0|2,0,0]=2 27 B10R1.61 C[C@@H](O)C1=C(Cl)C=CC=C1 AC020783 [0,0,0,0,0,0|1,0,2]=3 28 B10R1.61 C[C@H](C1=CC=CC=C1Br)N LN02156247 [0,0,0,0,0,0|2,0,1]=3 29 B10R1.61 C[C@H](N)C1=CC=CC=C1F AC181536 [0,0,0,0,0,0|2,0,1]=3 30 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 AC020784 [0,0,0,0,0,0|1,0,2]=3 31 B10R1.61 C[C@H](O)C1=CC=CN=C1N AC020958 [0,0,0,0,0,0|1,0,2]=3 32 B10R1.61 FC(F)C1=CC=CC=C1Br AC010373 [0,0,0,0,0,0|3,0,1]=4 33 B10R1.61 NC(=O)C1=C(Br)C=NC=C1 AC182435 [0,0,0,0,0,0|3,0,0]=3 34 B10R1.61 NC(=O)C1=C(N)C=CC=C1 AC190185 [0,0,0,0,0,0|1,0,0]=1 35 B10R1.61 NC(=O)C1=C(N)C=NC=C1 AC511944 [0,0,0,0,0,0|2,0,0]=2 36 B10R1.61 NC(=O)C1=CC=CC=C1I AC190079 [0,0,0,0,0,0|2,0,0]=2 37 B10R1.61 NC(=O)C1=CC=CN=C1N AC180726 [0,0,0,0,0,0|2,0,0]=2 38 B10R1.61 NC(=O)C1=NC=CC=C1N AC181996 [0,0,0,0,0,0|2,0,0]=2 39 B10R1.61 NC(=O)C1=NC=CN=C1Cl AC182491 [0,0,0,0,0,0|4,0,0]=4 40 B10R1.61 NC(=O)C1=NC=CN=C1[O-] AC021296 [0,0,0,0,0,0|4,0,0]=4 41 B10R1.61 NC1=C(C=CC=C1)B(O)O AC090182 [0,0,0,0,0,0|2,0,1]=3 42 B10R1.61 NC1=C(C=CN=C1)C(O)=O AC180749 [0,0,0,0,0,0|2,0,0]=2 43 B10R1.61 NC1=C(C=NC=C1)C(O)=O AC180942 [0,0,0,0,0,0|2,0,0]=2 44 B10R1.61 NC1=C(C=NC=C1)[N+]([O-])=O AC180807 [0,0,0,0,0,0|3,0,0]=3 45 B10R1.61 NC1=CC=CC=C1B(O)O AC510975 [0,0,0,0,0,0|2,0,1]=3 46 B10R1.61 NC1=CC=CN=C1C(O)=O AC180670 [0,0,0,0,0,0|2,0,0]=2 47 B10R1.61 NC1=CC=CN=C1[N+]([O-])=O AC180471 [0,0,0,0,0,0|3,0,0]=3 48 B10R1.61 NC1=NC=CC=C1C(O)=O AC510818 [0,0,0,0,0,0|2,0,0]=2 49 B10R1.61 NC1=NC=CC=C1[N+]([O-])=O AC180153 [0,0,0,0,0,0|3,0,0]=3 50 B10R1.61 NC1=NN=CC=C1C(O)=O AC181217 [0,0,0,0,0,0|3,0,0]=3 51 B10R1.61 OB(O)C1=C(Cl)C=CC=C1 AC181084 [0,0,0,0,0,0|3,0,1]=4 52 B10R1.61 OB(O)C1=CC=CC=C1Br AC090122 [0,0,0,0,0,0|3,0,1]=4 53 B10R1.61 OB(O)C1=CC=CC=C1F AC130319 [0,0,0,0,0,0|3,0,1]=4 54 B10R1.61 OB(O)C1=CC=CC=C1O AC181170 [0,0,0,0,0,0|3,0,1]=4 55 B10R1.61 OC(=O)C1=C(Br)C=CC=C1 AC510993 [0,0,0,0,0,0|2,0,0]=2 56 B10R1.61 OC(=O)C1=C(Br)N=CC=C1 AC130049 [0,0,0,0,0,0|3,0,0]=3 57 B10R1.61 OC(=O)C1=C(Cl)C=NC=C1 AC181556 [0,0,0,0,0,0|3,0,0]=3 58 B10R1.61 OC(=O)C1=C(F)C=NC=C1 AC160422 [0,0,0,0,0,0|3,0,0]=3 59 B10R1.61 OC(=O)C1=C(I)C=CC=C1 AC180035 [0,0,0,0,0,0|2,0,0]=2 60 B10R1.61 OC(=O)C1=CC=CC=C1O HY-B0167 [0,0,0,0,0,0|2,0,0]=2 61 B10R1.61 OC(=O)C1=CC=CN=C1Cl AC511646 [0,0,0,0,0,0|3,0,0]=3 62 B10R1.61 OC(=O)C1=CC=CN=C1F AC130164 [0,0,0,0,0,0|3,0,0]=3 63 B10R1.61 OC(=O)C1=CC=NC=C1Br AC180440 [0,0,0,0,0,0|3,0,0]=3 64 B10R1.61 OC(=O)C1=CC=NC=C1O AC170008 [0,0,0,0,0,0|3,0,0]=3 65 B10R1.61 OC(=O)C1=CC=NNC1=O AC181972 [0,0,0,0,0,0|4,0,0]=4 66 B10R1.61 OC(=O)C1=CN=CC=C1Cl AC180720 [0,0,0,0,0,0|3,0,0]=3 67 B10R1.61 OC(=O)C1=NC=CC=C1Br AC181228 [0,0,0,0,0,0|3,0,0]=3 68 B10R1.61 OC(=O)C1=NC=CC=C1Cl AC181291 [0,0,0,0,0,0|3,0,0]=3 69 B10R1.61 OC(=O)C1=NC=CC=C1F AC181795 [0,0,0,0,0,0|3,0,0]=3 70 B10R1.61 OC(=O)C1=NC=CC=C1O AC180151 [0,0,0,0,0,0|3,0,0]=3 71 B10R1.61 OC(=O)C1=NC=CN=C1Br AC512171 [0,0,0,0,0,0|4,0,0]=4 72 B10R1.61 OC(=O)C1=NC=CN=C1Cl AC210043 [0,0,0,0,0,0|4,0,0]=4 73 B10R1.61 OC1=C(C=NC=C1)[N+]([O-])=O AC180727 [0,0,0,0,0,0|4,0,0]=4 74 B10R1.61 OC1=CC=CC=C1C([O-])=O HY-B0167A [0,0,0,0,0,0|2,0,0]=2 75 B10R1.61 [O-][N+](=O)C1=C(Br)C=NC=C1 AC181528 [0,0,0,0,0,0|4,0,0]=4 76 B10R1.61 [O-][N+](=O)C1=C(F)C=NC=C1 AC511083 [0,0,0,0,0,0|4,0,0]=4 77 B10R1.61 [O-][N+](=O)C1=C(F)N=CC=C1 AC181572 [0,0,0,0,0,0|4,0,0]=4 78 B10R1.61 [O-][N+](=O)C1=CC=CN=C1Cl AC510833 [0,0,0,0,0,0|4,0,0]=4 79 B10R1.61 [O-][N+](=O)C1=CN=CC=C1Cl AC500191 [0,0,0,0,0,0|4,0,0]=4 80 B10R1.61 [O-][N+](=O)C1=NC=CC=C1Br AC181139 [0,0,0,0,0,0|4,0,0]=4 81 B9R1.6 CC(=C)C1=CC=CC=C1 AC190225 [1,0,0,0,0,0|1,0,0]=2 82 B9R1.6 CC(=O)C1=CC=CN=C1 AC510735 [1,0,0,0,0,0|1,0,0]=2 83 B9R1.6 CC(=O)C1=CN=CC=N1 AC510694 [1,0,0,0,0,0|2,0,0]=3 84 B9R1.6 CC(=O)C1=CN=CN=C1 AC050215 [1,0,0,0,0,0|2,0,0]=3 85 B9R1.6 CC(=O)C1=NC=CC=C1 AC131564 [1,0,0,0,0,0|1,0,0]=2 86 B9R1.6 CC(=O)C1=NC=CC=N1 AC182273 [1,0,0,0,0,0|2,0,0]=3 87 B9R1.6 CC(=O)C1=NC=NC=C1 LN00221164 [1,0,0,0,0,0|2,0,0]=3 88 B9R1.6 CC(N)C1=CC=CN=C1 AC170099 [1,0,0,0,0,0|2,0,1]=4 89 B9R1.6 CC(N)C1=CC=NC=C1 AC170001 [1,0,0,0,0,0|2,0,1]=4 90 B9R1.6 CC(N)C1=NC=CC=C1 AC021461 [1,0,0,0,0,0|2,0,1]=4 91 B9R1.6 CC(O)C1=NC=CC=C1 AC181953 [1,0,0,0,0,0|1,0,2]=4 92 B9R1.6 CN(C)C1=CC=NC=C1 AC131272 [1,0,0,0,0,0|3,0,0]=4 93 B9R1.6 C[C@@H](N)C1=NC=CC=C1 AC021462 [1,0,0,0,0,0|2,0,1]=4 94 B9R1.6 C[C@@H](O)C1=CC=CC=C1 AC021442 [1,0,0,0,0,0|0,0,2]=3 95 B9R1.6 C[C@H](N)C1=NC=CC=C1 AC170065 [1,0,0,0,0,0|2,0,1]=4 96 B9R1.6 ClC(=O)C1=CN=CN=C1 AC160433 [1,0,0,0,0,0|3,0,0]=4 97 B9R1.6 NC(=N)C1=CC=CC=C1 AC511551 [1,0,0,0,0,0|2,0,0]=3 98 B9R1.6 NC(=N)C1=CC=CN=C1 AC180531 [1,0,0,0,0,0|3,0,0]=4 99 B9R1.6 NC(=O)C1=CC=CN=C1 HY-B0150 [1,0,0,0,0,0|2,0,0]=3 100 B9R1.6 NC(=O)C1=NC=CN=C1 HY-B0271 [1,0,0,0,0,0|3,0,0]=4 101 B9R1.6 NC(=S)C1=NC=CC=C1 AC180667 [1,0,0,0,0,0|2,1,0]=4 102 B9R1.6 OB(O)C1=CC=CC=C1 AC130043 [1,0,0,0,0,0|2,0,1]=4 103 B9R1.6 OC(=O)C1=CC=CN=C1 AC510862 [1,0,0,0,0,0|2,0,0]=3 104 B9R1.6 OC(=O)C1=CC=CN=C1 HY-B0143 [1,0,0,0,0,0|2,0,0]=3 105 B9R1.6 OC(=O)C1=CC=NN=C1 AC180268 [1,0,0,0,0,0|3,0,0]=4 106 B9R1.6 OC(=O)C1=CN=CN=C1 AC020529 [1,0,0,0,0,0|3,0,0]=4 107 B9R1.6 OC(=O)C1=NC=CC=C1 AC190264 [1,0,0,0,0,0|2,0,0]=3 108 B9R1.6 OC(=O)C1=NC=CC=N1 AC181135 [1,0,0,0,0,0|3,0,0]=4 109 B9R1.6 OC(=O)C1=NC=CN=C1 AC021096 [1,0,0,0,0,0|3,0,0]=4 110 B9R1.6 OC(=O)C1=NC=NC=C1 AC180734 [1,0,0,0,0,0|3,0,0]=4 111 B9R1.6 OC(=O)C1=NN=CC=C1 AC511154 [1,0,0,0,0,0|3,0,0]=4 112 B9R1.15 BrC1=C(C=O)C=CC=C1 AC190053 [1,0,0,0,0,0|1,0,0]=2 113 B9R1.15 BrC1=C(C=O)C=CN=C1 AC511781 [1,0,0,0,0,0|2,0,0]=3 114 B9R1.15 BrC1=CC=CC=C1C#N AC500253 [1,0,0,0,0,0|2,0,1]=4 115 B9R1.15 BrC1=CC=NC=C1C=O AC290066 [1,0,0,0,0,0|2,0,0]=3 116 B9R1.15 BrC1=NC=CC=C1C=O AC130168 [1,0,0,0,0,0|2,0,0]=3 117 B9R1.15 BrCC1=C(Br)C=CC=C1 AC500309 [1,0,0,0,0,0|2,0,1]=4 118 B9R1.15 BrCC1=C(I)C=CC=C1 AC510755 [1,0,0,0,0,0|2,0,1]=4 119 B9R1.15 C1=CC(=C(C=O)N=C1)O LN00121425 [1,0,0,0,0,0|2,0,0]=3 120 B9R1.15 C1=CC(=C(N)N=C1)C#N LN00002641 [1,0,0,0,0,0|2,0,1]=4 121 B9R1.15 C1=CC=C(C(=C1)CO)Br LN00009848 [1,0,0,0,0,0|1,0,2]=4 122 B9R1.15 CC1=CC=CC=C1C=O AC511038 [1,0,0,0,0,0|1,0,0]=2 123 B9R1.15 CC1=CC=CC=C1CN AC190306 [1,0,0,0,0,0|2,0,1]=4 124 B9R1.15 CC1=CC=CN=C1C=O AC181444 [1,0,0,0,0,0|2,0,0]=3 125 B9R1.15 CCC1=CC=CC=C1Br AC500247 [1,0,0,0,0,0|1,0,1]=3 126 B9R1.15 CCC1=NC=CC=C1O LN00004884 [1,0,0,0,0,0|2,0,1]=4 127 B9R1.15 CNC1=C(O)C=CC=C1 AC512071 [1,0,0,0,0,0|2,0,0]=3 128 B9R1.15 CNC1=CC=CC=C1N AC511708 [1,0,0,0,0,0|1,0,0]=2 129 B9R1.15 CNC1=CC=CC=C1N LN01309502 [1,0,0,0,0,0|1,0,0]=2 130 B9R1.15 COC1=C(Br)C=CC=C1 AC510848 [1,0,0,0,0,0|2,0,0]=3 131 B9R1.15 COC1=C(Br)C=NC=C1 AC210036 [1,0,0,0,0,0|3,0,0]=4 132 B9R1.15 COC1=C(I)C=CC=C1 AC510814 [1,0,0,0,0,0|2,0,0]=3 133 B9R1.15 COC1=C(N)C=NC=C1 AC030137 [1,0,0,0,0,0|2,0,0]=3 134 B9R1.15 COC1=CC=CC=C1O AC190186 [1,0,0,0,0,0|2,0,0]=3 135 B9R1.15 COC1=CC=CN=C1Br AC500269 [1,0,0,0,0,0|3,0,0]=4 136 B9R1.15 COC1=CC=CN=C1Cl AC181653 [1,0,0,0,0,0|3,0,0]=4 137 B9R1.15 COC1=CC=CN=C1N AC511905 [1,0,0,0,0,0|2,0,0]=3 138 B9R1.15 COC1=CC=NC=C1Cl LN01322749 [1,0,0,0,0,0|3,0,0]=4 139 B9R1.15 COC1=CN=CN=C1N AC511956 [1,0,0,0,0,0|3,0,0]=4 140 B9R1.15 COC1=NC=CC=C1Br AC181597 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.15 COC1=NC=CC=C1Cl AC181590 [1,0,0,0,0,0|3,0,0]=4 142 B9R1.15 COC1=NC=CC=C1I AC181562 [1,0,0,0,0,0|3,0,0]=4 143 B9R1.15 ClC1=C(C=CC=C1)C#C AC180982 [1,0,0,0,0,0|1,0,2]=4 144 B9R1.15 ClC1=C(C=O)C=CN=C1 AC510941 [1,0,0,0,0,0|2,0,0]=3 145 B9R1.15 ClC1=CC=CC=C1C=O AC190062 [1,0,0,0,0,0|1,0,0]=2 146 B9R1.15 ClC1=CC=CC=C1CBr AC180009 [1,0,0,0,0,0|2,0,1]=4 147 B9R1.15 ClC1=CC=CN=C1C=O AC511242 [1,0,0,0,0,0|2,0,0]=3 148 B9R1.15 FC1=C(C=CC=C1)C#N AC511685 [1,0,0,0,0,0|2,0,1]=4 149 B9R1.15 FC1=C(CBr)C=CC=C1 AC510775 [1,0,0,0,0,0|2,0,1]=4 150 B9R1.15 FC1=CC=CC=C1C=O AC510338 [1,0,0,0,0,0|1,0,0]=2 151 B9R1.15 FC1=CC=CN=C1C=O AC100101 [1,0,0,0,0,0|2,0,0]=3 152 B9R1.15 FC1=NC=CC=C1C=O AC512030 [1,0,0,0,0,0|2,0,0]=3 153 B9R1.15 NC1=C(C=O)C=CC=C1 AC510813 [1,0,0,0,0,0|0,0,0]=1 154 B9R1.15 NC1=C(CO)C=CC=N1 AC181888 [1,0,0,0,0,0|1,0,2]=4 155 B9R1.15 NC1=CC=CC=C1CO AC511831 [1,0,0,0,0,0|0,0,2]=3 156 B9R1.15 