0 B10R1.61 C1=CC=C(C(=C1)C(=N)O)Br LN00236317 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.61 C1=CC=C(C(=C1)C(=N)O)I LN00200183 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.61 CC(=O)C1=CC=CC=C1Br AC511597 [0,0,0,0,0,0|2,0,1]=3 3 B10R1.61 CC(=O)C1=CC=CC=C1Cl AC500259 [0,0,0,0,0,0|2,0,1]=3 4 B10R1.61 CC(=O)C1=CC=CC=C1I LN00159959 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.61 CC(=O)C1=CC=CC=C1N AC180212 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.61 CC(=O)C1=CC=CC=C1O AC510427 [0,0,0,0,0,0|1,0,1]=2 7 B10R1.61 CC(=O)C1=CC=CN=C1Cl AC181741 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.61 CC(C)C1=C(N)N=CC=C1 AC010483 [0,0,0,0,0,0|2,0,0]=2 9 B10R1.61 CC1=C(C=CC=C1)B(O)O AC130310 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.61 CC1=C(C=CC=C1)C(O)=O AC511474 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.61 CN(C)C1=CC=CC=C1N AC511923 [0,0,0,0,0,0|2,0,0]=2 12 B10R1.61 C[C@@H](O)C1=C(Cl)C=CC=C1 AC020783 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.61 C[C@H](C1=CC=CC=C1Br)N LN02156247 [0,0,0,0,0,0|2,0,0]=2 14 B10R1.61 C[C@H](N)C1=CC=CC=C1F AC181536 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 AC020784 [0,0,0,0,0,0|2,0,0]=2 16 B10R1.61 C[C@H](O)C1=CC=CN=C1N AC020958 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.61 FC(F)C1=CC=CC=C1Br AC010373 [0,0,0,0,0,0|3,0,0]=3 18 B10R1.61 NC(=O)C1=C(N)C=CC=C1 AC190185 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.61 NC(=O)C1=CC=CC=C1I AC190079 [0,0,0,0,0,0|3,0,1]=4 20 B10R1.61 NC1=C(C=CC=C1)B(O)O AC090182 [0,0,0,0,0,0|4,0,0]=4 21 B10R1.61 NC1=CC=CC=C1B(O)O AC510975 [0,0,0,0,0,0|4,0,0]=4 22 B10R1.61 OB(O)C1=C(Cl)C=CC=C1 AC181084 [0,0,0,0,0,0|4,0,0]=4 23 B10R1.61 OB(O)C1=CC=CC=C1Br AC090122 [0,0,0,0,0,0|4,0,0]=4 24 B10R1.61 OB(O)C1=CC=CC=C1F AC130319 [0,0,0,0,0,0|4,0,0]=4 25 B10R1.61 OB(O)C1=CC=CC=C1O AC181170 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.61 OC(=O)C1=C(Br)C=CC=C1 AC510993 [0,0,0,0,0,0|3,0,1]=4 27 B10R1.61 OC(=O)C1=C(I)C=CC=C1 AC180035 [0,0,0,0,0,0|3,0,1]=4 28 B10R1.61 OC(=O)C1=CC=CC=C1O HY-B0167 [0,0,0,0,0,0|2,0,1]=3 29 B10R1.61 OC(=O)C1=CC=NC=C1O AC170008 [0,0,0,0,0,0|3,0,1]=4 30 B10R1.61 OC(=O)C1=NC=CC=C1O AC180151 [0,0,0,0,0,0|3,0,1]=4 31 B10R1.61 OC1=C(C=NC=C1)[N+]([O-])=O AC180727 [0,0,0,0,0,0|4,0,0]=4 32 B10R1.61 OC1=CC=CC=C1C([O-])=O HY-B0167A [0,0,0,0,0,0|2,0,1]=3 33 B9R1.6 CC(=C)C1=CC=CC=C1 AC190225 [1,0,0,0,0,0|0,0,2]=3 34 B9R1.6 CC(=O)C1=CC=CN=C1 AC510735 [1,0,0,0,0,0|2,0,1]=4 35 B9R1.6 CC(=O)C1=NC=CC=C1 AC131564 [1,0,0,0,0,0|2,0,1]=4 36 B9R1.6 CC(N)C1=CC=CN=C1 AC170099 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.6 CC(N)C1=CC=NC=C1 AC170001 [1,0,0,0,0,0|2,0,0]=3 38 B9R1.6 CC(N)C1=NC=CC=C1 AC021461 [1,0,0,0,0,0|2,0,0]=3 39 B9R1.6 CC(O)C1=NC=CC=C1 AC181953 [1,0,0,0,0,0|2,0,0]=3 40 B9R1.6 CN(C)C1=CC=NC=C1 AC131272 [1,0,0,0,0,0|2,0,0]=3 41 B9R1.6 C[C@@H](N)C1=NC=CC=C1 AC021462 [1,0,0,0,0,0|2,0,0]=3 42 B9R1.6 C[C@@H](O)C1=CC=CC=C1 AC021442 [1,0,0,0,0,0|1,0,0]=2 43 B9R1.6 C[C@H](N)C1=NC=CC=C1 AC170065 [1,0,0,0,0,0|2,0,0]=3 44 B9R1.6 NC(=N)C1=CC=CC=C1 AC511551 [1,0,0,0,0,0|2,0,1]=4 45 B9R1.6 OB(O)C1=CC=CC=C1 AC130043 [1,0,0,0,0,0|3,0,0]=4 46 B9R1.15 BrC1=C(C=O)C=CC=C1 AC190053 [1,0,0,0,0,0|2,0,1]=4 47 B9R1.15 BrC1=CC=CC=C1C#N AC500253 [1,0,0,0,0,0|2,0,1]=4 48 B9R1.15 BrCC1=C(Br)C=CC=C1 AC500309 [1,0,0,0,0,0|2,0,0]=3 49 B9R1.15 BrCC1=C(I)C=CC=C1 AC510755 [1,0,0,0,0,0|2,0,0]=3 50 B9R1.15 C1=CC(=C(C=O)N=C1)O LN00121425 [1,0,0,0,0,0|2,0,1]=4 51 B9R1.15 C1=CC=C(C(=C1)CO)Br LN00009848 [1,0,0,0,0,0|2,0,0]=3 52 B9R1.15 CC1=CC=CC=C1C=O AC511038 [1,0,0,0,0,0|2,0,1]=4 53 B9R1.15 CC1=CC=CC=C1CN AC190306 [1,0,0,0,0,0|2,0,0]=3 54 B9R1.15 CC1=NC=CC=C1CO LN00004952 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.15 CCC1=CC=CC=C1Br AC500247 [1,0,0,0,0,0|1,0,0]=2 56 B9R1.15 CCC1=NC=CC=C1O LN00004884 [1,0,0,0,0,0|1,0,0]=2 57 B9R1.15 CNC1=C(O)C=CC=C1 AC512071 [1,0,0,0,0,0|1,0,0]=2 58 B9R1.15 CNC1=CC=CC=C1N AC511708 [1,0,0,0,0,0|2,0,0]=3 59 B9R1.15 CNC1=CC=CC=C1N LN01309502 [1,0,0,0,0,0|2,0,0]=3 60 B9R1.15 COC1=C(Br)C=CC=C1 AC510848 [1,0,0,0,0,0|2,0,0]=3 61 B9R1.15 COC1=C(Br)C=NC=C1 AC210036 [1,0,0,0,0,0|3,0,0]=4 62 B9R1.15 COC1=C(I)C=CC=C1 AC510814 [1,0,0,0,0,0|2,0,0]=3 63 B9R1.15 COC1=C(N)C=NC=C1 AC030137 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.15 COC1=CC=CC=C1O AC190186 [1,0,0,0,0,0|1,0,0]=2 65 B9R1.15 COC1=CC=CN=C1Br AC500269 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.15 COC1=CC=CN=C1Cl AC181653 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.15 COC1=CC=CN=C1N AC511905 [1,0,0,0,0,0|3,0,0]=4 68 B9R1.15 COC1=CC=NC=C1Cl LN01322749 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.15 COC1=NC=CC=C1Br AC181597 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.15 COC1=NC=CC=C1Cl AC181590 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.15 