NC1=CC=CN=C1C#N AC181442 [1,0,0,0,0,0|2,0,1]=4 157 B9R1.15 NC1=CN=CC=C1C#N AC181753 [1,0,0,0,0,0|2,0,1]=4 158 B9R1.15 NC1=NC=CC=C1C#C AC270033 [1,0,0,0,0,0|1,0,2]=4 159 B9R1.15 NC1=NC=CC=C1C#N AC180722 [1,0,0,0,0,0|2,0,1]=4 160 B9R1.15 NC1=NC=CC=C1C=O AC020960 [1,0,0,0,0,0|1,0,0]=2 161 B9R1.15 NCC1=C(Br)C=CC=C1 AC500061 [1,0,0,0,0,0|2,0,1]=4 162 B9R1.15 NCC1=C(F)C=CC=C1 AC190246 [1,0,0,0,0,0|2,0,1]=4 163 B9R1.15 NCC1=CC=CC=C1O AC181137 [1,0,0,0,0,0|2,0,1]=4 164 B9R1.15 NNC1=CC=CC=C1Cl AC180294 [1,0,0,0,0,0|3,0,0]=4 165 B9R1.15 O=CC1=CC=CNC1=O AC182145 [1,0,0,0,0,0|2,0,0]=3 166 B9R1.15 OC1=C(C=CC=C1)C#N AC511758 [1,0,0,0,0,0|2,0,1]=4 167 B9R1.15 OC1=C(C=O)C=CC=C1 AC190207 [1,0,0,0,0,0|1,0,0]=2 168 B9R1.15 OC1=C(C=O)C=CN=C1 AC511223 [1,0,0,0,0,0|2,0,0]=3 169 B9R1.15 OC1=CC=CN=C1C=O AC270030 [1,0,0,0,0,0|2,0,0]=3 170 B9R1.15 OCC1=CC=CC=C1Br AC230033 [1,0,0,0,0,0|1,0,2]=4 171 B9R1.15 OCC1=CC=CC=C1I AC511037 [1,0,0,0,0,0|1,0,2]=4 172 B9R1.15 OCC1=CC=CC=C1O HY-B1419 [1,0,0,0,0,0|1,0,2]=4 173 B11R1.53 CC(=O)C1=CC=CC=C1C#N AC511890 [0,1,0,0,0,0|0,0,1]=2 174 B11R1.53 CCC1=C(C=CC=N1)C(=O)O LN00337936 [0,1,0,0,0,0|3,0,0]=4 175 B11R1.53 CCC1=CC=CC=C1C(O)=O AC220178 [0,1,0,0,0,0|2,0,0]=3 176 B11R1.53 COC1=C(C=CN=C1)C(O)=O AC182097 [0,1,0,0,0,0|3,0,0]=4 177 B11R1.53 COC1=NC=CC=C1C(O)=O AC512049 [0,1,0,0,0,0|3,0,0]=4 178 B11R1.53 NNC1=CC=CC=C1[N+]([O-])=O AC180549 [0,1,0,0,0,0|2,0,0]=3 179 B11R1.53 OC(=O)C1=C(C=O)C=CC=C1 AC180060 [0,1,0,0,0,0|2,0,0]=3 180 B11R1.53 OCC1=C(C=CC=C1)[N+]([O-])=O AC511759 [0,1,0,0,0,0|3,0,0]=4 181 B11R1.53 [O-][N+](=O)C1=CC=CC=C1C=O AC510835 [0,1,0,0,0,0|3,0,0]=4 182 B11R1.53 [O-][N+](=O)C1=CC=CC=C1CBr AC180199 [0,1,0,0,0,0|3,0,0]=4 183 B11R1.87 CC(C)(C)C1=C(N)C=CC=C1 AC180736 [0,1,0,0,0,0|1,0,1]=3 184 B11R1.87 CC1=CC=CC=C1S(O)(=O)=O AC180434 [0,1,0,0,0,0|3,0,0]=4 185 B11R1.87 CP(C)(=O)C1=CC=CC=C1N AC511962 [0,1,0,0,0,0|1,0,0]=2 186 B11R1.87 NC1=C(C=CC=C1)C(F)(F)F AC190266 [0,1,0,0,0,0|2,0,1]=4 187 B11R1.87 NS(=O)(=O)C1=CC=CC=C1F AC510719 [0,1,0,0,0,0|3,0,0]=4 188 B11R1.156 C1=CC(=C(C(=C1)I)C(=O)O)Br LN01103640 [0,1,0,0,0,0|2,0,0]=3 189 B11R1.156 CC(=O)C1=C(F)C=CC=C1F AC180004 [0,1,0,0,0,0|1,0,0]=2 190 B11R1.156 CC1=C(C(=CC=C1)C)C(=O)O LN00180777 [0,1,0,0,0,0|2,0,0]=3 191 B11R1.156 CC1=C(C(N)=NC=C1)[N+]([O-])=O AC180154 [0,1,0,0,0,0|3,0,0]=4 192 B11R1.156 CC1=C(C(O)=O)C(Br)=CC=C1 AC510997 [0,1,0,0,0,0|2,0,0]=3 193 B11R1.156 CC1=C(C(O)=O)C(Cl)=CC=C1 AC180479 [0,1,0,0,0,0|2,0,0]=3 194 B11R1.156 CC1=CC=CC(Cl)=C1[N+]([O-])=O AC181852 [0,1,0,0,0,0|3,0,0]=4 195 B11R1.156 CC1=CC=CC(N)=C1C(O)=O AC180216 [0,1,0,0,0,0|1,0,0]=2 196 B11R1.156 CC1=CC=CC(O)=C1C(O)=O AC181197 [0,1,0,0,0,0|2,0,0]=3 197 B11R1.156 NC1=C(C(Cl)=NC=C1)[N+]([O-])=O AC182106 [0,1,0,0,0,0|3,0,0]=4 198 B11R1.156 NC1=C(C(O)=O)C(Cl)=CC=C1 AC180503 [0,1,0,0,0,0|1,0,0]=2 199 B11R1.156 NC1=CC=CC(Br)=C1C(O)=O AC181693 [0,1,0,0,0,0|1,0,0]=2 200 B11R1.156 NC1=CC=CC(F)=C1C(O)=O AC130111 [0,1,0,0,0,0|1,0,0]=2 201 B11R1.156 NC1=CC=CC(F)=C1[N+]([O-])=O AC130183 [0,1,0,0,0,0|2,0,0]=3 202 B11R1.156 NC1=CC=NC(O)=C1[N+]([O-])=O AC021077 [0,1,0,0,0,0|3,0,0]=4 203 B11R1.156 OC(=O)C1=C(Cl)C=NC=C1Cl AC510651 [0,1,0,0,0,0|3,0,0]=4 204 B11R1.156 OC(=O)C1=C(Cl)N=CC=C1Cl AC130184 [0,1,0,0,0,0|3,0,0]=4 205 B11R1.156 OC(=O)C1=C(Cl)N=CC=C1F AC131137 [0,1,0,0,0,0|3,0,0]=4 206 B11R1.156 OC(=O)C1=C(Cl)N=CC=C1I AC190122 [0,1,0,0,0,0|3,0,0]=4 207 B11R1.156 OC(=O)C1=C(F)C=CC=C1Br AC181254 [0,1,0,0,0,0|2,0,0]=3 208 B11R1.156 OC(=O)C1=C(F)C=CC=C1F AC020998 [0,1,0,0,0,0|2,0,0]=3 209 B11R1.156 OC(=O)C1=C(F)C=NC=C1F AC512102 [0,1,0,0,0,0|3,0,0]=4 210 B11R1.156 OC(=O)C1=C(O)C=CC=C1F AC511776 [0,1,0,0,0,0|2,0,0]=3 211 B11R1.156 OC1=CC=CC(O)=C1[N+]([O-])=O AC511751 [0,1,0,0,0,0|3,0,0]=4 212 B11R1.156 [O-][N+](=O)C1=C(Cl)C=CC=C1F AC181993 [0,1,0,0,0,0|3,0,0]=4 213 B11R1.156 [O-][N+](=O)C1=C(F)C=CC=C1Br AC511218 [0,1,0,0,0,0|3,0,0]=4 214 B11R1.156 [O-][N+](=O)C1=C(F)C=CC=C1F AC180865 [0,1,0,0,0,0|3,0,0]=4 215 B11R1.159 C1=CC(=C(C(=C1)Cl)Br)C(=O)O LN00204324 [0,1,0,0,0,0|2,0,0]=3 216 B11R1.159 C1=CC(=C(C(=C1)F)Br)C(=O)O LN01316525 [0,1,0,0,0,0|2,0,0]=3 217 B11R1.159 CC(=O)C1=C(O)C(Br)=CC=C1 AC182239 [0,1,0,0,0,0|1,0,0]=2 218 B11R1.159 CC1=C(Br)C=CC=C1C(O)=O AC130042 [0,1,0,0,0,0|2,0,0]=3 219 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)I LN00116621 [0,1,0,0,0,0|2,0,0]=3 220 B11R1.159 CC1=C(C=CC=C1Cl)C(O)=O AC180528 [0,1,0,0,0,0|2,0,0]=3 221 B11R1.159 CC1=C(C=CC=C1F)C(O)=O AC510933 [0,1,0,0,0,0|2,0,0]=3 222 B11R1.159 CC1=C(Cl)C(=CC=C1)[N+]([O-])=O AC180745 [0,1,0,0,0,0|3,0,0]=4 223 B11R1.159 CC1=C(I)C(=CC=C1)C(O)=O AC510630 [0,1,0,0,0,0|2,0,0]=3 224 B11R1.159 CC1=C(N)C(=CC=C1)[N+]([O-])=O AC510582 [0,1,0,0,0,0|2,0,0]=3 225 B11R1.159 CC1=C(N)C=CC=C1[N+]([O-])=O AC020807 [0,1,0,0,0,0|3,0,0]=4 226 B11R1.159 CC1=C(O)C(=CC=C1)C(O)=O HY-B1399 [0,1,0,0,0,0|2,0,0]=3 227 B11R1.159 CC1=CC=CC(=C1Br)[N+]([O-])=O AC180743 [0,1,0,0,0,0|3,0,0]=4 228 B11R1.159 CC1=CC=CC(=C1F)[N+]([O-])=O AC181634 [0,1,0,0,0,0|3,0,0]=4 229 B11R1.159 CC1=CC=CC(=C1O)[N+]([O-])=O AC180392 [0,1,0,0,0,0|3,0,0]=4 230 B11R1.159 CC1=CC=CC(C(O)=O)=C1Br AC510821 [0,1,0,0,0,0|2,0,0]=3 231 B11R1.159 CC1=CC=CC(C(O)=O)=C1C AC021104 [0,1,0,0,0,0|2,0,0]=3 232 B11R1.159 CC1=CC=CC(C(O)=O)=C1N AC511696 [0,1,0,0,0,0|1,0,0]=2 233 B11R1.159 NC1=C(Br)C=CC=C1C(O)=O AC181691 [0,1,0,0,0,0|1,0,0]=2 234 B11R1.159 NC1=C(C=CC=C1Cl)C(O)=O AC180742 [0,1,0,0,0,0|1,0,0]=2 235 B11R1.159 NC1=C(Cl)C(=CC=C1)[N+]([O-])=O AC050166 [0,1,0,0,0,0|3,0,0]=4 236 B11R1.159 NC1=C(F)C=CC=C1C(O)=O AC181251 [0,1,0,0,0,0|1,0,0]=2 237 B11R1.159 NC1=C(F)C=CC=C1[N+]([O-])=O AC181791 [0,1,0,0,0,0|2,0,0]=3 238 B11R1.159 NC1=C(O)C=CC=C1C(O)=O AC130201 [0,1,0,0,0,0|1,0,0]=2 239 B11R1.159 NC1=C(O)C=CC=C1[N+]([O-])=O AC510866 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.159 OC(=O)C1=C(Br)C(F)=CC=C1 AC130173 [0,1,0,0,0,0|2,0,0]=3 241 B11R1.159 OC(=O)C1=C(Cl)C(Cl)=NC=C1 AC181344 [0,1,0,0,0,0|3,0,0]=4 242 B11R1.159 OC(=O)C1=C(F)C(Cl)=NC=C1 AC181762 [0,1,0,0,0,0|3,0,0]=4 243 B11R1.159 OC(=O)C1=CC=CC(Br)=C1O AC511188 [0,1,0,0,0,0|2,0,0]=3 244 B11R1.159 OC(=O)C1=CC=NC(Br)=C1F AC182721 [0,1,0,0,0,0|3,0,0]=4 245 B11R1.159 OC1=CC=CC(=C1Cl)[N+]([O-])=O AC020526 [0,1,0,0,0,0|3,0,0]=4 246 B11R1.159 [O-][N+](=O)C1=CC=CC(F)=C1F AC181013 [0,1,0,0,0,0|3,0,0]=4 247 B11R1.166 C1=CC(=C(C=C1Br)F)C(=O)O LN00008566 [0,1,0,0,0,0|2,0,0]=3 248 B11R1.166 C1=CC(=C(C=C1F)Br)[N+](=O)[O-] LN00009950 [0,1,0,0,0,0|3,0,0]=4 249 B11R1.166 C1=CC(=C(C=C1O)Br)C(=O)O LN01038895 [0,1,0,0,0,0|2,0,0]=3 250 B11R1.166 C1=CC(=C(C=C1O)F)[N+](=O)[O-] LN00116278 [0,1,0,0,0,0|3,0,0]=4 251 B11R1.166 CC(=O)C1=C(C=C(C=C1)N)Cl LN01796470 [0,1,0,0,0,0|1,0,0]=2 252 B11R1.166 CC(=O)C1=C(F)C=C(Br)C=C1 AC220119 [0,1,0,0,0,0|1,0,0]=2 253 B11R1.166 CC(=O)C1=CC=C(Br)C=C1O AC181677 [0,1,0,0,0,0|1,0,0]=2 254 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1Br AC511164 [0,1,0,0,0,0|1,0,0]=2 255 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1Cl AC500263 [0,1,0,0,0,0|1,0,0]=2 256 B11R1.166 CC(=O)C1=CC=C(N)C=C1O AC511889 [0,1,0,0,0,0|1,0,0]=2 257 B11R1.166 CC(=O)C1=CC=C(O)C=C1F AC021126 [0,1,0,0,0,0|1,0,0]=2 258 B11R1.166 CC(=O)C1=NC=C(F)C=C1F AC050224 [0,1,0,0,0,0|2,0,0]=3 259 B11R1.166 CC(C)C1=CC=C(N)C=C1O AC050674 [0,1,0,0,0,0|2,0,1]=4 260 B11R1.166 CC1=C(C=CC(Cl)=C1)[N+]([O-])=O AC180382 [0,1,0,0,0,0|3,0,0]=4 261 B11R1.166 CC1=C(N=CC(Br)=C1)C(O)=O AC182133 [0,1,0,0,0,0|3,0,0]=4 262 B11R1.166 CC1=CC(Br)=CC=C1C(O)=O AC250047 [0,1,0,0,0,0|2,0,0]=3 263 B11R1.166 CC1=CC(Br)=CC=C1[N+]([O-])=O AC050901 [0,1,0,0,0,0|3,0,0]=4 264 B11R1.166 CC1=CC(Cl)=C(C=C1)[N+]([O-])=O AC181490 [0,1,0,0,0,0|3,0,0]=4 265 B11R1.166 CC1=CC(Cl)=CN=C1C(O)=O AC182134 [0,1,0,0,0,0|3,0,0]=4 266 B11R1.166 CC1=CC(F)=C(C=C1)C(O)=O AC181531 [0,1,0,0,0,0|2,0,0]=3 267 B11R1.166 CC1=CC(F)=C(C=C1)[N+]([O-])=O AC180188 [0,1,0,0,0,0|3,0,0]=4 268 B11R1.166 CC1=CC(N)=CC=C1C(O)=O AC181976 [0,1,0,0,0,0|2,0,0]=3 269 B11R1.166 CC1=CC(O)=C(C=N1)C(O)=O AC181761 [0,1,0,0,0,0|3,0,0]=4 270 B11R1.166 CC1=CC=C(C(N)=N1)[N+]([O-])=O AC180488 [0,1,0,0,0,0|3,0,0]=4 271 B11R1.166 CC1=CC=C(C(O)=O)C(Br)=C1 AC511793 [0,1,0,0,0,0|2,0,0]=3 272 B11R1.166 