COC1=NC=CC=C1I AC181562 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.15 ClC1=C(C=CC=C1)C#C AC180982 [1,0,0,0,0,0|1,0,2]=4 73 B9R1.15 ClC1=CC=CC=C1C=O AC190062 [1,0,0,0,0,0|2,0,1]=4 74 B9R1.15 ClC1=CC=CC=C1CBr AC180009 [1,0,0,0,0,0|2,0,0]=3 75 B9R1.15 FC1=C(C=CC=C1)C#N AC511685 [1,0,0,0,0,0|2,0,1]=4 76 B9R1.15 FC1=C(CBr)C=CC=C1 AC510775 [1,0,0,0,0,0|2,0,0]=3 77 B9R1.15 FC1=CC=CC=C1C=O AC510338 [1,0,0,0,0,0|2,0,1]=4 78 B9R1.15 NC1=C(C=O)C=CC=C1 AC510813 [1,0,0,0,0,0|2,0,1]=4 79 B9R1.15 NC1=C(CO)C=CC=N1 AC181888 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.15 NC1=CC=CC=C1CO AC511831 [1,0,0,0,0,0|2,0,0]=3 81 B9R1.15 NCC1=C(Br)C=CC=C1 AC500061 [1,0,0,0,0,0|2,0,0]=3 82 B9R1.15 NCC1=C(F)C=CC=C1 AC190246 [1,0,0,0,0,0|2,0,0]=3 83 B9R1.15 NCC1=CC=CC=C1O AC181137 [1,0,0,0,0,0|1,0,0]=2 84 B9R1.15 NNC1=CC=CC=C1Cl AC180294 [1,0,0,0,0,0|3,0,0]=4 85 B9R1.15 OC1=C(C=CC=C1)C#N AC511758 [1,0,0,0,0,0|1,0,1]=3 86 B9R1.15 OC1=C(C=O)C=CC=C1 AC190207 [1,0,0,0,0,0|1,0,1]=3 87 B9R1.15 OC1=C(C=O)C=CN=C1 AC511223 [1,0,0,0,0,0|2,0,1]=4 88 B9R1.15 OC1=CC=CN=C1C#N AC511818 [1,0,0,0,0,0|2,0,1]=4 89 B9R1.15 OC1=CC=CN=C1C=O AC270030 [1,0,0,0,0,0|2,0,1]=4 90 B9R1.15 OCC1=C(Br)C=NC=C1 AC182666 [1,0,0,0,0,0|3,0,0]=4 91 B9R1.15 OCC1=C(F)C=NC=C1 AC160575 [1,0,0,0,0,0|3,0,0]=4 92 B9R1.15 OCC1=CC=CC=C1Br AC230033 [1,0,0,0,0,0|2,0,0]=3 93 B9R1.15 OCC1=CC=CC=C1I AC511037 [1,0,0,0,0,0|2,0,0]=3 94 B9R1.15 OCC1=CC=CC=C1O HY-B1419 [1,0,0,0,0,0|1,0,0]=2 95 B9R1.15 OCC1=CC=CN=C1Cl AC181378 [1,0,0,0,0,0|3,0,0]=4 96 B9R1.15 OCC1=CC=CN=C1F AC181533 [1,0,0,0,0,0|3,0,0]=4 97 B11R1.53 CC(=O)C1=CC=CC=C1C#N AC511890 [0,1,0,0,0,0|2,0,1]=4 98 B11R1.53 COC1=C(C=CC=C1)B(O)O AC180960 [0,1,0,0,0,0|3,0,0]=4 99 B11R1.53 FC(F)C1=CC=CC=C1C=O AC010378 [0,1,0,0,0,0|2,0,1]=4 100 B11R1.53 OCC1=C(C=CC=C1)C(F)F AC010383 [0,1,0,0,0,0|2,0,0]=3 101 B11R1.53 OCC1=C(C=CC=C1)[N+]([O-])=O AC511759 [0,1,0,0,0,0|3,0,0]=4 102 B11R1.53 OCC1=CC=CC=C1B(O)O AC090231 [0,1,0,0,0,0|3,0,0]=4 103 B11R1.87 CC(C)(C)C1=C(N)C=CC=C1 AC180736 [0,1,0,0,0,0|1,0,0]=2 104 B11R1.87 CC1=CC=CC=C1C(F)(F)F AC180790 [0,1,0,0,0,0|3,0,0]=4 105 B11R1.87 CP(C)(=O)C1=CC=CC=C1N AC511962 [0,1,0,0,0,0|2,0,0]=3 106 B11R1.87 FC(F)(F)C1=CC=CC=C1I AC190161 [0,1,0,0,0,0|3,0,0]=4 107 B11R1.87 NC1=C(C=CC=C1)C(F)(F)F AC190266 [0,1,0,0,0,0|3,0,0]=4 108 B11R1.156 CC(=O)C1=C(F)C=CC=C1F AC180004 [0,1,0,0,0,0|2,0,1]=4 109 B11R1.156 