CC1=CC=C(C(O)=O)C(Cl)=N1 AC020050 [0,1,0,0,0,0|3,0,0]=4 273 B11R1.166 CC1=CC=C(C(O)=O)C(N)=C1 AC511862 [0,1,0,0,0,0|1,0,0]=2 274 B11R1.166 CC1=NC(=C(C=C1)C(=O)O)C LN00181449 [0,1,0,0,0,0|3,0,0]=4 275 B11R1.166 CC1=NC(=C(C=C1)C(=O)O)Cl LN00131032 [0,1,0,0,0,0|3,0,0]=4 276 B11R1.166 C[C@@H](C1=C(C=C(C=C1)Br)F)N LN02010281 [0,1,0,0,0,0|2,0,1]=4 277 B11R1.166 NC(=N)C1=CC=C(Br)C=C1F AC021555 [0,1,0,0,0,0|3,0,0]=4 278 B11R1.166 NC(=O)C1=C(N)N=C(Cl)C=C1 AC020634 [0,1,0,0,0,0|2,0,0]=3 279 B11R1.166 NC(=O)C1=CC=C(Cl)C=C1N AC182388 [0,1,0,0,0,0|1,0,0]=2 280 B11R1.166 NC1=C(C=CC(Cl)=C1)C(O)=O AC180214 [0,1,0,0,0,0|1,0,0]=2 281 B11R1.166 NC1=C(C=CC(Cl)=C1)[N+]([O-])=O AC500225 [0,1,0,0,0,0|2,0,0]=3 282 B11R1.166 NC1=C(C=CC(Cl)=N1)C(O)=O AC020633 [0,1,0,0,0,0|2,0,0]=3 283 B11R1.166 NC1=C(C=CC(Cl)=N1)[N+]([O-])=O AC180472 [0,1,0,0,0,0|3,0,0]=4 284 B11R1.166 NC1=CC(Br)=CC=C1C(O)=O AC181692 [0,1,0,0,0,0|1,0,0]=2 285 B11R1.166 NC1=CC(Br)=CC=C1[N+]([O-])=O AC182391 [0,1,0,0,0,0|2,0,0]=3 286 B11R1.166 NC1=CC(Cl)=C(C=C1)C(O)=O AC511619 [0,1,0,0,0,0|2,0,0]=3 287 B11R1.166 NC1=CC(F)=CC=C1[N+]([O-])=O AC130073 [0,1,0,0,0,0|2,0,0]=3 288 B11R1.166 NC1=CC(I)=CC=C1C(O)=O AC182459 [0,1,0,0,0,0|1,0,0]=2 289 B11R1.166 NC1=CC=C(C(Br)=C1)[N+]([O-])=O AC512057 [0,1,0,0,0,0|3,0,0]=4 290 B11R1.166 NC1=CC=C(C(F)=C1)[N+]([O-])=O AC181633 [0,1,0,0,0,0|3,0,0]=4 291 B11R1.166 NC1=CC=C(C(O)=O)C(F)=C1 AC511347 [0,1,0,0,0,0|2,0,0]=3 292 B11R1.166 NC1=CC=C(C(O)=O)C(O)=C1 HY-B1048 [0,1,0,0,0,0|2,0,0]=3 293 B11R1.166 OC(=O)C1=C(Br)C=C(Cl)C=C1 AC181078 [0,1,0,0,0,0|2,0,0]=3 294 B11R1.166 OC(=O)C1=C(Br)C=C(F)C=C1 AC180537 [0,1,0,0,0,0|2,0,0]=3 295 B11R1.166 OC(=O)C1=C(Br)N=C(F)C=C1 AC050995 [0,1,0,0,0,0|3,0,0]=4 296 B11R1.166 OC(=O)C1=C(Cl)C=C(Cl)C=C1 AC510802 [0,1,0,0,0,0|2,0,0]=3 297 B11R1.166 OC(=O)C1=C(Cl)C=C(F)C=C1 AC200135 [0,1,0,0,0,0|2,0,0]=3 298 B11R1.166 OC(=O)C1=C(F)C=C(Br)C=C1 AC511019 [0,1,0,0,0,0|2,0,0]=3 299 B11R1.166 OC(=O)C1=C(F)C=C(Cl)C=C1 AC510774 [0,1,0,0,0,0|2,0,0]=3 300 B11R1.166 OC(=O)C1=C(F)C=C(F)C=C1 AC180271 [0,1,0,0,0,0|2,0,0]=3 301 B11R1.166 OC(=O)C1=C(F)C=C(I)C=C1 AC181546 [0,1,0,0,0,0|2,0,0]=3 302 B11R1.166 OC(=O)C1=C(F)N=C(Br)C=C1 AC050280 [0,1,0,0,0,0|3,0,0]=4 303 B11R1.166 OC(=O)C1=C(O)C=C(Br)C=C1 AC500228 [0,1,0,0,0,0|2,0,0]=3 304 B11R1.166 OC(=O)C1=CC=C(Br)C=C1Cl AC180439 [0,1,0,0,0,0|2,0,0]=3 305 B11R1.166 OC(=O)C1=CC=C(Cl)C=C1I AC511491 [0,1,0,0,0,0|2,0,0]=3 306 B11R1.166 OC(=O)C1=CC=C(Cl)N=C1Cl AC180623 [0,1,0,0,0,0|3,0,0]=4 307 B11R1.166 OC(=O)C1=CC=C(F)C=C1O AC511669 [0,1,0,0,0,0|2,0,0]=3 308 B11R1.166 OC(=O)C1=CC=C(O)C=C1F AC181201 [0,1,0,0,0,0|2,0,0]=3 309 B11R1.166 OC(=O)C1=CN=C(Br)C=C1Cl AC050221 [0,1,0,0,0,0|3,0,0]=4 310 B11R1.166 OC(=O)C1=CN=C(Cl)C=C1Cl AC180938 [0,1,0,0,0,0|3,0,0]=4 311 B11R1.166 OC(=O)C1=NC=C(Br)C=C1Cl AC182704 [0,1,0,0,0,0|3,0,0]=4 312 B11R1.166 OC(=O)C1=NC=C(Cl)C=C1Cl AC181600 [0,1,0,0,0,0|3,0,0]=4 313 B11R1.166 OC(=O)C1=NC=C(F)C=C1F AC510952 [0,1,0,0,0,0|3,0,0]=4 314 B11R1.166 OC1=C(C=CC(Br)=C1)[N+]([O-])=O AC181565 [0,1,0,0,0,0|3,0,0]=4 315 B11R1.166 OC1=C(C=CC(F)=C1)[N+]([O-])=O AC130685 [0,1,0,0,0,0|3,0,0]=4 316 B11R1.166 OC1=CC(Cl)=CC=C1[N+]([O-])=O AC182400 [0,1,0,0,0,0|3,0,0]=4 317 B11R1.166 OC1=CC=C(C(Br)=C1)[N+]([O-])=O AC182511 [0,1,0,0,0,0|3,0,0]=4 318 B11R1.166 OC1=CC=C(C(I)=C1)[N+]([O-])=O AC512128 [0,1,0,0,0,0|3,0,0]=4 319 B11R1.166 [O-][N+](=O)C1=C(Br)C=C(Br)C=C1 AC181472 [0,1,0,0,0,0|3,0,0]=4 320 B11R1.166 [O-][N+](=O)C1=C(F)C=C(Br)C=C1 AC130114 [0,1,0,0,0,0|3,0,0]=4 321 B11R1.166 [O-][N+](=O)C1=CC=C(Cl)C=C1F AC180450 [0,1,0,0,0,0|3,0,0]=4 322 B11R1.166 [O-][N+](=O)C1=CC=C(F)C=C1Br AC181099 [0,1,0,0,0,0|3,0,0]=4 323 B11R1.166 [O-][N+](=O)C1=CC=C(F)C=C1Cl AC181631 [0,1,0,0,0,0|3,0,0]=4 324 B11R1.167 C1=C(C=NC(=C1C(=O)O)N)Br LN00008839 [0,1,0,0,0,0|2,0,0]=3 325 B11R1.167 C1=CC(=C(C=C1F)C(=O)O)Br LN00008719 [0,1,0,0,0,0|2,0,0]=3 326 B11R1.167 C1=CC(=C(C=C1I)C(=O)O)Cl LN00007888 [0,1,0,0,0,0|2,0,0]=3 327 B11R1.167 CC(=O)C1=C(Cl)C=CC(F)=C1 AC180460 [0,1,0,0,0,0|1,0,0]=2 328 B11R1.167 CC(=O)C1=C(F)C=CC(Br)=N1 AC050927 [0,1,0,0,0,0|2,0,0]=3 329 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 AC130204 [0,1,0,0,0,0|1,0,0]=2 330 B11R1.167 CC(=O)C1=CC(Br)=CC=C1F AC182638 [0,1,0,0,0,0|1,0,0]=2 331 B11R1.167 CC(=O)C1=CC(Br)=CC=C1N AC511145 [0,1,0,0,0,0|0,0,0]=1 332 B11R1.167 CC(=O)C1=CC(Br)=CC=C1O AC510656 [0,1,0,0,0,0|1,0,0]=2 333 B11R1.167 CC(=O)C1=CC(Cl)=CC=C1Cl AC020882 [0,1,0,0,0,0|1,0,0]=2 334 B11R1.167 CC(=O)C1=CC(F)=CC=C1O AC510745 [0,1,0,0,0,0|1,0,0]=2 335 B11R1.167 CC1=C(C=C(C=C1)Br)[N+](=O)[O-] LN00174237 [0,1,0,0,0,0|3,0,0]=4 336 B11R1.167 CC1=C(C=C(I)C=C1)C(O)=O AC181258 [0,1,0,0,0,0|2,0,0]=3 337 B11R1.167 CC1=C(C=C(N)C=C1)C(O)=O AC181945 [0,1,0,0,0,0|2,0,0]=3 338 B11R1.167 CC1=C(C=C(O)C=C1)[N+]([O-])=O AC180200 [0,1,0,0,0,0|3,0,0]=4 339 B11R1.167 CC1=CC(=C(C=C1)I)C(=O)O LN00117409 [0,1,0,0,0,0|2,0,0]=3 340 B11R1.167 CC1=CC(=C(I)C=C1)[N+]([O-])=O AC180379 [0,1,0,0,0,0|3,0,0]=4 341 B11R1.167 CC1=CC=C(Br)C=C1C(O)=O AC511799 [0,1,0,0,0,0|2,0,0]=3 342 B11R1.167 CC1=CC=C(Cl)C(=C1)C(O)=O AC511767 [0,1,0,0,0,0|2,0,0]=3 343 B11R1.167 CC1=CC=C(Cl)N=C1C(O)=O AC050269 [0,1,0,0,0,0|3,0,0]=4 344 B11R1.167 CC1=CC=C(F)C(=C1)[N+]([O-])=O AC180189 [0,1,0,0,0,0|3,0,0]=4 345 B11R1.167 CC1=CC=C(I)C=C1[N+]([O-])=O AC180498 [0,1,0,0,0,0|3,0,0]=4 346 B11R1.167 CC1=CC=C(N)C(=C1)C(O)=O AC180220 [0,1,0,0,0,0|1,0,0]=2 347 B11R1.167 NC(=N)C1=C(F)C=CC(F)=C1 AC190144 [0,1,0,0,0,0|3,0,0]=4 348 B11R1.167 NC(=O)C1=C(Cl)N=CC(Cl)=C1 AC180875 [0,1,0,0,0,0|3,0,0]=4 349 B11R1.167 NC(=O)C1=C(N)N=CC(Br)=C1 AC050591 [0,1,0,0,0,0|2,0,0]=3 350 B11R1.167 NC1=C(C=C(Br)C=C1)C(O)=O AC510850 [0,1,0,0,0,0|1,0,0]=2 351 B11R1.167 NC1=C(C=C(Br)C=C1)[N+]([O-])=O AC510988 [0,1,0,0,0,0|2,0,0]=3 352 B11R1.167 NC1=C(C=C(Br)C=N1)C(O)=O AC181326 [0,1,0,0,0,0|2,0,0]=3 353 B11R1.167 NC1=C(C=C(Br)C=N1)[N+]([O-])=O AC180487 [0,1,0,0,0,0|3,0,0]=4 354 B11R1.167 NC1=C(C=C(F)C=C1)C(O)=O AC512093 [0,1,0,0,0,0|1,0,0]=2 355 B11R1.167 NC1=C(C=C(F)C=N1)[N+]([O-])=O AC511595 [0,1,0,0,0,0|3,0,0]=4 356 B11R1.167 NC1=C(C=C(I)C=C1)C(O)=O AC180218 [0,1,0,0,0,0|1,0,0]=2 357 B11R1.167 NC1=C(C=C(O)C=C1)C(O)=O AC180219 [0,1,0,0,0,0|1,0,0]=2 358 B11R1.167 NC1=CC(C(O)=O)=C(O)C=C1 HY-15027 [0,1,0,0,0,0|2,0,0]=3 359 B11R1.167 NC1=CC=C(Cl)N=C1C(O)=O AC182417 [0,1,0,0,0,0|2,0,0]=3 360 B11R1.167 NC1=CC=C(O)C=C1[N+]([O-])=O AC130220 [0,1,0,0,0,0|2,0,0]=3 361 B11R1.167 NC1=CN=C(Cl)C=C1C(O)=O AC511065 [0,1,0,0,0,0|2,0,0]=3 362 B11R1.167 NC1=NC=C(Br)C(=C1)C(O)=O AC182498 [0,1,0,0,0,0|3,0,0]=4 363 B11R1.167 NC1=NC=C(Br)N=C1C(O)=O AC511230 [0,1,0,0,0,0|3,0,0]=4 364 B11R1.167 OC(=O)C1=C(Br)C=CC(O)=C1 AC512094 [0,1,0,0,0,0|2,0,0]=3 365 B11R1.167 OC(=O)C1=C(Br)N=CC(Cl)=C1 AC182442 [0,1,0,0,0,0|3,0,0]=4 366 B11R1.167 OC(=O)C1=C(Cl)C=CC(F)=C1 AC180797 [0,1,0,0,0,0|2,0,0]=3 367 B11R1.167 OC(=O)C1=C(Cl)C=NC(Br)=C1 AC050570 [0,1,0,0,0,0|3,0,0]=4 368 B11R1.167 OC(=O)C1=C(Cl)N=CC(F)=C1 AC500330 [0,1,0,0,0,0|3,0,0]=4 369 B11R1.167 OC(=O)C1=C(F)N=CC(Br)=C1 AC182057 [0,1,0,0,0,0|3,0,0]=4 370 B11R1.167 OC(=O)C1=C(O)C=CC(O)=C1 AC130216 [0,1,0,0,0,0|2,0,0]=3 371 B11R1.167 OC(=O)C1=CC(Br)=CC=C1Br AC180318 [0,1,0,0,0,0|2,0,0]=3 372 B11R1.167 OC(=O)C1=CC(Br)=CC=C1Cl AC511599 [0,1,0,0,0,0|2,0,0]=3 373 B11R1.167 OC(=O)C1=CC(Br)=CC=C1I AC180644 [0,1,0,0,0,0|2,0,0]=3 374 B11R1.167 OC(=O)C1=CC(Br)=CN=C1Cl AC181748 [0,1,0,0,0,0|3,0,0]=4 375 B11R1.167 OC(=O)C1=CC(Br)=CN=C1O AC020330 [0,1,0,0,0,0|3,0,0]=4 376 B11R1.167 OC(=O)C1=CC(Br)=NC=C1F AC040200 [0,1,0,0,0,0|3,0,0]=4 377 B11R1.167 OC(=O)C1=CC(Cl)=CC=C1F AC181071 [0,1,0,0,0,0|2,0,0]=3 378 B11R1.167 OC(=O)C1=CC(Cl)=CC=C1O AC500101 [0,1,0,0,0,0|2,0,0]=3 379 B11R1.167 OC(=O)C1=CC(Cl)=CN=C1Cl AC181345 [0,1,0,0,0,0|3,0,0]=4 380 B11R1.167 OC(=O)C1=CC(Cl)=CN=C1O AC180874 [0,1,0,0,0,0|3,0,0]=4 381 B11R1.167 OC(=O)C1=CC(Cl)=NC=C1Cl AC181039 [0,1,0,0,0,0|3,0,0]=4 382 B11R1.167 OC(=O)C1=CC(Cl)=NC=C1F AC181864 [0,1,0,0,0,0|3,0,0]=4 383 B11R1.167 OC(=O)C1=CC(I)=CC=C1Br AC180643 [0,1,0,0,0,0|2,0,0]=3 384 B11R1.167 OC(=O)C1=CC(I)=CC=C1Cl AC180645 [0,1,0,0,0,0|2,0,0]=3 385 B11R1.167 OC(=O)C1=CC(I)=CC=C1F AC500186 [0,1,0,0,0,0|2,0,0]=3 386 B11R1.167 