CC(O)C1=C(Cl)C=NC=C1Cl AC040048 [0,1,0,0,0,0|3,0,0]=4 110 B11R1.156 CC1=CC=CC(O)=C1C(O)=O AC181197 [0,1,0,0,0,0|2,0,1]=4 111 B11R1.156 C[C@@H](O)C1=C(Cl)C=NC=C1Cl AC020778 [0,1,0,0,0,0|3,0,0]=4 112 B11R1.156 C[C@H](O)C1=C(Cl)C=NC=C1Cl AC040046 [0,1,0,0,0,0|3,0,0]=4 113 B11R1.156 OC(=O)C1=C(O)C=CC=C1F AC511776 [0,1,0,0,0,0|2,0,1]=4 114 B11R1.156 OC1=CC=CC(O)=C1[N+]([O-])=O AC511751 [0,1,0,0,0,0|3,0,0]=4 115 B11R1.159 CC(=O)C1=C(O)C(Br)=CC=C1 AC182239 [0,1,0,0,0,0|1,0,1]=3 116 B11R1.159 CC1=C(O)C(=CC=C1)C(O)=O HY-B1399 [0,1,0,0,0,0|2,0,1]=4 117 B11R1.159 CC1=CC=CC(=C1O)[N+]([O-])=O AC180392 [0,1,0,0,0,0|3,0,0]=4 118 B11R1.159 OC(=O)C1=CC=CC(Br)=C1O AC511188 [0,1,0,0,0,0|2,0,1]=4 119 B11R1.166 CC(=O)C1=C(C=C(C=C1)N)Cl LN01796470 [0,1,0,0,0,0|2,0,1]=4 120 B11R1.166 CC(=O)C1=C(F)C=C(Br)C=C1 AC220119 [0,1,0,0,0,0|2,0,1]=4 121 B11R1.166 CC(=O)C1=CC=C(Br)C=C1O AC181677 [0,1,0,0,0,0|1,0,1]=3 122 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1Br AC511164 [0,1,0,0,0,0|2,0,1]=4 123 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1Cl AC500263 [0,1,0,0,0,0|2,0,1]=4 124 B11R1.166 CC(=O)C1=CC=C(N)C=C1O AC511889 [0,1,0,0,0,0|1,0,1]=3 125 B11R1.166 CC(=O)C1=CC=C(O)C=C1F AC021126 [0,1,0,0,0,0|2,0,1]=4 126 B11R1.166 CC(C)C1=CC=C(N)C=C1O AC050674 [0,1,0,0,0,0|0,0,0]=1 127 B11R1.166 C[C@@H](C1=C(C=C(C=C1)Br)F)N LN02010281 [0,1,0,0,0,0|2,0,0]=3 128 B11R1.166 NC1=CC=C(C(O)=O)C(O)=C1 HY-B1048 [0,1,0,0,0,0|2,0,1]=4 129 B11R1.166 OC(=O)C1=C(O)C=C(Br)C=C1 AC500228 [0,1,0,0,0,0|2,0,1]=4 130 B11R1.166 OC(=O)C1=CC=C(F)C=C1O AC511669 [0,1,0,0,0,0|2,0,1]=4 131 B11R1.166 OC1=C(C=CC(Br)=C1)[N+]([O-])=O AC181565 [0,1,0,0,0,0|3,0,0]=4 132 B11R1.166 OC1=C(C=CC(F)=C1)[N+]([O-])=O AC130685 [0,1,0,0,0,0|3,0,0]=4 133 B11R1.166 OC1=CC(Cl)=CC=C1[N+]([O-])=O AC182400 [0,1,0,0,0,0|3,0,0]=4 134 B11R1.167 CC(=O)C1=C(Cl)C=CC(F)=C1 AC180460 [0,1,0,0,0,0|2,0,1]=4 135 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 AC130204 [0,1,0,0,0,0|1,0,1]=3 136 B11R1.167 CC(=O)C1=CC(Br)=CC=C1F AC182638 [0,1,0,0,0,0|2,0,1]=4 137 B11R1.167 CC(=O)C1=CC(Br)=CC=C1N AC511145 [0,1,0,0,0,0|2,0,1]=4 138 B11R1.167 CC(=O)C1=CC(Br)=CC=C1O AC510656 [0,1,0,0,0,0|1,0,1]=3 139 B11R1.167 CC(=O)C1=CC(Cl)=CC=C1Cl AC020882 [0,1,0,0,0,0|2,0,1]=4 140 B11R1.167 CC(=O)C1=CC(F)=CC=C1O AC510745 [0,1,0,0,0,0|1,0,1]=3 141 B11R1.167 CC1=CC(=C(C=C1)O)B(O)O LN02136315 [0,1,0,0,0,0|3,0,0]=4 142 B11R1.167 CC1=CC(B(O)O)=C(O)C=C1 