OC(=O)C1=NC(Cl)=CC=C1F AC512028 [0,1,0,0,0,0|3,0,0]=4 387 B11R1.167 OC1=C(C=C(Br)C=C1)[N+]([O-])=O AC511791 [0,1,0,0,0,0|3,0,0]=4 388 B11R1.167 OC1=CC=C(Br)C(=C1)[N+]([O-])=O AC511874 [0,1,0,0,0,0|3,0,0]=4 389 B11R1.167 OC1=CC=C(F)C(=C1)[N+]([O-])=O AC511186 [0,1,0,0,0,0|3,0,0]=4 390 B11R1.167 [O-][N+](=O)C1=C(Br)C=CC(Br)=C1 AC180187 [0,1,0,0,0,0|3,0,0]=4 391 B11R1.167 [O-][N+](=O)C1=C(F)C=CC(Cl)=C1 AC512044 [0,1,0,0,0,0|3,0,0]=4 392 B11R1.167 [O-][N+](=O)C1=CC(Br)=CC=C1F AC130117 [0,1,0,0,0,0|3,0,0]=4 393 B11R1.167 [O-][N+](=O)C1=CC(Cl)=CC=C1Br AC180381 [0,1,0,0,0,0|3,0,0]=4 394 B11R1.167 [O-][N+](=O)C1=CC(F)=CC=C1Br AC180538 [0,1,0,0,0,0|3,0,0]=4 395 B11R1.167 [O-][N+](=O)C1=CC(F)=CC=C1Cl AC180658 [0,1,0,0,0,0|3,0,0]=4 396 B11R1.167 [O-][N+](=O)C1=CC(F)=CC=C1F AC511680 [0,1,0,0,0,0|3,0,0]=4 397 B11R1.222 C1=CC=C(C(=C1)[C@@H](CO)N)Cl LN02026918 [0,1,0,0,0,0|2,0,1]=4 398 B11R1.222 CCC(=O)C1=C(Cl)C=CC=C1 AC060049 [0,1,0,0,0,0|1,0,0]=2 399 B11R1.222 CNC(=O)C1=C(O)C=CC=C1 AC030031 [0,1,0,0,0,0|1,0,0]=2 400 B11R1.222 COC(=O)C1=C(Br)C=CC=N1 AC130237 [0,1,0,0,0,0|2,0,0]=3 401 B11R1.222 COC(=O)C1=C(F)N=CC=C1 AC181573 [0,1,0,0,0,0|2,0,0]=3 402 B11R1.222 COC(=O)C1=C(F)N=CC=C1 LN00171755 [0,1,0,0,0,0|2,0,0]=3 403 B11R1.222 COC(=O)C1=C(I)C=CC=C1 AC130757 [0,1,0,0,0,0|1,0,0]=2 404 B11R1.222 COC(=O)C1=C(N)C=NC=C1 AC181387 [0,1,0,0,0,0|1,0,0]=2 405 B11R1.222 COC(=O)C1=C(O)C=NC=C1 AC181065 [0,1,0,0,0,0|2,0,0]=3 406 B11R1.222 COC(=O)C1=C(O)N=CN=C1 AC181268 [0,1,0,0,0,0|3,0,0]=4 407 B11R1.222 COC(=O)C1=CC=CN=C1C AC180513 [0,1,0,0,0,0|2,0,0]=3 408 B11R1.222 COC(=O)C1=CC=CN=C1N AC021174 [0,1,0,0,0,0|1,0,0]=2 409 B11R1.222 COC(=O)C1=CC=NC=C1F AC160577 [0,1,0,0,0,0|2,0,0]=3 410 B11R1.222 COC(=O)C1=CN=CC=C1C AC182396 [0,1,0,0,0,0|2,0,0]=3 411 B11R1.222 COC(=O)C1=CN=CC=C1N AC170093 [0,1,0,0,0,0|1,0,0]=2 412 B11R1.222 COC(=O)C1=NC=CN=C1Br AC210044 [0,1,0,0,0,0|3,0,0]=4 413 B11R1.222 COC(=O)C1=NC=CN=C1N AC180244 [0,1,0,0,0,0|2,0,0]=3 414 B11R1.222 FC1=CC=CC=C1C(=O)CBr AC190234 [0,1,0,0,0,0|1,0,0]=2 415 B11R1.222 NNC(=O)C1=CC=CC=C1O AC190220 [0,1,0,0,0,0|2,0,0]=3 416 B11R2.1 BrC1=CNC2=C1C=CC=N2 AC020574 [0,0,0,1,0,0|2,0,1]=4 417 B11R2.1 BrC1=NNC2=C1C=CC=C2 AC510758 [0,0,0,1,0,0|2,0,0]=3 418 B11R2.1 CC1=CNC2=C1C=CC=C2 AC500066 [0,0,0,1,0,0|1,0,0]=2 419 B11R2.1 CC1=CNC2=C1C=CC=N2 AC020743 [0,0,0,1,0,0|2,0,0]=3 420 B11R2.1 CN1C=CC2=C1C=CC=C2 AC510426 [0,0,0,1,0,0|3,0,0]=4 421 B11R2.1 IC1=CNC2=C1C=NC=C2 AC182228 [0,0,0,1,0,0|2,0,1]=4 422 B11R2.1 IC1=NNC2=C1C=CC=C2 AC181868 [0,0,0,1,0,0|2,0,0]=3 423 B11R2.1 IC1=NNC2=C1C=CN=C2 AC182656 [0,0,0,1,0,0|3,0,0]=4 424 B11R2.1 IC1=NNC2=NC=CC=C12 AC021469 [0,0,0,1,0,0|3,0,0]=4 425 B11R2.1 NC1=NNC2=C1C=CC=C2 AC180839 [0,0,0,1,0,0|2,0,0]=3 426 B11R2.1 NC1=NNC2=C1C=CC=N2 AC021468 [0,0,0,1,0,0|3,0,0]=4 427 B11R2.1 NC1CCC2=CC=CC=C12 AC190231 [0,0,0,1,0,0|2,0,1]=4 428 B11R2.1 O=C1CCC2=C1C=CC=C2 AC220153 [0,0,0,1,0,0|1,0,0]=2 429 B11R2.1 O=C1CCC2=CC=CN=C12 AC182161 [0,0,0,1,0,0|2,0,0]=3 430 B11R2.1 O=C1CCC2=NC=CC=C12 AC511871 [0,0,0,1,0,0|2,0,0]=3 431 B11R2.1 O=C1COC2=C1C=CC=C2 AC130193 [0,0,0,1,0,0|1,0,0]=2 432 B11R2.1 O=C1CSC2=CC=CC=C12 AC182209 [0,0,0,1,0,0|1,0,0]=2 433 B11R2.1 O=C1NCC2=CC=CC=C12 AC511115 [0,0,0,1,0,0|2,0,0]=3 434 B9R1.41 C1=NC(=C(N)S1)C(=O)N LN00337314 [0,0,0,0,1,0|3,0,0]=4 435 B9R1.41 CC(=O)C1=CNC=C1C AC330027 [0,0,0,0,1,0|2,0,0]=3 436 B9R1.41 CC1=C(C(=O)O)NC=C1 LN01237182 [0,0,0,0,1,0|3,0,0]=4 437 B9R1.41 CN1C=CC=C1C(=O)O LN00149766 [0,0,0,0,1,0|3,0,0]=4 438 B9R1.41 CN1C=CN=C1C(C)=O AC511919 [0,0,0,0,1,0|3,0,0]=4 439 B9R1.41 NC(=O)C1=C(N)N=CN1 AC510939 [0,0,0,0,1,0|3,0,0]=4 440 B9R1.41 NC(=O)C1=C(N)SC=C1 AC511070 [0,0,0,0,1,0|2,0,0]=3 441 B9R1.41 NC(=O)C1=C(N)SC=N1 AC182669 [0,0,0,0,1,0|3,0,0]=4 442 B9R1.41 NN1C=CC=C1C(N)=O AC182612 [0,0,0,0,1,0|2,0,0]=3 443 B9R1.41 OC(=O)C1=C(Br)SC=C1 AC100025 [0,0,0,0,1,0|3,0,0]=4 444 B9R1.41 OC(=O)C1=C(F)C=CS1 AC181662 [0,0,0,0,1,0|3,0,0]=4 445 B9R1.41 OC(=O)C1=CSC=C1Br AC050399 [0,0,0,0,1,0|3,0,0]=4 446 B11R1.86 C1=CC=C(C(=C1)CC(=N)N)Cl LN00242261 [0,0,0,0,0,1|3,0,0]=4 447 B11R1.86 C1=CC=C(C(=C1)CC(=O)O)Br LN00124676 [0,0,0,0,0,1|2,0,0]=3 448 B11R1.86 CC(=NC1=CC=CC=C1N)O LN00141995 [0,0,0,0,0,1|0,0,1]=2 449 B11R1.86 CC(=O)CC1=CC=CC=C1Br AC511603 [0,0,0,0,0,1|1,0,0]=2 450 B11R1.86 CC(C)OC1=CC=CC=C1N AC180979 [0,0,0,0,0,1|1,0,1]=3 451 B11R1.86 NC1=CC=CC=C1OC(F)F AC030138 [0,0,0,0,0,1|2,0,1]=4 452 B11R1.86 OC(=O)CC1=C(I)C=CC=C1 AC510681 [0,0,0,0,0,1|2,0,0]=3 453 B11R1.86 OC(=O)CC1=C(O)C=CC=C1 AC130768 [0,0,0,0,0,1|2,0,0]=3 454 B8R1.2 CNC1=NC=CC=C1 AC500327 [2,0,0,0,0,0|2,0,0]=4 455 B8R1.2 COC1=CC=NC=C1 AC510883 [2,0,0,0,0,0|2,0,0]=4 456 B8R1.2 O=CC1=CC=CN=C1 AC170118 [2,0,0,0,0,0|1,0,0]=3 457 B8R1.2 O=CC1=CC=NC=C1 AC180162 [2,0,0,0,0,0|1,0,0]=3 458 B8R1.2 O=CC1=NC=CC=C1 AC500026 [2,0,0,0,0,0|1,0,0]=3 459 B8R1.2 OCC1=CC=CC=C1 HY-B0892 [2,0,0,0,0,0|0,0,2]=4 460 B8R1.2 ONC1=CC=CC=C1 AC500156 [2,0,0,0,0,0|1,0,1]=4 461 B8R1.5 BrC1=CC=CC=C1I AC500034 [2,0,0,0,0,0|2,0,0]=4 462 B8R1.5 C1=CC(=C(F)N=C1)N LN00124624 [2,0,0,0,0,0|2,0,0]=4 463 B8R1.5 CC1=C(Br)C=CN=C1 AC181859 [2,0,0,0,0,0|2,0,0]=4 464 B8R1.5 CC1=C(Br)N=CC=C1 AC510729 [2,0,0,0,0,0|2,0,0]=4 465 B8R1.5 CC1=C(N)C=NC=C1 AC180724 [2,0,0,0,0,0|1,0,0]=3 466 B8R1.5 CC1=C(N)N=CN=C1 AC512148 [2,0,0,0,0,0|2,0,0]=4 467 B8R1.5 CC1=CC=CC=C1I AC510875 [2,0,0,0,0,0|1,0,0]=3 468 B8R1.5 CC1=CC=CN=C1F AC511615 [2,0,0,0,0,0|2,0,0]=4 469 B8R1.5 CC1=CN=CC=C1N AC181305 [2,0,0,0,0,0|1,0,0]=3 470 B8R1.5 CC1=CN=CC=C1N LN00001726 [2,0,0,0,0,0|1,0,0]=3 471 B8R1.5 CC1=CN=CC=C1O AC181809 [2,0,0,0,0,0|2,0,0]=4 472 B8R1.5 CC1=NC=CC=C1Br AC180855 [2,0,0,0,0,0|2,0,0]=4 473 B8R1.5 CC1=NC=CC=C1Cl AC181796 [2,0,0,0,0,0|2,0,0]=4 474 B8R1.5 CC1=NC=CC=C1O AC180647 [2,0,0,0,0,0|2,0,0]=4 475 B8R1.5 CC1=NC=CN=C1N AC182349 [2,0,0,0,0,0|2,0,0]=4 476 B8R1.5 CC1=NC=NC=C1N AC182384 [2,0,0,0,0,0|2,0,0]=4 477 B8R1.5 C[N+]1=C(Cl)C=CC=C1 AC130274 [2,0,0,0,0,0|2,0,0]=4 478 B8R1.5 ClC1=CC=CC=C1Br AC190163 [2,0,0,0,0,0|2,0,0]=4 479 B8R1.5 ClC1=CC=CC=C1I AC510876 [2,0,0,0,0,0|2,0,0]=4 480 B8R1.5 FC1=CC=CC=C1I AC190203 [2,0,0,0,0,0|2,0,0]=4 481 B8R1.5 IC1=CC=CC=C1I AC510877 [2,0,0,0,0,0|2,0,0]=4 482 B8R1.5 NC1=C(Br)C=NC=C1 AC181385 [2,0,0,0,0,0|2,0,0]=4 483 B8R1.5 NC1=C(Br)N=CC=C1 AC130122 [2,0,0,0,0,0|2,0,0]=4 484 B8R1.5 NC1=C(Cl)C=CC=N1 AC181688 [2,0,0,0,0,0|2,0,0]=4 485 B8R1.5 NC1=C(I)C=CC=C1 AC500016 [2,0,0,0,0,0|1,0,0]=3 486 B8R1.5 NC1=C(I)C=NC=C1 AC181474 [2,0,0,0,0,0|2,0,0]=4 487 B8R1.5 NC1=C(N)C=NC=C1 AC290039 [2,0,0,0,0,0|2,0,0]=4 488 B8R1.5 NC1=C(N)C=NC=C1 HY-14946 [2,0,0,0,0,0|2,0,0]=4 489 B8R1.5 NC1=C(O)C=CC=C1 AC190222 [2,0,0,0,0,0|0,0,1]=3 490 B8R1.5 NC1=CC=CC=C1F AC021683 [2,0,0,0,0,0|1,0,0]=3 491 B8R1.5 NC1=CC=CN=C1F AC511535 [2,0,0,0,0,0|2,0,0]=4 492 B8R1.5 NC1=CC=CN=C1N AC180156 [2,0,0,0,0,0|2,0,0]=4 493 B8R1.5 NC1=CC=CN=C1O AC500058 [2,0,0,0,0,0|1,0,1]=4 494 B8R1.5 NC1=CN=CC=C1Cl AC030140 [2,0,0,0,0,0|2,0,0]=4 495 B8R1.5 NC1=NC=CC=C1F AC500260 [2,0,0,0,0,0|2,0,0]=4 496 B8R1.5 NC1=NC=CC=C1I AC181297 [2,0,0,0,0,0|2,0,0]=4 497 B8R1.5 NC1=NC=CC=C1O AC511555 [2,0,0,0,0,0|1,0,1]=4 498 B8R1.5 OC1=C(Br)C=CC=C1 AC190217 [2,0,0,0,0,0|1,0,1]=4 499 B8R1.5 OC1=C(I)C=CC=C1 AC510212 [2,0,0,0,0,0|1,0,1]=4 500 B8R1.5 OC1=CC=CC=C1Cl AC190324 [2,0,0,0,0,0|1,0,1]=4 501 B8R1.5 OC1=COC=CC1=O AC182492 [2,0,0,0,0,0|2,0,0]=4 502 B10R1.13 C1=CC(=NC=C1Br)C(=O)O LN00009289 [1,1,0,0,0,0|2,0,0]=4 503 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 AC511499 [1,1,0,0,0,0|1,0,0]=3 504 B10R1.13 CC(=O)C1=CC=C(C)C=C1 AC511479 [1,1,0,0,0,0|0,0,0]=2 505 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 AC181609 [1,1,0,0,0,0|1,0,0]=3 506 B10R1.13 CC(=O)C1=CC=C(F)N=C1 AC182130 [1,1,0,0,0,0|1,0,0]=3 507 B10R1.13 CC(=O)C1=CC=C(N)C=C1 AC510510 [1,1,0,0,0,0|0,0,0]=2 508 B10R1.13 CC(=O)C1=CC=C(O)C=C1 AC190210 [1,1,0,0,0,0|0,0,0]=2 509 B10R1.13 CC(=O)C1=CC=C(O)N=C1 AC182574 [1,1,0,0,0,0|1,0,0]=3 510 B10R1.13 CC(=O)C1=CN=C(C=C1)Br LN00170457 [1,1,0,0,0,0|1,0,0]=3 511 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 AC181883 [1,1,0,0,0,0|1,0,0]=3 512 B10R1.13 CC1=CC=C(C=C1)C(O)=O AC190159 [1,1,0,0,0,0|1,0,0]=3 513 B10R1.13 CC1=CC=C(C=C1)S([O-])=O AC510965 [1,1,0,0,0,0|2,0,0]=4 514 B10R1.13 CC1=CN=C(C=C1)C(O)=O AC181304 [1,1,0,0,0,0|2,0,0]=4 515 B10R1.13 CN(C)C1=CC=C(C=C1)O LN00220688 [1,1,0,0,0,0|2,0,0]=4 516 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 AC020028 [1,1,0,0,0,0|1,0,1]=4 517 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 AC050507 [1,1,0,0,0,0|1,0,1]=4 518 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 AC050523 [1,1,0,0,0,0|1,0,1]=4 519 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 AC020207 [1,1,0,0,0,0|1,0,1]=4 520 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 AC500284 [1,1,0,0,0,0|1,0,1]=4 521 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 AC020024 [1,1,0,0,0,0|1,0,1]=4 522 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 AC050617 [1,1,0,0,0,0|1,0,1]=4 523 B10R1.13 NC(=N)C1=CC=C(Br)C=C1 AC181036 [1,1,0,0,0,0|2,0,0]=4 524 B10R1.13 NC(=N)C1=CC=C(Cl)C=C1 AC180714 [1,1,0,0,0,0|2,0,0]=4 525 B10R1.13 NC(=N)C1=CC=C(N)C=C1 AC511622 [1,1,0,0,0,0|2,0,0]=4 526 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 AC190321 [1,1,0,0,0,0|1,0,0]=3 527 B10R1.13 NC(=O)C1=CC=C(F)C=C1 AC511804 [1,1,0,0,0,0|1,0,0]=3 528 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 AC180441 [1,1,0,0,0,0|1,1,0]=4 529 B10R1.13 NC1=CC=C(C=C1)C(O)=O HY-B1008 [1,1,0,0,0,0|1,0,0]=3 530 B10R1.13 NC1=CC=C(N=C1)C(O)=O AC181509 [1,1,0,0,0,0|2,0,0]=4 531 B10R1.13 OC(=O)C1=CC=C(Br)C=N1 AC180939 [1,1,0,0,0,0|2,0,0]=4 532 B10R1.13 OC(=O)C1=CC=C(Br)N=C1 AC181373 [1,1,0,0,0,0|2,0,0]=4 533 B10R1.13 OC(=O)C1=CC=C(Cl)N=C1 AC180144 [1,1,0,0,0,0|2,0,0]=4 534 B10R1.13 OC(=O)C1=CC=C(F)N=C1 AC512097 [1,1,0,0,0,0|2,0,0]=4 535 B10R1.13 OC(=O)C1=CC=C(I)C=C1 AC510881 [1,1,0,0,0,0|1,0,0]=3 536 B10R1.13 OC(=O)C1=CC=C(O)C=C1 AC190218 [1,1,0,0,0,0|1,0,0]=3 537 B10R1.13 OC(=O)C1=CC=C(O)C=N1 AC181066 [1,1,0,0,0,0|2,0,0]=4 538 B10R1.13 OC(=O)C1=CC=C(O)N=C1 AC180148 [1,1,0,0,0,0|2,0,0]=4 539 B10R1.13 OC(=O)C1=NC=C(Cl)C=C1 AC510981 [1,1,0,0,0,0|2,0,0]=4 540 B10R1.13 OC(=O)C1=NC=C(F)C=C1 AC181804 [1,1,0,0,0,0|2,0,0]=4 541 B10R1.13 [O-][N+](=O)C1=CC=C(F)C=C1 AC500316 [1,1,0,0,0,0|2,0,0]=4 542 B10R1.15 BrCC(=O)C1=CC=CC=C1 AC190211 [1,1,0,0,0,0|0,0,0]=2 543 B10R1.15 BrCC(=O)C1=CC=NC=C1 AC190075 [1,1,0,0,0,0|1,0,0]=3 544 B10R1.15 BrCC(=O)C1=NC=CC=C1 AC190303 [1,1,0,0,0,0|1,0,0]=3 545 B10R1.15 C/C(=N\O)C1=CC=CN=C1 AC170016 [1,1,0,0,0,0|1,0,1]=4 546 B10R1.15 C1=CC(=NC=C1)C(=O)CBr LN00004265 [1,1,0,0,0,0|1,0,0]=3 547 B10R1.15 C1=CC=C(C=C1)C(=O)CN LN00159450 [1,1,0,0,0,0|0,0,0]=2 548 B10R1.15 C1=CC=C(C=C1)[C@@H](CO)O LN00236000 [1,1,0,0,0,0|0,0,2]=4 549 B10R1.15 CC(C=O)C1=CC=CC=C1 AC190221 [1,1,0,0,0,0|0,0,1]=3 550 B10R1.15 CCC(C1=CC=CC=C1)Br LN01357533 [1,1,0,0,0,0|1,0,1]=4 551 B10R1.15 COC(=O)C1=CC=CN=C1 AC190178 [1,1,0,0,0,0|1,0,0]=3 552 B10R1.15 COC(=O)C1=CC=NC=C1 AC180163 [1,1,0,0,0,0|1,0,0]=3 553 B10R1.15 COC(=O)C1=CC=NN=C1 AC182530 [1,1,0,0,0,0|2,0,0]=4 554 B10R1.15 COC(=O)C1=CN=CN=C1 AC050514 [1,1,0,0,0,0|2,0,0]=4 555 B10R1.15 COC(=O)C1=NC=CC=N1 AC021481 [1,1,0,0,0,0|2,0,0]=4 556 B10R1.15 NCC(=O)C1=CC=CC=C1 AC180291 [1,1,0,0,0,0|0,0,0]=2 557 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 AC510841 [1,1,0,0,0,0|0,0,2]=4 558 B10R1.15 NNC(=O)C1=CC=NC=C1 HY-B0329 [1,1,0,0,0,0|2,0,0]=4 559 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 AC180222 [1,1,0,0,0,0|1,0,1]=4 560 B10R1.15 N[C@H](CO)C1=CC=CC=C1 AC131619 [1,1,0,0,0,0|1,0,1]=4 561 B10R1.15 OCC(=O)C1=CC=CC=C1 AC180446 [1,1,0,0,0,0|0,0,0]=2 562 B10R1.28 CC(C)(N)C1=CC=CC=C1 AC500102 [1,1,0,0,0,0|1,0,1]=4 563 B10R1.28 ClS(=O)(=O)C1=CC=CC=C1 AC190208 [1,1,0,0,0,0|2,0,0]=4 564 B10R1.28 OS(=O)(=O)C1=CC=CC=C1 AC190167 [1,1,0,0,0,0|2,0,0]=4 565 B10R1.113 C1=C(C=NC=C1C(=O)O)Cl LN00003135 [1,1,0,0,0,0|2,0,0]=4 566 B10R1.113 C1=CC(=NC(=C1)Br)C(=O)O LN00009301 [1,1,0,0,0,0|2,0,0]=4 567 B10R1.113 C1=CC(=NC(=C1)F)C(=O)O LN00009991 [1,1,0,0,0,0|2,0,0]=4 568 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 AC020983 [1,1,0,0,0,0|1,0,0]=3 569 B10R1.113 CC(=O)C1=CC=CC(=N1)Br LN00004057 [1,1,0,0,0,0|1,0,0]=3 570 B10R1.113 CC(=O)C1=CC=CC(Br)=C1 AC500258 [1,1,0,0,0,0|0,0,0]=2 571 B10R1.113 CC(=O)C1=CC=CC(F)=C1 AC180005 [1,1,0,0,0,0|0,0,0]=2 572 B10R1.113 CC(=O)C1=CN=CC(Br)=C1 AC511684 [1,1,0,0,0,0|1,0,0]=3 573 B10R1.113 CC(=O)C1=NC(Br)=CC=C1 AC180989 [1,1,0,0,0,0|1,0,0]=3 574 B10R1.113 CC(=O)C1=NC(C)=CC=C1 AC181994 [1,1,0,0,0,0|1,0,0]=3 575 B10R1.113 CC(C1=CC(=CC=C1)Br)N LN01347982 [1,1,0,0,0,0|1,0,1]=4 576 B10R1.113 CC(N)C1=CC(O)=CC=C1 AC020799 [1,1,0,0,0,0|1,0,1]=4 577 B10R1.113 CC(N)C1=CC=CC(Br)=C1 AC021480 [1,1,0,0,0,0|1,0,1]=4 578 B10R1.113 CC(N)C1=CC=CC(Br)=C1 AC182169 [1,1,0,0,0,0|1,0,1]=4 579 B10R1.113 CC1=CC(=CC=N1)C(=O)O LN00011005 [1,1,0,0,0,0|2,0,0]=4 580 B10R1.113 CC1=CC(=CN=C1)C(O)=O AC181129 [1,1,0,0,0,0|2,0,0]=4 581 B10R1.113 CC1=CC=CC(=N1)C(O)=O AC180370 [1,1,0,0,0,0|2,0,0]=4 582 B10R1.113 CC1=NC=CC(=C1)C(O)=O AC510752 [1,1,0,0,0,0|2,0,0]=4 583 B10R1.113 CN(C)C1=CC=CC(O)=C1 AC190067 [1,1,0,0,0,0|2,0,0]=4 584 B10R1.113 C[C@@H](N)C1=CC=CC(Br)=C1 AC511565 [1,1,0,0,0,0|1,0,1]=4 585 B10R1.113 C[C@H](N)C1=CC(Br)=CC=C1 AC020029 [1,1,0,0,0,0|1,0,1]=4 586 B10R1.113 NC(=N)C1=CC=CC(Br)=C1 AC181813 [1,1,0,0,0,0|2,0,0]=4 587 B10R1.113 NC(=O)C1=CC(N)=CN=C1 AC182383 [1,1,0,0,0,0|2,0,0]=4 588 B10R1.113 NC(=O)C1=CC=CC(N)=C1 HY-12022 [1,1,0,0,0,0|1,0,0]=3 589 B10R1.113 NC(=O)C1=C[N+]([O-])=CC=C1 HY-101407 [1,1,0,0,0,0|2,0,0]=4 590 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 AC181190 [1,1,0,0,0,0|2,0,0]=4 591 B10R1.113 NC1=CC(=CC=N1)C(O)=O AC180915 [1,1,0,0,0,0|2,0,0]=4 592 B10R1.113 NC1=CC=CC(=N1)C(O)=O AC180914 [1,1,0,0,0,0|2,0,0]=4 593 B10R1.113 NC1=CN=CC(=C1)C(O)=O AC180732 [1,1,0,0,0,0|2,0,0]=4 594 B10R1.113 OC(=O)C1=CC(=O)NC=C1 AC181219 [1,1,0,0,0,0|2,0,0]=4 595 B10R1.113 OC(=O)C1=CC(Cl)=CC=N1 AC180860 [1,1,0,0,0,0|2,0,0]=4 596 B10R1.113 OC(=O)C1=CC(Cl)=NC=C1 AC511765 [1,1,0,0,0,0|2,0,0]=4 597 B10R1.113 OC(=O)C1=CC(F)=CN=C1 AC511690 [1,1,0,0,0,0|2,0,0]=4 598 B10R1.113 OC(=O)C1=CC(F)=NC=C1 AC181447 [1,1,0,0,0,0|2,0,0]=4 599 B10R1.113 OC(=O)C1=CC(I)=NC=C1 AC190088 [1,1,0,0,0,0|2,0,0]=4 600 B10R1.113 OC(=O)C1=CC(O)=CC=C1 AC190160 [1,1,0,0,0,0|1,0,0]=3 601 B10R1.113 OC(=O)C1=CC=CC(=O)N1 AC180866 [1,1,0,0,0,0|2,0,0]=4 602 B10R1.113 OC(=O)C1=CC=NC(Br)=C1 AC181281 [1,1,0,0,0,0|2,0,0]=4 603 B10R1.113 OC(=O)C1=CN(=O)=CC=C1 HY-B1061 [1,1,0,0,0,0|2,0,0]=4 604 B10R1.113 OC(=O)C1=CN=CC(Cl)=C1 AC180728 [1,1,0,0,0,0|2,0,0]=4 605 B10R1.113 OC(=O)C1=CN=CC(O)=C1 AC500286 [1,1,0,0,0,0|2,0,0]=4 606 B10R1.113 OC(=O)C1=NC(Br)=CC=C1 AC510356 [1,1,0,0,0,0|2,0,0]=4 607 B10R1.113 OC(=O)C1=NC(Cl)=CC=C1 AC180794 [1,1,0,0,0,0|2,0,0]=4 608 B10R1.113 OC(=O)C1=NC=CC(Br)=C1 AC511849 [1,1,0,0,0,0|2,0,0]=4 609 B10R1.113 OC(=O)C1=NC=CC(O)=C1 AC181051 [1,1,0,0,0,0|2,0,0]=4 610 B10R1.2 C1=CC(=C(C(=C1)Cl)N)C#N LN00173772 [1,1,0,0,0,0|1,0,1]=4 611 B10R1.2 CC1=C(C(=CC=C1)C=O)Cl LN01373184 [1,1,0,0,0,0|1,0,0]=3 612 B10R1.2 CC1=C(C(=CC=C1)C=O)O LN00226164 [1,1,0,0,0,0|1,0,0]=3 613 B10R1.2 CC1=C(F)C=CC=C1C=O AC180620 [1,1,0,0,0,0|1,0,0]=3 614 B10R1.2 CC1=C(O)C(C=O)=CC=C1 AC511803 [1,1,0,0,0,0|1,0,0]=3 615 B10R1.2 CC1=C(O)C=CC=C1C=O AC182557 [1,1,0,0,0,0|1,0,0]=3 616 B10R1.2 COC1=C(Br)C(F)=CC=C1 AC130062 [1,1,0,0,0,0|2,0,0]=4 617 B10R1.2 COC1=C(C)C(C)=CC=C1 AC021515 [1,1,0,0,0,0|2,0,0]=4 618 B10R1.2 COC1=C(Cl)C(N)=CC=C1 AC020504 [1,1,0,0,0,0|2,0,0]=4 619 B10R1.2 COC1=C(F)C(F)=CC=C1 AC181264 [1,1,0,0,0,0|2,0,0]=4 620 B10R1.2 COC1=C(N)C(C)=CC=C1 AC511717 [1,1,0,0,0,0|1,0,0]=3 621 B10R1.2 COC1=CC=CC(Br)=C1C AC182617 [1,1,0,0,0,0|2,0,0]=4 622 B10R1.2 COC1=CC=CC(N)=C1C AC020524 [1,1,0,0,0,0|2,0,0]=4 623 B10R1.2 COC1=CC=CC(N)=C1C AC181971 [1,1,0,0,0,0|2,0,0]=4 624 B10R1.2 COC1=CC=CC(N)=C1Cl AC020005 [1,1,0,0,0,0|2,0,0]=4 625 B10R1.2 ClC1=C(Cl)C(C=O)=CC=C1 AC510904 [1,1,0,0,0,0|1,0,0]=3 626 B10R1.2 FC1=C(Br)C=CC=C1C=O AC020867 [1,1,0,0,0,0|1,0,0]=3 627 B10R1.2 FC1=C(C=O)C=CC=C1Cl AC510971 [1,1,0,0,0,0|1,0,0]=3 628 B10R1.2 FC1=C(F)C(C=O)=CC=C1 AC160002 [1,1,0,0,0,0|1,0,0]=3 629 B10R1.2 NC1=C(Cl)C=CC=C1C#N AC511724 [1,1,0,0,0,0|1,0,1]=4 630 B10R1.2 OC1=C(Br)C(C=O)=CC=C1 AC511063 [1,1,0,0,0,0|1,0,0]=3 631 B10R1.2 OC1=C(C=O)C=CC=C1Br AC500094 [1,1,0,0,0,0|1,0,0]=3 632 B10R1.2 OC1=C(C=O)C=CC=C1F AC511686 [1,1,0,0,0,0|1,0,0]=3 633 B10R1.2 OC1=C(Cl)C(C=O)=CC=C1 AC020595 [1,1,0,0,0,0|1,0,0]=3 634 B10R1.2 OC1=C(Cl)C=CC=C1C=O AC510684 [1,1,0,0,0,0|1,0,0]=3 635 B10R1.4 C1=CC=C(C(=C1)CC=O)Br LN00181697 [1,1,0,0,0,0|1,0,0]=3 636 B10R1.4 C1=CC=C(C(=C1)CC=O)Cl LN00180075 [1,1,0,0,0,0|1,0,0]=3 637 B10R1.4 C1=CC=C(C(=C1)CC=O)F LN00181093 [1,1,0,0,0,0|1,0,0]=3 638 B10R1.4 C1=CC=C(C(=C1)CCO)Br LN00142608 [1,1,0,0,0,0|1,0,1]=4 639 B10R1.4 C1=CC=C(C(=C1)CCO)Cl LN00192290 [1,1,0,0,0,0|1,0,1]=4 640 B10R1.4 CC1=CC=CC=C1CC=O LN00181191 [1,1,0,0,0,0|1,0,0]=3 641 B10R1.4 CC1=CC=CC=C1N=CO LN00241919 [1,1,0,0,0,0|1,0,1]=4 642 B10R1.4 CCOC1=CC=CC=C1N AC190317 [1,1,0,0,0,0|0,0,1]=3 643 B10R1.4 NCCC1=CC=CC=C1N AC070086 [1,1,0,0,0,0|0,0,1]=3 644 B10R1.4 NCCC1=CC=CC=C1O AC050448 [1,1,0,0,0,0|1,0,1]=4 645 B10R1.4 O/N=C/C1=CC=CC=C1F AC051165 [1,1,0,0,0,0|1,0,1]=4 646 B10R1.4 OCCC1=CC=CC=C1Br AC180682 [1,1,0,0,0,0|1,0,1]=4 647 B10R1.20 C#CC1=CC=CC=C1C=O LN01316618 [1,1,0,0,0,0|1,0,0]=3 648 B10R1.20 CNC1=CC=CC=C1NC AC050961 [1,1,0,0,0,0|1,0,0]=3 649 B10R1.20 COC1=C(C=O)C=CC=C1 AC500195 [1,1,0,0,0,0|1,0,0]=3 650 B10R1.20 COC1=C(C=O)C=NC=C1 AC190044 [1,1,0,0,0,0|2,0,0]=4 651 B10R1.20 COC1=CC=CC=C1C#N AC510922 [1,1,0,0,0,0|1,0,1]=4 652 B10R1.20 COC1=CC=CC=C1NN AC180402 [1,1,0,0,0,0|1,0,0]=3 653 B10R1.20 COC1=NC=CC=C1C=O AC190310 [1,1,0,0,0,0|2,0,0]=4 654 B10R1.20 NCC1=C(C=CC=C1)C#N AC182058 [1,1,0,0,0,0|1,0,1]=4 655 B10R1.20 NCC1=CC=CC=C1CO AC182374 [1,1,0,0,0,0|0,0,2]=4 656 B10R1.20 O=CC1=C(C=CC=C1)C#N AC190314 [1,1,0,0,0,0|0,0,1]=3 657 B10R1.25 C1=C(C(=CN=C1Cl)C=O)N LN01359750 [1,1,0,0,0,0|1,0,0]=3 658 B10R1.25 C1=CC(=CC(=C1C#N)N)F LN00167077 [1,1,0,0,0,0|1,0,1]=4 659 B10R1.25 C1=CC(=CC(=C1C=O)N)F LN01315478 [1,1,0,0,0,0|0,0,0]=2 660 B10R1.25 C1=CC(=NC(=C1C=O)N)Br LN02219294 [1,1,0,0,0,0|1,0,0]=3 661 B10R1.25 CC1=CC(=C(C=C1)C=O)F LN00181719 [1,1,0,0,0,0|1,0,0]=3 662 B10R1.25 CC1=CC(Br)=CC=C1C=O AC510700 [1,1,0,0,0,0|1,0,0]=3 663 B10R1.25 CC1=CC(Cl)=CC=C1C=O AC181463 [1,1,0,0,0,0|1,0,0]=3 664 B10R1.25 CC1=CC(F)=C(C=O)C=C1 AC511511 [1,1,0,0,0,0|1,0,0]=3 665 B10R1.25 CC1=CC(F)=CC=C1C=O AC181464 [1,1,0,0,0,0|1,0,0]=3 666 B10R1.25 CC1=CC=C(C=O)C(O)=C1 AC511779 [1,1,0,0,0,0|1,0,0]=3 667 B10R1.25 COC1=C(F)C=C(N)C=C1 AC500320 [1,1,0,0,0,0|2,0,0]=4 668 B10R1.25 COC1=CC=C(Br)C=C1C AC511516 [1,1,0,0,0,0|2,0,0]=4 669 B10R1.25 COC1=CC=C(Br)C=C1F AC180272 [1,1,0,0,0,0|2,0,0]=4 670 B10R1.25 COC1=CC=C(Br)C=C1O AC510743 [1,1,0,0,0,0|2,0,0]=4 671 B10R1.25 COC1=CC=C(F)C=C1Br AC130052 [1,1,0,0,0,0|2,0,0]=4 672 B10R1.25 COC1=CC=C(F)C=C1O AC180763 [1,1,0,0,0,0|2,0,0]=4 673 B10R1.25 COC1=CC=C(N)C=C1Br AC500244 [1,1,0,0,0,0|2,0,0]=4 674 B10R1.25 COC1=NC=C(Br)C=C1N AC020839 [1,1,0,0,0,0|2,0,0]=4 675 B10R1.25 ClC1=C(C=O)C=CC(Br)=C1 AC511532 [1,1,0,0,0,0|1,0,0]=3 676 B10R1.25 ClC1=CC(Br)=C(C=O)C=C1 AC511094 [1,1,0,0,0,0|1,0,0]=3 677 B10R1.25 ClC1=CC(Cl)=NC=C1C=O AC250026 [1,1,0,0,0,0|2,0,0]=4 678 B10R1.25 ClC1=CC=C(C=O)C(Cl)=C1 AC510984 [1,1,0,0,0,0|1,0,0]=3 679 B10R1.25 ClC1=CC=C(C=O)C(Cl)=N1 AC511930 [1,1,0,0,0,0|2,0,0]=4 680 B10R1.25 FC1=C(C=O)C=CC(Br)=C1 AC510847 [1,1,0,0,0,0|1,0,0]=3 681 B10R1.25 FC1=CC(Cl)=C(C=O)C=C1 AC500099 [1,1,0,0,0,0|1,0,0]=3 682 B10R1.25 FC1=CC(Cl)=CC=C1C=O AC510870 [1,1,0,0,0,0|1,0,0]=3 683 B10R1.25 FC1=CC(F)=C(C=O)C=C1 AC500219 [1,1,0,0,0,0|1,0,0]=3 684 B10R1.25 FC1=CC=C(C=O)C(F)=N1 AC182270 [1,1,0,0,0,0|2,0,0]=4 685 B10R1.25 NC1=CC(Br)=CC=C1C#N AC511157 [1,1,0,0,0,0|1,0,1]=4 686 B10R1.25 NC1=CC(Br)=CC=C1C=O AC182295 [1,1,0,0,0,0|0,0,0]=2 687 B10R1.25 OC1=CC(Br)=CC=C1C=O AC130078 [1,1,0,0,0,0|1,0,0]=3 688 B10R1.25 OC1=CC(Cl)=C(C=O)C=C1 AC180515 [1,1,0,0,0,0|1,0,0]=3 689 B10R1.25 OC1=CC(Cl)=CC=C1C=O AC510701 [1,1,0,0,0,0|1,0,0]=3 690 B10R1.25 OC1=CC(O)=C(C=O)C=C1 AC511006 [1,1,0,0,0,0|1,0,0]=3 691 B10R1.25 OC1=CC=C(C=O)C(Br)=C1 AC511225 [1,1,0,0,0,0|1,0,0]=3 692 B10R1.30 BrC1=CC=C(Br)C(C=O)=C1 AC510951 [1,1,0,0,0,0|1,0,0]=3 693 B10R1.30 BrC1=CC=C(I)C(C=O)=C1 AC512099 [1,1,0,0,0,0|1,0,0]=3 694 B10R1.30 C1=C(C=C(C=O)C(=C1)I)F LN00180413 [1,1,0,0,0,0|1,0,0]=3 695 B10R1.30 C1=C(C=C(C=O)C(=C1)N)Cl LN00175145 [1,1,0,0,0,0|0,0,0]=2 696 B10R1.30 C1=C(C=C(CO)C(=C1)N)Br LN00152170 [1,1,0,0,0,0|0,0,2]=4 697 B10R1.30 CC1=CC(=C(C=C1)N)C#N LN00009384 [1,1,0,0,0,0|1,0,1]=4 698 B10R1.30 CC1=CC=C(Br)C(C=O)=C1 AC511861 [1,1,0,0,0,0|1,0,0]=3 699 B10R1.30 CCC1=CC(=CC=C1F)Br LN01279639 [1,1,0,0,0,0|1,0,1]=4 700 B10R1.30 CCC1=CC(Br)=CC=C1N AC021532 [1,1,0,0,0,0|0,0,1]=3 701 B10R1.30 COC1=C(Br)C=CC(Cl)=C1 AC511561 [1,1,0,0,0,0|2,0,0]=4 702 B10R1.30 COC1=C(Cl)C=CC(N)=C1 AC511495 [1,1,0,0,0,0|2,0,0]=4 703 B10R1.30 COC1=CC(=CC=C1Br)O LN00004696 [1,1,0,0,0,0|2,0,0]=4 704 B10R1.30 COC1=CC(Br)=CC=C1N AC510860 [1,1,0,0,0,0|1,0,0]=3 705 B10R1.30 COC1=CC(F)=CC=C1N AC040109 [1,1,0,0,0,0|1,0,0]=3 706 B10R1.30 COC1=CC(N)=CC=C1Br AC500116 [1,1,0,0,0,0|2,0,0]=4 707 B10R1.30 COC1=CC(N)=CC=C1C AC510672 [1,1,0,0,0,0|2,0,0]=4 708 B10R1.30 COC1=CC(N)=CC=C1F AC511952 [1,1,0,0,0,0|2,0,0]=4 709 B10R1.30 COC1=NC(C)=CC=C1N AC181576 [1,1,0,0,0,0|2,0,0]=4 710 B10R1.30 ClC1=C(C=O)C=C(Br)C=C1 AC512059 [1,1,0,0,0,0|1,0,0]=3 711 B10R1.30 ClC1=CC=C(Br)C(C=O)=C1 AC500233 [1,1,0,0,0,0|1,0,0]=3 712 B10R1.30 FC1=C(C=O)C=C(Br)C=C1 AC021686 [1,1,0,0,0,0|1,0,0]=3 713 B10R1.30 FC1=CC=C(Br)C(C=O)=C1 AC130147 [1,1,0,0,0,0|1,0,0]=3 714 B10R1.30 FC1=CC=C(Cl)C(C=O)=C1 AC181706 [1,1,0,0,0,0|1,0,0]=3 715 B10R1.30 FC1=CC=C(F)C(C=O)=C1 AC130353 [1,1,0,0,0,0|1,0,0]=3 716 B10R1.30 FC1=NC=C(Br)C=C1C=O AC510989 [1,1,0,0,0,0|2,0,0]=4 717 B10R1.30 NCC1=C(N)C=CC(Cl)=C1 AC200134 [1,1,0,0,0,0|1,0,1]=4 718 B10R1.30 OC1=C(C=O)C=C(Br)C=C1 AC130239 [1,1,0,0,0,0|1,0,0]=3 719 B10R1.30 OC1=C(C=O)C=C(Cl)C=C1 AC510907 [1,1,0,0,0,0|1,0,0]=3 720 B10R1.30 OC1=C(C=O)C=C(F)C=C1 AC131640 [1,1,0,0,0,0|1,0,0]=3 721 B10R1.30 OC1=CC(C=O)=C(Br)C=C1 AC500124 [1,1,0,0,0,0|1,0,0]=3 722 B10R1.30 OC1=CC=C(Cl)C(C=O)=C1 AC511254 [1,1,0,0,0,0|1,0,0]=3 723 B10R1.30 OC1=NC=C(Br)C(C=O)=C1 AC050936 [1,1,0,0,0,0|2,0,0]=4 724 B10R1.245 BrC1=CC=CC(Br)=C1C=O AC511829 [1,1,0,0,0,0|1,0,0]=3 725 B10R1.245 BrC1=CN=CC(Br)=C1C=O AC181963 [1,1,0,0,0,0|2,0,0]=4 726 B10R1.245 C1=CC(=C(C=O)C(=C1)N)F LN00179804 [1,1,0,0,0,0|0,0,0]=2 727 B10R1.245 C1=CC(=C(C=O)C(=C1)O)Cl LN00172491 [1,1,0,0,0,0|1,0,0]=3 728 B10R1.245 C1=CC(=C(C=O)C(=C1)O)F LN00011257 [1,1,0,0,0,0|1,0,0]=3 729 B10R1.245 CC1=CC=CC(C)=C1C=O AC510633 [1,1,0,0,0,0|1,0,0]=3 730 B10R1.245 ClC1=C(C=O)C(I)=CC=N1 AC181594 [1,1,0,0,0,0|2,0,0]=4 731 B10R1.245 ClC1=CC=CC(Cl)=C1C=O AC511806 [1,1,0,0,0,0|1,0,0]=3 732 B10R1.245 ClC1=CC=NC(Cl)=C1C=O AC510645 [1,1,0,0,0,0|2,0,0]=4 733 B10R1.245 FC1=C(C=O)C(Br)=CC=C1 AC181608 [1,1,0,0,0,0|1,0,0]=3 734 B10R1.245 FC1=C(C=O)C(I)=CC=N1 AC512029 [1,1,0,0,0,0|2,0,0]=4 735 B10R1.245 FC1=CC=CC(F)=C1C=O AC500128 [1,1,0,0,0,0|1,0,0]=3 736 B10R1.245 NC1=C(C#N)C(F)=CC=C1 AC130213 [1,1,0,0,0,0|1,0,1]=4 737 B10R1.245 NC1=CC=CC(Br)=C1C#N AC511794 [1,1,0,0,0,0|1,0,1]=4 738 B10R1.245 OC1=C(C=O)C(Br)=CC=C1 AC130094 [1,1,0,0,0,0|1,0,0]=3 739 B10R1.245 OC1=C(C=O)C(Cl)=CC=C1 AC511571 [1,1,0,0,0,0|1,0,0]=3 740 B10R1.245 OC1=CC=CC(O)=C1C=O AC130064 [1,1,0,0,0,0|1,0,0]=3 741 B10R1.149 CC1=C(C(=O)OC)SC=C1 LN00225784 [0,1,0,0,1,0|2,0,0]=4 742 B10R1.149 COC(=O)C1=C(Br)C=CS1 AC180822 [0,1,0,0,1,0|2,0,0]=4 743 B10R1.149 COC(=O)C1=C(C)C=CO1 AC130320 [0,1,0,0,1,0|2,0,0]=4 744 B10R1.149 COC(=O)C1=C(C)C=CS1 AC180945 [0,1,0,0,1,0|2,0,0]=4 745 B10R1.149 COC(=O)C1=C(Cl)C=CN1 AC182790 [0,1,0,0,1,0|2,0,0]=4 746 B10R1.149 COC(=O)C1=C(N)C=NN1 AC021509 [0,1,0,0,1,0|2,0,0]=4 747 B10R1.149 COC(=O)C1=C(N)N=CS1 AC040080 [0,1,0,0,1,0|2,0,0]=4 748 B10R1.149 COC(=O)C1=C(N)SC=C1 AC500044 [0,1,0,0,1,0|1,0,0]=3 749 B10R1.149 COC(=O)C1=C(O)C=CS1 AC020953 [0,1,0,0,1,0|2,0,0]=4 750 B12R1.75 COC1=CC=CC=C1CC(O)=O AC190219 [0,1,0,0,0,1|2,0,0]=4 751 B12R1.75 CSC1=CC=CC=C1NC(C)=O HY-18594 [0,1,0,0,0,1|1,0,0]=3 752 B12R1.75 OC(=O)CC1=CC=CC=C1C=O AC021504 [0,1,0,0,0,1|2,0,0]=4 753 B12R1.124 NC(C(O)=O)C1=C(Cl)C=CC=C1 AC180493 [0,1,0,0,0,1|2,0,0]=4 754 B12R1.124 OC(C(O)=O)C1=CC=CC=C1Cl AC180660 [0,1,0,0,0,1|2,0,0]=4 755 B12R1.124 O[C@H](C(O)=O)C1=CC=CC=C1Cl AC181111 [0,1,0,0,0,1|2,0,0]=4 756 B12R1.127 CC(=O)NC1=C(Br)C=CC(C)=N1 AC051142 [0,1,0,0,0,1|2,0,0]=4 757 B12R1.224 C1=CC(=C(C(=C1)F)F)CC(=O)O LN00116508 [0,1,0,0,0,1|2,0,0]=4 758 B12R1.224 OC(=O)CC1=CC=CC(Br)=C1F AC050655 [0,1,0,0,0,1|2,0,0]=4 759 B12R1.224 OC(=O)CC1=CC=CC(F)=C1F AC180442 [0,1,0,0,0,1|2,0,0]=4 760 B12R1.233 OC(=O)CC1=C(F)C=C(Br)C=C1 AC511468 [0,1,0,0,0,1|2,0,0]=4 761 B12R1.371 COC(=O)CC1=C(Br)C=CC=C1 AC500125 [0,1,0,0,0,1|1,0,0]=3 762 B12R1.1009 C1=CC(=C(CC(=O)O)C(=C1)F)F LN00116491 [0,1,0,0,0,1|2,0,0]=4 763 B12R1.46 COC1=CC=C(Br)C=C1C(O)=O AC511620 [0,2,0,0,0,0|2,0,0]=4 764 B12R1.46 NCC1=CC=C(Cl)C=C1[N+]([O-])=O AC100001 [0,2,0,0,0,0|2,0,0]=4 765 B12R1.46 OC(=O)C1=CC(Cl)=CC=C1C=C AC080602 [0,2,0,0,0,0|2,0,0]=4 766 B12R1.57 COC1=CC(Br)=CC=C1C(C)=O AC512144 [0,2,0,0,0,0|1,0,0]=3 767 B12R1.57 COC1=CC(F)=CC=C1C(O)=O AC181080 [0,2,0,0,0,0|2,0,0]=4 768 B12R1.57 NC1=CC=C(C([O-])=O)C(O[Na])=C1 HY-I0447A [0,2,0,0,0,0|2,0,0]=4 769 B12R1.77 BrCC(=O)C1=C(C=CC=C1)C#N AC250033 [0,2,0,0,0,0|0,0,1]=3 770 B12R1.77 CNC1=CC=CC=C1C(=O)OC AC021164 [0,2,0,0,0,0|0,0,0]=2 771 B12R1.77 COC(=O)C1=C(CBr)C=CC=C1 AC511028 [0,2,0,0,0,0|1,0,0]=3 772 B12R1.77 COC(=O)C1=CC=CC=C1CBr LN00174655 [0,2,0,0,0,0|1,0,0]=3 773 B12R1.77 COC1=C(C=CC=C1)C(=O)NN AC190068 [0,2,0,0,0,0|2,0,0]=4 774 B12R1.261 C[C@@H](N)C1=CC=CC=C1[N+]([O-])=O AC020485 [0,2,0,0,0,0|2,0,0]=4 775 B12R1.261 C[C@H](N)C1=C(C=CC=C1)[N+]([O-])=O AC020093 [0,2,0,0,0,0|2,0,0]=4 776 B12R1.261 OB(O)C1=CC=CC=C1C(O)=O AC090072 [0,2,0,0,0,0|2,0,0]=4 777 B12R1.261 OC(=O)C1=C(C=CC=C1)[I](=O)=O AC130202 [0,2,0,0,0,0|2,0,0]=4 778 B12R1.261 OC(=O)C1=CC=CC=C1C(F)F AC010380 [0,2,0,0,0,0|2,0,0]=4 779 B12R1.283 CCOC1=CC=CC=C1C(N)=O HY-B1428 [0,2,0,0,0,0|2,0,0]=4 780 B12R1.283 CNCC1=C(C=CC=C1)[N+]([O-])=O AC040088 [0,2,0,0,0,0|2,0,0]=4 781 B12R1.437 CCC1=C(C(O)=O)C(N)=CC=C1 AC050616 [0,2,0,0,0,0|1,0,0]=3 782 B12R1.437 COC1=C(C(C)=O)C(O)=CC=C1 AC180230 [0,2,0,0,0,0|1,0,0]=3 783 B12R1.437 COC1=C(C(O)=O)C(C)=CC=C1 AC050034 [0,2,0,0,0,0|2,0,0]=4 784 B12R1.437 COC1=C(C(O)=O)C(N)=CC=C1 AC181382 [0,2,0,0,0,0|1,0,0]=3 785 B12R1.195 CNS(=O)(=O)C1=CC=CC=C1N AC021492 [0,2,0,0,0,0|1,0,0]=3 786 B12R1.894 NC1=C(I)C=CC(F)=C1[N+]([O-])=O AC010433 [0,2,0,0,0,0|2,0,0]=4 787 B12R1.1000 CC(=O)C1=C(C=C(C=C1O)Br)F LN01360961 [0,2,0,0,0,0|1,0,0]=3 788 B12R1.1000 CC(=O)C1=C(F)C=C(Br)C=C1F AC512017 [0,2,0,0,0,0|1,0,0]=3 789 B12R1.1000 CC1=CC(C)=C(C(O)=O)C(C)=C1 AC511710 [0,2,0,0,0,0|2,0,0]=4 790 B12R1.1000 NC1=CC(F)=CC(F)=C1C(O)=O AC181690 [0,2,0,0,0,0|1,0,0]=3 791 B12R1.1000 OC(=O)C1=C(F)C=C(Br)C=C1F AC500129 [0,2,0,0,0,0|2,0,0]=4 792 B12R1.1000 OC(=O)C1=C(F)C=C(F)C=C1F AC180458 [0,2,0,0,0,0|2,0,0]=4 793 B12R1.1000 OC(=O)C1=C(F)C=C(O)C=C1F AC181555 [0,2,0,0,0,0|2,0,0]=4 794 B12R1.3441 COC(=O)C1=C(C)C=CC=C1Br AC511043 [0,2,0,0,0,0|1,0,0]=3 795 B12R1.3441 COC(=O)C1=C(Cl)N=CC=C1Cl AC182615 [0,2,0,0,0,0|2,0,0]=4 796 B12R1.3441 COC(=O)C1=C(F)C=CC=C1F AC020997 [0,2,0,0,0,0|1,0,0]=3 797 B12R1.3441 COC(=O)C1=C(O)C=CC=C1O AC130166 [0,2,0,0,0,0|1,0,0]=3 798 B12R1.24 COC(=O)C1=C(C(=CC=C1)N)F LN01330791 [0,2,0,0,0,0|1,0,0]=3 799 B12R1.24 COC(=O)C1=C(N)C(Br)=NC=C1 AC050996 [0,2,0,0,0,0|1,0,0]=3 800 B12R1.24 COC(=O)C1=C(N)C(Cl)=NC=C1 AC181621 [0,2,0,0,0,0|1,0,0]=3 801 B12R1.24 COC(=O)C1=CC=CC(C)=C1Br AC180768 [0,2,0,0,0,0|1,0,0]=3 802 B12R1.24 COC(=O)C1=CC=CC(C)=C1C AC512000 [0,2,0,0,0,0|1,0,0]=3 803 B12R1.24 COC(=O)C1=CC=CC(N)=C1O AC051060 [0,2,0,0,0,0|1,0,0]=3 804 B12R1.440 COC1=C(N)C(=CC=C1)C(O)=O AC180617 [0,2,0,0,0,0|1,0,0]=3 805 B12R1.440 COC1=CC=CC(=C1N)[N+](=O)[O-] LN00009176 [0,2,0,0,0,0|2,0,0]=4 806 B12R1.440 COC1=CC=CC(C(O)=O)=C1C AC181402 [0,2,0,0,0,0|2,0,0]=4 807 B12R1.440 OC(=O)C1=CC=CC(C#N)=C1F AC512012 [0,2,0,0,0,0|2,0,0]=4 808 B12R1.511 CC(=O)C1=C(C(=CC(=C1)Cl)Cl)F LN00222784 [0,2,0,0,0,0|1,0,0]=3 809 B12R1.511 CC1=CC(Br)=CC(=C1N)[N+]([O-])=O AC021332 [0,2,0,0,0,0|2,0,0]=4 810 B12R1.511 CC1=CC(C)=C(N)C(=C1)C(O)=O AC130032 [0,2,0,0,0,0|1,0,0]=3 811 B12R1.511 CC1=CC(Cl)=CC(C(O)=O)=C1N AC181468 [0,2,0,0,0,0|1,0,0]=3 812 B12R1.511 NC1=C(C=C(Br)C=C1F)[N+]([O-])=O AC511878 [0,2,0,0,0,0|2,0,0]=4 813 B12R1.511 NC1=C(C=C(F)C=C1Br)[N+]([O-])=O AC130055 [0,2,0,0,0,0|2,0,0]=4 814 B12R1.511 NC1=C(F)C=C(F)C=C1C(O)=O AC512106 [0,2,0,0,0,0|1,0,0]=3 815 B12R1.511 NC1=CC(Br)=CC(=C1N)[N+]([O-])=O AC182468 [0,2,0,0,0,0|2,0,0]=4 816 B12R1.893 C1=CC(=C(C(=C1C(=O)O)F)Br)F LN00216149 [0,2,0,0,0,0|2,0,0]=4 817 B12R1.893 CC1=CC=C(C(O)=O)C(N)=C1C AC180737 [0,2,0,0,0,0|1,0,0]=3 818 B12R1.893 OC(=O)C1=C(Br)C(F)=C(F)C=C1 AC512145 [0,2,0,0,0,0|2,0,0]=4 819 B12R1.232 C1=C(C(=CC(=C1F)Br)N)C(=O)O LN01319400 [0,2,0,0,0,0|1,0,0]=3 820 B12R1.232 CC(=O)C1=CC(C)=C(C)C=C1O AC160404 [0,2,0,0,0,0|1,0,0]=3 821 B12R1.232 CC1=CC(=C(C=C1Cl)N)[N+](=O)[O-] LN00177104 [0,2,0,0,0,0|2,0,0]=4 822 B12R1.232 CC1=CC(C)=C(Br)C=C1C(O)=O AC010473 [0,2,0,0,0,0|2,0,0]=4 823 B12R1.232 CC1=CC(F)=C(C=C1F)C(O)=O AC182219 [0,2,0,0,0,0|2,0,0]=4 824 B12R1.232 NC1=C(C=C(F)C(F)=C1)C(O)=O AC180632 [0,2,0,0,0,0|1,0,0]=3 825 B12R1.232 OC(=O)C1=C(F)C=C(Br)C(Cl)=C1 AC512163 [0,2,0,0,0,0|2,0,0]=4 826 B12R1.232 OC(=O)C1=CC(Br)=C(F)C=C1Cl AC250023 [0,2,0,0,0,0|2,0,0]=4 827 B12R1.232 OC(=O)C1=CC(Cl)=C(F)C=C1F AC181990 [0,2,0,0,0,0|2,0,0]=4 828 B12R1.232 OC(=O)C1=CC(F)=C(Br)C=C1Cl AC180968 [0,2,0,0,0,0|2,0,0]=4 829 B12R1.452 COC1=CC(F)=C(C=C1)C(O)=O AC181047 [0,2,0,0,0,0|2,0,0]=4 830 B12R1.452 COC1=CC(N)=C(C=C1)C(O)=O AC181072 [0,2,0,0,0,0|1,0,0]=3 831 B12R1.452 COC1=CC=C(C(C)=O)C(O)=C1 HY-N0159 [0,2,0,0,0,0|1,0,0]=3 832 B12R1.452 COC1=CC=C(C(N)=C1)[N+]([O-])=O AC021255 [0,2,0,0,0,0|2,0,0]=4 833 B12R1.452 OC(=O)C1=CC=C(C=C1F)C#N AC511542 [0,2,0,0,0,0|2,0,0]=4 834 B12R1.1703 CNC(=O)C1=C(F)C=C(N)C=C1 AC020117 [0,2,0,0,0,0|1,0,0]=3 835 B12R1.1703 COC(=O)C1=C(C=C(C=C1)F)F LN00222667 [0,2,0,0,0,0|1,0,0]=3 836 B12R1.1703 COC(=O)C1=C(N)C=C(Br)C=C1 AC511119 [0,2,0,0,0,0|0,0,0]=2 837 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1C AC182536 [0,2,0,0,0,0|1,0,0]=3 838 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1Cl AC182567 [0,2,0,0,0,0|1,0,0]=3 839 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1F AC181941 [0,2,0,0,0,0|1,0,0]=3 840 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1O AC511146 [0,2,0,0,0,0|1,0,0]=3 841 B12R1.1703 COC(=O)C1=CC=C(F)C=C1N AC160360 [0,2,0,0,0,0|0,0,0]=2 842 B12R1.1703 COC(=O)C1=CC=C(F)C=C1O AC181401 [0,2,0,0,0,0|1,0,0]=3 843 B12R1.1703 COC(=O)C1=CC=C(N)C=C1C AC182296 [0,2,0,0,0,0|1,0,0]=3 844 B12R1.1703 COC(=O)C1=CC=C(N)C=C1F AC511082 [0,2,0,0,0,0|1,0,0]=3 845 B12R1.1703 COC(=O)C1=CC=C(O)C=C1F AC511585 [0,2,0,0,0,0|1,0,0]=3 846 B12R1.1703 COC(=O)C1=CN=C(Cl)C=C1Cl AC181855 [0,2,0,0,0,0|2,0,0]=4 847 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1C AC051189 [0,2,0,0,0,0|2,0,0]=4 848 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1C AC200060 [0,2,0,0,0,0|2,0,0]=4 849 B12R1.1703 ClC1=CC=C(C(=O)CBr)C(Cl)=C1 AC190239 [0,2,0,0,0,0|1,0,0]=3 850 B12R1.354 CC1=C(C=C(C=C1)I)C(=O)OC LN01358463 [0,2,0,0,0,0|1,0,0]=3 851 B12R1.354 COC(=O)C1=C(Br)C=CC(O)=C1 AC060056 [0,2,0,0,0,0|1,0,0]=3 852 B12R1.354 COC(=O)C1=C(C)C=CC(Br)=C1 AC510571 [0,2,0,0,0,0|1,0,0]=3 853 B12R1.354 COC(=O)C1=C(C=CC(=C1)I)Br LN01324137 [0,2,0,0,0,0|1,0,0]=3 854 B12R1.354 COC(=O)C1=C(Cl)C=NC(Br)=C1 AC050279 [0,2,0,0,0,0|2,0,0]=4 855 B12R1.354 COC(=O)C1=C(Cl)C=NC(Cl)=C1 AC050603 [0,2,0,0,0,0|2,0,0]=4 856 B12R1.354 COC(=O)C1=C(Cl)N=CC(Br)=C1 AC030154 [0,2,0,0,0,0|2,0,0]=4 857 B12R1.354 COC(=O)C1=C(Cl)N=CC(Cl)=C1 AC511953 [0,2,0,0,0,0|2,0,0]=4 858 B12R1.354 COC(=O)C1=C(N)C=CC(Br)=C1 AC510812 [0,2,0,0,0,0|0,0,0]=2 859 B12R1.354 COC(=O)C1=C(N=CC(=C1)Br)O LN00145206 [0,2,0,0,0,0|2,0,0]=4 860 B12R1.354 COC(=O)C1=CC(Br)=CC=C1F AC511080 [0,2,0,0,0,0|1,0,0]=3 861 B12R1.354 COC(=O)C1=CC(Br)=CC=C1O AC510579 [0,2,0,0,0,0|1,0,0]=3 862 B12R1.354 COC(=O)C1=CC(Br)=CN=C1N AC181850 [0,2,0,0,0,0|1,0,0]=3 863 B12R1.354 COC(=O)C1=CC(C)=CC=C1N AC181067 [0,2,0,0,0,0|0,0,0]=2 864 B12R1.354 COC(=O)C1=CC(F)=CC=C1Br AC180663 [0,2,0,0,0,0|1,0,0]=3 865 B12R1.354 COC(=O)C1=CC(N)=CC=C1C AC182355 [0,2,0,0,0,0|1,0,0]=3 866 B12R1.354 COC(=O)C1=CC(N)=NC=C1Br AC182364 [0,2,0,0,0,0|2,0,0]=4 867 B12R1.354 