AC100052 [0,1,0,0,0,0|3,0,0]=4 143 B11R1.167 NC1=CC(C(O)=O)=C(O)C=C1 HY-15027 [0,1,0,0,0,0|2,0,1]=4 144 B11R1.167 OC(=O)C1=C(O)C=CC(O)=C1 AC130216 [0,1,0,0,0,0|2,0,1]=4 145 B11R1.167 OC(=O)C1=CC(Cl)=CC=C1O AC500101 [0,1,0,0,0,0|2,0,1]=4 146 B11R1.167 OC1=C(C=C(Br)C=C1)[N+]([O-])=O AC511791 [0,1,0,0,0,0|3,0,0]=4 147 B11R1.222 C1=CC=C(C(=C1)[C@@H](CO)N)Cl LN02026918 [0,1,0,0,0,0|2,0,0]=3 148 B11R1.222 CCC(=O)C1=C(Cl)C=CC=C1 AC060049 [0,1,0,0,0,0|2,0,1]=4 149 B11R1.222 CNC(=O)C1=C(O)C=CC=C1 AC030031 [0,1,0,0,0,0|1,0,1]=3 150 B11R1.222 COC(=O)C1=C(I)C=CC=C1 AC130757 [0,1,0,0,0,0|2,0,1]=4 151 B11R1.222 COC(=O)C1=C(O)C=NC=C1 AC181065 [0,1,0,0,0,0|2,0,1]=4 152 B11R1.222 FC1=CC=CC=C1C(=O)CBr AC190234 [0,1,0,0,0,0|2,0,1]=4 153 B11R1.222 NNC(=O)C1=CC=CC=C1O AC190220 [0,1,0,0,0,0|2,0,1]=4 154 B11R2.1 CC1=CNC2=C1C=CC=C2 AC500066 [0,0,0,1,0,0|1,0,2]=4 155 B11R2.1 CN1C=CC2=C1C=CC=C2 AC510426 [0,0,0,1,0,0|2,0,1]=4 156 B11R2.1 NC1CCC2=CC=CC=C12 AC190231 [0,0,0,1,0,0|2,0,0]=3 157 B11R2.1 NC1COC2=NC=CC=C12 AC512024 [0,0,0,1,0,0|2,0,0]=3 158 B11R2.1 O=C1CCC2=C1C=CC=C2 AC220153 [0,0,0,1,0,0|2,0,1]=4 159 B11R2.1 O=C1COC2=C1C=CC=C2 AC130193 [0,0,0,1,0,0|1,0,1]=3 160 B11R2.1 O=C1CSC2=CC=CC=C12 AC182209 [0,0,0,1,0,0|1,1,1]=4 161 B11R2.1 OC1CCC2=CC=CN=C12 AC182162 [0,0,0,1,0,0|3,0,0]=4 162 B11R2.55 FC1=NC=CC=C1C2CC2 AC040078 [0,0,0,1,0,0|2,0,0]=3 163 B9R1.41 CC(C)C1=C(N)NN=C1 AC040156 [0,0,0,0,1,0|3,0,0]=4 164 B11R1.86 CC(=NC1=CC=CC=C1N)O LN00141995 [0,0,0,0,0,1|2,0,1]=4 165 B11R1.86 CC(=O)CC1=CC=CC=C1Br AC511603 [0,0,0,0,0,1|2,0,1]=4 166 B11R1.86 CC(C)OC1=CC=CC=C1N AC180979 [0,0,0,0,0,1|1,0,0]=2 167 B11R1.86 NC1=CC=CC=C1OC(F)F AC030138 [0,0,0,0,0,1|3,0,0]=4 168 B11R1.86 OC(=O)CC1=C(O)C=CC=C1 AC130768 [0,0,0,0,0,1|2,0,1]=4 169 B8R1.2 BrCC1=CC=CN=C1 AC190295 [2,0,0,0,0,0|2,0,0]=4 170 B8R1.2 BrCC1=CC=NC=C1 AC190236 [2,0,0,0,0,0|2,0,0]=4 171 B8R1.2 BrCC1=NC=CC=C1 AC190262 [2,0,0,0,0,0|2,0,0]=4 172 B8R1.2 CNC1=NC=CC=C1 AC500327 [2,0,0,0,0,0|2,0,0]=4 173 B8R1.2 COC1=CC=NC=C1 AC510883 [2,0,0,0,0,0|2,0,0]=4 174 B8R1.2 ClCC1=CC=CC=N1 AC510931 [2,0,0,0,0,0|2,0,0]=4 175 B8R1.2 ClCC1=CC=CN=C1 AC190048 [2,0,0,0,0,0|2,0,0]=4 176 B8R1.2 NCC1=CC=CN=C1 AC512081 [2,0,0,0,0,0|2,0,0]=4 177 B8R1.2 NCC1=CC=NC=C1 AC510741 [2,0,0,0,0,0|2,0,0]=4 178 B8R1.2 OCC1=CC=CC=C1 HY-B0892 [2,0,0,0,0,0|1,0,0]=3 179 B8R1.2 OCC1=CC=CN=C1 AC500154 [2,0,0,0,0,0|2,0,0]=4 180 B8R1.2 OCC1=CC=NC=C1 AC510857 [2,0,0,0,0,0|2,0,0]=4 181 B8R1.2 OCC1=NC=CC=C1 AC511744 [2,0,0,0,0,0|2,0,0]=4 182 B8R1.2 ONC1=CC=CC=C1 AC500156 [2,0,0,0,0,0|2,0,0]=4 183 B8R1.2 SCC1=NC=CC=C1 AC100035 [2,0,0,0,0,0|2,0,0]=4 184 B8R1.5 BrC1=CC=CC=C1I AC500034 [2,0,0,0,0,0|2,0,0]=4 185 B8R1.5 CC1=C(Br)C=CN=C1 AC181859 [2,0,0,0,0,0|2,0,0]=4 186 B8R1.5 CC1=C(Br)N=CC=C1 AC510729 [2,0,0,0,0,0|2,0,0]=4 187 B8R1.5 CC1=C(N)C=NC=C1 AC180724 [2,0,0,0,0,0|2,0,0]=4 188 B8R1.5 CC1=CC=CC=C1I AC510875 [2,0,0,0,0,0|1,0,0]=3 189 B8R1.5 CC1=CC=CN=C1F AC511615 [2,0,0,0,0,0|2,0,0]=4 190 B8R1.5 CC1=CN=CC=C1N AC181305 [2,0,0,0,0,0|2,0,0]=4 191 B8R1.5 CC1=CN=CC=C1N LN00001726 [2,0,0,0,0,0|2,0,0]=4 192 B8R1.5 CC1=CN=CC=C1O AC181809 [2,0,0,0,0,0|1,0,0]=3 193 B8R1.5 CC1=NC=CC=C1Br AC180855 [2,0,0,0,0,0|2,0,0]=4 194 B8R1.5 CC1=NC=CC=C1Cl AC181796 [2,0,0,0,0,0|2,0,0]=4 195 B8R1.5 CC1=NC=CC=C1O AC180647 [2,0,0,0,0,0|1,0,0]=3 196 B8R1.5 C[N+]1=C(Cl)C=CC=C1 AC130274 [2,0,0,0,0,0|2,0,0]=4 197 B8R1.5 ClC1=CC=CC=C1Br AC190163 [2,0,0,0,0,0|2,0,0]=4 198 B8R1.5 ClC1=CC=CC=C1I AC510876 [2,0,0,0,0,0|2,0,0]=4 199 B8R1.5 FC1=CC=CC=C1I AC190203 [2,0,0,0,0,0|2,0,0]=4 200 B8R1.5 IC1=CC=CC=C1I AC510877 [2,0,0,0,0,0|2,0,0]=4 201 B8R1.5 NC1=C(I)C=CC=C1 AC500016 [2,0,0,0,0,0|2,0,0]=4 202 B8R1.5 NC1=C(O)C=CC=C1 AC190222 [2,0,0,0,0,0|1,0,0]=3 203 B8R1.5 NC1=CC=CC=C1F AC021683 [2,0,0,0,0,0|2,0,0]=4 204 B8R1.5 NC1=CC=CN=C1O AC500058 [2,0,0,0,0,0|2,0,0]=4 205 B8R1.5 NC1=NC=CC=C1O AC511555 [2,0,0,0,0,0|2,0,0]=4 206 B8R1.5 OC1=C(Br)C=CC=C1 AC190217 [2,0,0,0,0,0|1,0,0]=3 207 B8R1.5 OC1=C(Br)C=CN=C1 AC511252 [2,0,0,0,0,0|2,0,0]=4 208 B8R1.5 OC1=C(Br)C=NC=C1 AC181282 [2,0,0,0,0,0|2,0,0]=4 209 B8R1.5 OC1=C(Cl)C=NC=C1 AC181811 [2,0,0,0,0,0|2,0,0]=4 210 B8R1.5 OC1=C(F)N=CC=C1 AC510678 [2,0,0,0,0,0|2,0,0]=4 211 B8R1.5 OC1=C(I)C=CC=C1 AC510212 [2,0,0,0,0,0|1,0,0]=3 212 B8R1.5 OC1=C(I)C=CN=C1 AC182369 [2,0,0,0,0,0|2,0,0]=4 213 B8R1.5 OC1=C(I)N=CC=C1 AC180367 [2,0,0,0,0,0|2,0,0]=4 214 B8R1.5 OC1=CC=CC=C1Cl AC190324 [2,0,0,0,0,0|1,0,0]=3 215 B8R1.5 OC1=CC=CN=C1Br AC130123 [2,0,0,0,0,0|2,0,0]=4 216 B8R1.5 OC1=CC=CN=C1Cl AC190272 [2,0,0,0,0,0|2,0,0]=4 217 B8R1.5 OC1=CC=CN=C1O AC511556 [2,0,0,0,0,0|2,0,0]=4 218 B8R1.5 OC1=COC=CC1=O AC182492 [2,0,0,0,0,0|2,0,0]=4 219 B8R1.5 OC1=NC=CC=C1Br AC181616 [2,0,0,0,0,0|2,0,0]=4 220 B8R1.5 OC1=NC=CC=C1Cl AC181284 [2,0,0,0,0,0|2,0,0]=4 221 B8R1.5 OC1=NC=CC=C1F AC181567 [2,0,0,0,0,0|2,0,0]=4 222 B10R1.13 CC(=O)C1=CC=C(C)C=C1 