COC(=O)C1=NC(Br)=CN=C1N AC181131 [0,2,0,0,0,0|2,0,0]=4 868 B12R1.354 COC(=O)C1=NC(Cl)=CN=C1N AC181132 [0,2,0,0,0,0|2,0,0]=4 869 B12R1.453 CC(=O)C1=CC(=CC=C1O)C#N AC180690 [0,2,0,0,0,0|1,0,0]=3 870 B12R1.453 CCC1=CC(C(C)=O)=C(O)C=C1 AC160358 [0,2,0,0,0,0|1,0,0]=3 871 B12R1.453 COC1=CC(C(C)=O)=C(O)C=C1 AC130229 [0,2,0,0,0,0|1,0,0]=3 872 B12R1.453 COC1=CC(C(O)=O)=C(F)C=C1 AC511681 [0,2,0,0,0,0|2,0,0]=4 873 B12R1.453 COC1=CC(C(O)=O)=C(O)C=C1 AC511628 [0,2,0,0,0,0|2,0,0]=4 874 B12R1.453 COC1=CC=C(Br)C(=C1)C(O)=O AC511611 [0,2,0,0,0,0|2,0,0]=4 875 B12R1.453 COC1=CC=C(N)C(=C1)C(N)=O AC182701 [0,2,0,0,0,0|1,0,0]=3 876 B12R1.453 NC1=C(C=C(C=C1)C#N)[N+]([O-])=O AC020928 [0,2,0,0,0,0|2,0,0]=4 877 B12R1.308 CCOC(=O)C1=C(N)C=NC=C1 AC181700 [0,2,0,0,0,0|1,0,0]=3 878 B12R1.308 CCOC(=O)C1=C(N)N=CN=C1 AC051071 [0,2,0,0,0,0|2,0,0]=4 879 B12R1.308 CCOC(=O)C1=CC=CN=C1Cl AC511510 [0,2,0,0,0,0|2,0,0]=4 880 B12R1.308 CCOC(=O)C1=CC=CN=C1N AC181253 [0,2,0,0,0,0|1,0,0]=3 881 B12R1.308 CCOC(=O)C1=NC=CC=C1N AC181064 [0,2,0,0,0,0|1,0,0]=3 882 B10R1.18 CC(=O)CC1=NC=CC=C1 AC511843 [0,0,1,1,0,0|0,0,2]=4 883 B10R2.7 C1=CC2=C(N=C1)NCC2 LN00151014 [1,0,0,1,0,0|1,0,1]=4 884 B10R2.7 C1=CN=CC2=C1C=CN2 LN00004595 [1,0,0,1,0,0|1,0,1]=4 885 B10R2.7 C1=CNC2=C1C=NC=C2 LN00006232 [1,0,0,1,0,0|1,0,1]=4 886 B10R2.7 C1CC2=C(N1)C=CC=C2 AC500074 [1,0,0,1,0,0|0,0,1]=3 887 B10R2.7 C1CC2=C(N1)N=CC=C2 AC020599 [1,0,0,1,0,0|1,0,1]=4 888 B10R2.7 C1CC2=CC=CC=C2O1 AC020850 [1,0,0,1,0,0|1,0,1]=4 889 B10R2.7 C1CC2=CC=CN=C2N1 AC021071 [1,0,0,1,0,0|1,0,1]=4 890 B10R2.7 N1C=CC2=C1C=CC=C2 AC130112 [1,0,0,1,0,0|0,0,1]=3 891 B10R2.7 N1C=CC2=C1C=CC=N2 AC160369 [1,0,0,1,0,0|1,0,1]=4 892 B10R2.7 N1C=CC2=C1C=NC=C2 AC181302 [1,0,0,1,0,0|1,0,1]=4 893 B10R2.7 N1C=CC2=CN=CC=C12 AC181145 [1,0,0,1,0,0|1,0,1]=4 894 B10R2.7 N1N=CC2=C1C=CC=C2 AC511172 [1,0,0,1,0,0|1,0,0]=3 895 B10R2.7 N1N=CC2=CC=CN=C12 AC050955 [1,0,0,1,0,0|2,0,0]=4 896 B10R2.7 N1N=CC2=NC=CC=C12 AC182223 [1,0,0,1,0,0|2,0,0]=4 897 B10R2.7 N1N=NC2=C1C=CC=C2 AC190223 [1,0,0,1,0,0|2,0,0]=4 898 B10R2.7 S1C=CC2=C1C=CC=C2 AC130090 [1,0,0,1,0,0|1,0,1]=4 899 B10R2.32 O=C1CCC2=C1SC=C2 AC181664 [0,0,0,1,1,0|2,0,0]=4 900 B12R2.24 O=C1CCC2=C(C1)C=CC=C2 AC160458 [0,0,0,1,0,1|1,0,0]=3 901 B12R2.24 O=C1CCC2=CC=CC=C2N1 AC180323 [0,0,0,1,0,1|1,0,0]=3 902 B12R2.24 O=C1COC2=CC=CC=C2N1 AC180799 [0,0,0,1,0,1|1,0,0]=3 903 B12R2.24 O=C1COC2=CC=CN=C2N1 AC180173 [0,0,0,1,0,1|2,0,0]=4 904 B12R2.24 O=C1NC2=C(C=CC=C2)N=C1 AC511476 [0,0,0,1,0,1|0,0,2]=4 905 B12R2.202 BrC1=C2NC(=O)CC2=CC=C1 AC010324 [0,0,0,1,0,1|1,0,0]=3 906 B12R2.202 CC1=NC2=C(N1)C=CC=C2Br AC070056 [0,0,0,1,0,1|2,0,0]=4 907 B12R2.202 CC1=NC2=CC=CC(Br)=C2O1 AC051145 [0,0,0,1,0,1|2,0,0]=4 908 B12R2.202 FC1=CC=CC2=C1NC(=O)C2 AC181438 [0,0,0,1,0,1|1,0,0]=3 909 B12R2.1081 CC1=C2C=CC=CC2=CN=C1 AC040044 [0,1,0,1,0,0|1,0,1]=4 910 B12R2.1081 CC1CNCC2=C1C=CC=C2 LN00001946 [0,1,0,1,0,0|1,0,1]=4 911 B12R2.1081 CC1CNCC2=CC=CC=C12 LN00245503 [0,1,0,1,0,0|1,0,1]=4 912 B12R2.1081 N=C1CCCC2=C1C=CC=C2 AC020396 [0,1,0,1,0,0|2,0,0]=4 913 B12R2.1081 O=C1CCCC2=C1C=CC=C2 AC220096 [0,1,0,1,0,0|1,0,0]=3 914 B12R2.1081 O=C1CCCC2=C1N=CC=C2 AC181728 [0,1,0,1,0,0|2,0,0]=4 915 B12R2.1081 O=C1CCOC2=C1C=CC=C2 AC510788 [0,1,0,1,0,0|1,0,0]=3 916 B12R2.1081 O=C1CCOC2=CC=CN=C12 AC020004 [0,1,0,1,0,0|2,0,0]=4 917 B12R2.1081 O=C1COCC2=C1C=CC=C2 AC182447 [0,1,0,1,0,0|1,0,0]=3 918 B12R2.1081 O=C1NC=CC2=C1C=CC=C2 AC180180 [0,1,0,1,0,0|1,0,1]=4 919 B12R2.2028 BrC1CC(=O)C2=C1C=CC=C2 AC182462 [0,1,0,1,0,0|1,0,0]=3 920 B12R2.2028 CN1N=C(N)C2=C1C=CC=C2 AC040203 [0,1,0,1,0,0|2,0,0]=4 921 B12R2.2028 O=C1CC(=O)C2=C1C=CC=C2 AC360011 [0,1,0,1,0,0|1,0,0]=3 922 B12R2.203 BrC1=CC=CC2=C1C(=O)CC2 AC050920 [0,1,0,1,0,0|1,0,0]=3 923 B12R2.203 C1=CC(=C2C(=C1)NNC2=N)Br LN00157573 [0,1,0,1,0,0|2,0,0]=4 924 B12R2.203 ClC1=C2C(=O)CCC2=CC=C1 AC020058 [0,1,0,1,0,0|1,0,0]=3 925 B12R2.203 FC1=CC=CC2=C1C(=O)CC2 AC182102 [0,1,0,1,0,0|1,0,0]=3 926 B12R2.203 NC1=NNC2=C1C(I)=CC=C2 AC050594 [0,1,0,1,0,0|2,0,0]=4 927 B12R2.196 BrC1=C2COC(=O)C2=CC=C1 AC200055 [0,1,0,1,0,0|2,0,0]=4 928 B12R2.196 BrC1=CC=CC2=C1CCC2=O AC181309 [0,1,0,1,0,0|1,0,0]=3 929 B12R2.196 BrC1=CC=CC2=C1CNC2=O AC511302 [0,1,0,1,0,0|2,0,0]=4 930 B12R2.196 C1=CC2=C(C(=C1)F)NN=C2O LN01811243 [0,1,0,1,0,0|1,0,1]=4 931 B12R2.196 CC1=CC=CC2=C1CCC2=O AC220154 [0,1,0,1,0,0|1,0,0]=3 932 B12R2.196 OC1=CC=CC2=C1CCC2=O AC130287 [0,1,0,1,0,0|1,0,0]=3 933 B12R2.612 BrC1=CC2=C(C=C1)C(=O)CC2 AC500011 [0,1,0,1,0,0|1,0,0]=3 934 B12R2.612 BrC1=CC2=C(C=C1)C(=O)NC2 AC182430 [0,1,0,1,0,0|2,0,0]=4 935 B12R2.612 BrC1=CC=C2C(=O)OCC2=C1 AC510912 [0,1,0,1,0,0|2,0,0]=4 936 B12R2.612 C1=CC2=C(C=C1N)NN=C2O LN01377208 [0,1,0,1,0,0|1,0,1]=4 937 B12R2.612 C1CC(=O)C2=CC=C(C=C12)F LN00116021 [0,1,0,1,0,0|1,0,0]=3 938 B12R2.612 C1CC(=O)C2=CC=C(C=C12)N LN00213518 [0,1,0,1,0,0|1,0,0]=3 939 B12R2.612 CC1=CC=C2C(=O)CCC2=C1 AC220151 [0,1,0,1,0,0|1,0,0]=3 940 B12R2.612 CC1=NNC2=C1C=CC(Br)=C2 AC050651 [0,1,0,1,0,0|1,0,0]=3 941 B12R2.612 ClC1=CC2=C(C=C1)C(=O)CC2 AC220152 [0,1,0,1,0,0|1,0,0]=3 942 B12R2.612 ClC1=NNC2=C1C=CC(Br)=C2 AC182025 [0,1,0,1,0,0|2,0,0]=4 943 B12R2.612 NC1=CC2=C(C=C1)C(=O)NC2 AC182562 [0,1,0,1,0,0|2,0,0]=4 944 B12R2.612 NC1=CC2=C(C=C1)C(=O)NN2 AC182749 [0,1,0,1,0,0|1,0,0]=3 945 B12R2.612 NC1=NNC2=C1C=CC(Br)=C2 AC181911 [0,1,0,1,0,0|2,0,0]=4 946 B12R2.612 NC1=NNC2=CC(N)=CC=C12 AC060008 [0,1,0,1,0,0|2,0,0]=4 947 B12R2.612 OC1=CC=C2C(=O)COC2=C1 AC080307 [0,1,0,1,0,0|1,0,0]=3 948 B12R2.132 BrC1=CC2=C(CCC2=O)C=C1 AC181424 [0,1,0,1,0,0|1,0,0]=3 949 B12R2.132 BrC1=CC2=C(CNC2=O)C=C1 AC010273 [0,1,0,1,0,0|2,0,0]=4 950 B12R2.132 BrC1=CC2=C(COC2=O)C=C1 AC181679 [0,1,0,1,0,0|2,0,0]=4 951 B12R2.132 BrC1=CC2=C(NNC2=O)C=C1 AC050636 [0,1,0,1,0,0|1,0,0]=3 952 B12R2.132 BrC1=CC=C2NN=C(I)C2=C1 AC020392 [0,1,0,1,0,0|2,0,0]=4 953 B12R2.132 C1=CC(=CC2=C1COC2=O)F LN00196949 [0,1,0,1,0,0|2,0,0]=4 954 B12R2.132 CC1=C2C=C(C=CC2=NN1)Br LN00170889 [0,1,0,1,0,0|1,0,1]=4 955 B12R2.132 CC1=CC2=C(C=C1)CCC2=O LN00220913 [0,1,0,1,0,0|1,0,0]=3 956 B12R2.132 CC1=NNC2=C1C=C(Br)C=C2 AC020792 [0,1,0,1,0,0|1,0,0]=3 957 B12R2.132 CC1=NNC2=NC=C(Br)C=C12 AC182662 [0,1,0,1,0,0|2,0,0]=4 958 B12R2.132 CC1=NOC2=CC=C(Br)C=C12 AC040073 [0,1,0,1,0,0|2,0,0]=4 959 B12R2.132 ClC1=CC2=C(CCC2=O)C=C1 AC181146 [0,1,0,1,0,0|1,0,0]=3 960 B12R2.132 FC1=CC=C2ONC(=O)C2=C1 AC512185 [0,1,0,1,0,0|2,0,0]=4 961 B12R2.132 IC1=CC2=C(NNC2=O)C=C1 AC050335 [0,1,0,1,0,0|1,0,0]=3 962 B12R2.132 NC1=NNC2=C1C=C(Br)C=C2 AC050596 [0,1,0,1,0,0|2,0,0]=4 963 B12R2.132 OC1=CC2=C(CCC2=O)C=C1 AC510898 [0,1,0,1,0,0|1,0,0]=3 964 B12R2.132 OC1=CC2=C(NN=C2Br)C=C1 AC050692 [0,1,0,1,0,0|2,0,0]=4 965 B12R2.1 C1=CC=C2C(=C1)C(=CN2)C#N LN00175060 [0,1,0,1,0,0|1,0,1]=4 966 B12R2.1 C1=CC=C2C(=C1)C(=CS2)C=O LN00174575 [0,1,0,1,0,0|1,0,1]=4 967 B12R2.1 N#CC1=CNC2=C1C=CC=C2 AC510832 [0,1,0,1,0,0|1,0,1]=4 968 B12R2.1 NCC1=CNC2=C1C=CC=C2 AC320010 [0,1,0,1,0,0|1,0,0]=3 969 B12R2.1 NCC1=NNC2=C1C=CC=C2 AC182032 [0,1,0,1,0,0|1,0,0]=3 970 B12R2.1 O=CC1=CNC2=C1C=CC=C2 AC510786 [0,1,0,1,0,0|0,0,1]=3 971 B12R2.1 O=CC1=CNC2=C1C=NC=C2 AC190013 [0,1,0,1,0,0|1,0,1]=4 972 B12R2.1 O=CC1=COC2=CC=CC=C12 AC511143 [0,1,0,1,0,0|1,0,1]=4 973 B12R2.1 O=CC1=CSC2=C1C=CC=C2 AC180517 [0,1,0,1,0,0|1,0,1]=4 974 B12R2.1 O=CC1=NNC2=C1C=CC=C2 AC511854 [0,1,0,1,0,0|1,0,0]=3 975 B12R2.18 C1=CC=C2C(=C1)CC(=O)C2=O LN01358389 [0,1,0,1,0,0|1,0,1]=4 976 B12R2.18 CC1=C(Br)C2=C(N1)N=CC=C2 AC020308 [0,1,0,1,0,0|2,0,0]=4 977 B8R1.7 CC(=O)C1=CC=CS1 AC510514 [1,0,0,0,1,0|1,0,0]=3 978 B8R1.7 CC(=O)C1=CSC=C1 AC500077 [1,0,0,0,1,0|1,0,0]=3 979 B8R1.7 CC(=O)C1=NC=CN1 AC210047 [1,0,0,0,1,0|2,0,0]=4 980 B8R1.7 CC(=O)C1=NC=CS1 AC510705 [1,0,0,0,1,0|2,0,0]=4 981 B8R1.7 ClC(=O)C1=CC=CN1 AC180091 [1,0,0,0,1,0|2,0,0]=4 982 B8R1.7 OC(=O)C1=CC=CO1 AC510992 [1,0,0,0,1,0|2,0,0]=4 983 B8R1.7 OC(=O)C1=CNC=C1 AC181119 [1,0,0,0,1,0|2,0,0]=4 984 B8R1.7 OC(=O)C1=CSC=C1 AC310080 [1,0,0,0,1,0|2,0,0]=4 985 B8R1.7 [O-]C(=O)C1=CC=CS1 AC030126 [1,0,0,0,1,0|2,0,0]=4 986 B8R1.11 C1=CSC(=C1Br)C=O LN00146488 [1,0,0,0,1,0|2,0,0]=4 987 B12R1.125 C1=CC=C(C(=C1)CCC(=O)O)Cl LN00119293 [0,0,0,0,0,2|2,0,0]=4 988 B12R1.125 OC(=O)CCC1=CC=CC=C1Br AC500214 [0,0,0,0,0,2|2,0,0]=4