AC511479 [1,1,0,0,0,0|1,0,1]=4 223 B10R1.13 CC(=O)C1=CC=C(N)C=C1 AC510510 [1,1,0,0,0,0|1,0,1]=4 224 B10R1.13 CC(=O)C1=CC=C(O)C=C1 AC190210 [1,1,0,0,0,0|1,0,1]=4 225 B10R1.13 CC(C)C1=NC=C(C=C1)N LN00179988 [1,1,0,0,0,0|1,0,0]=3 226 B10R1.13 CC(O)C1=CC=C(C)N=C1 AC020061 [1,1,0,0,0,0|2,0,0]=4 227 B10R1.13 CN(C)C1=CC=C(C=C1)O LN00220688 [1,1,0,0,0,0|1,0,0]=3 228 B10R1.13 C[C@@H](C1=NC=C(C=C1)Br)N LN02000998 [1,1,0,0,0,0|2,0,0]=4 229 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 AC020028 [1,1,0,0,0,0|1,0,0]=3 230 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 AC050507 [1,1,0,0,0,0|1,0,0]=3 231 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 AC050523 [1,1,0,0,0,0|1,0,0]=3 232 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 AC020207 [1,1,0,0,0,0|1,0,0]=3 233 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 AC500284 [1,1,0,0,0,0|1,0,0]=3 234 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 AC020024 [1,1,0,0,0,0|1,0,0]=3 235 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 AC050617 [1,1,0,0,0,0|1,0,0]=3 236 B10R1.13 OC1=CC=C(C=C1)C(F)F AC512172 [1,1,0,0,0,0|2,0,0]=4 237 B10R1.15 BrCC(=O)C1=CC=CC=C1 AC190211 [1,1,0,0,0,0|1,0,1]=4 238 B10R1.15 C1=CC=C(C=C1)C(=O)CN LN00159450 [1,1,0,0,0,0|1,0,1]=4 239 B10R1.15 C1=CC=C(C=C1)[C@@H](CO)O LN00236000 [1,1,0,0,0,0|1,0,0]=3 240 B10R1.15 CC(C=O)C1=CC=CC=C1 AC190221 [1,1,0,0,0,0|0,0,1]=3 241 B10R1.15 CCC(C1=CC=CC=C1)Br LN01357533 [1,1,0,0,0,0|1,0,0]=3 242 B10R1.15 NCC(=O)C1=CC=CC=C1 AC180291 [1,1,0,0,0,0|1,0,1]=4 243 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 AC510841 [1,1,0,0,0,0|1,0,0]=3 244 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 AC180222 [1,1,0,0,0,0|1,0,0]=3 245 B10R1.15 N[C@H](CO)C1=CC=CC=C1 AC131619 [1,1,0,0,0,0|1,0,0]=3 246 B10R1.15 OCC(=O)C1=CC=CC=C1 AC180446 [1,1,0,0,0,0|1,0,1]=4 247 B10R1.28 CC(C)(C)C1=CC=NC=C1 AC180164 [1,1,0,0,0,0|1,0,0]=3 248 B10R1.28 CC(C)(N)C1=CC=CC=C1 AC500102 [1,1,0,0,0,0|0,0,0]=2 249 B10R1.28 CC(C)(N)C1=CC=CN=C1 AC182353 [1,1,0,0,0,0|1,0,0]=3 250 B10R1.113 CC(=O)C1=CC=CC(Br)=C1 AC500258 [1,1,0,0,0,0|1,0,1]=4 251 B10R1.113 CC(=O)C1=CC=CC(F)=C1 AC180005 [1,1,0,0,0,0|1,0,1]=4 252 B10R1.113 CC(C1=CC(=CC=C1)Br)N LN01347982 [1,1,0,0,0,0|1,0,0]=3 253 B10R1.113 CC(N)C1=CC(O)=CC=C1 AC020799 [1,1,0,0,0,0|1,0,0]=3 254 B10R1.113 CC(N)C1=CC=CC(Br)=C1 AC021480 [1,1,0,0,0,0|1,0,0]=3 255 B10R1.113 CC(N)C1=CC=CC(Br)=C1 AC182169 [1,1,0,0,0,0|1,0,0]=3 256 B10R1.113 CN(C)C1=CC(Cl)=NC=C1 AC160486 [1,1,0,0,0,0|2,0,0]=4 257 B10R1.113 CN(C)C1=CC=CC(O)=C1 AC190067 [1,1,0,0,0,0|1,0,0]=3 258 B10R1.113 C[C@@H](N)C1=CC=CC(Br)=C1 AC511565 [1,1,0,0,0,0|1,0,0]=3 259 B10R1.113 C[C@H](N)C1=CC(Br)=CC=C1 AC020029 [1,1,0,0,0,0|1,0,0]=3 260 B10R1.2 C1=CC(=C(C(=C1)O)O)C#N LN00166380 [1,1,0,0,0,0|1,0,1]=4 261 B10R1.2 CC1=C(Br)C(CO)=CC=C1 AC010441 [1,1,0,0,0,0|2,0,0]=4 262 B10R1.2 CC1=C(Br)C=CC=C1CO AC200067 [1,1,0,0,0,0|2,0,0]=4 263 B10R1.2 CC1=C(C(=CC=C1)C=O)O LN00226164 [1,1,0,0,0,0|1,0,1]=4 264 B10R1.2 CC1=C(C)C(CBr)=CC=C1 AC511858 [1,1,0,0,0,0|2,0,0]=4 265 B10R1.2 CC1=C(O)C(C=O)=CC=C1 AC511803 [1,1,0,0,0,0|1,0,1]=4 266 B10R1.2 COC1=C(Br)C(F)=CC=C1 AC130062 [1,1,0,0,0,0|2,0,0]=4 267 B10R1.2 COC1=C(C)C(C)=CC=C1 AC021515 [1,1,0,0,0,0|2,0,0]=4 268 B10R1.2 COC1=C(Cl)C(N)=CC=C1 AC020504 [1,1,0,0,0,0|2,0,0]=4 269 B10R1.2 COC1=C(F)C(F)=CC=C1 AC181264 [1,1,0,0,0,0|2,0,0]=4 270 B10R1.2 COC1=C(N)C(C)=CC=C1 AC511717 [1,1,0,0,0,0|2,0,0]=4 271 B10R1.2 COC1=CC=CC(Br)=C1C AC182617 [1,1,0,0,0,0|2,0,0]=4 272 B10R1.2 COC1=CC=CC(N)=C1C AC020524 [1,1,0,0,0,0|2,0,0]=4 273 B10R1.2 COC1=CC=CC(N)=C1C AC181971 [1,1,0,0,0,0|2,0,0]=4 274 B10R1.2 COC1=CC=CC(N)=C1Cl AC020005 [1,1,0,0,0,0|2,0,0]=4 275 B10R1.2 FC1=C(Cl)C(CBr)=CC=C1 AC511933 [1,1,0,0,0,0|2,0,0]=4 276 B10R1.2 OC1=C(C=O)C=CC=C1Br AC500094 [1,1,0,0,0,0|1,0,1]=4 277 B10R1.2 OC1=C(C=O)C=CC=C1F AC511686 [1,1,0,0,0,0|1,0,1]=4 278 B10R1.2 OC1=C(Cl)C=CC=C1C=O AC510684 [1,1,0,0,0,0|1,0,1]=4 279 B10R1.2 OC1=C(O)C(=CC=C1)C#N AC512108 [1,1,0,0,0,0|1,0,1]=4 280 B10R1.4 C1=CC=C(C(=C1)CC=O)Br LN00181697 [1,1,0,0,0,0|1,0,1]=4 281 B10R1.4 C1=CC=C(C(=C1)CC=O)Cl LN00180075 [1,1,0,0,0,0|1,0,1]=4 282 B10R1.4 C1=CC=C(C(=C1)CC=O)F LN00181093 [1,1,0,0,0,0|1,0,1]=4 283 B10R1.4 C1=CC=C(C(=C1)CCO)Br LN00142608 [1,1,0,0,0,0|1,0,0]=3 284 B10R1.4 C1=CC=C(C(=C1)CCO)Cl LN00192290 [1,1,0,0,0,0|1,0,0]=3 285 B10R1.4 CC1=C(CON)C=CC=C1 AC010097 [1,1,0,0,0,0|2,0,0]=4 286 B10R1.4 CC1=CC=CC=C1CC#N AC512146 [1,1,0,0,0,0|1,0,1]=4 287 B10R1.4 CC1=CC=CC=C1CC=O LN00181191 [1,1,0,0,0,0|1,0,1]=4 288 B10R1.4 CCOC1=CC=CC=C1N AC190317 [1,1,0,0,0,0|1,0,0]=3 289 B10R1.4 NCCC1=CC=CC=C1N AC070086 [1,1,0,0,0,0|1,0,0]=3 290 B10R1.4 NCCC1=CC=CC=C1O AC050448 [1,1,0,0,0,0|0,0,0]=2 291 B10R1.4 OCCC1=CC=CC=C1Br AC180682 [1,1,0,0,0,0|1,0,0]=3 292 B10R1.20 BrCC1=C(C=CC=C1)C#N AC500261 [1,1,0,0,0,0|2,0,0]=4 293 B10R1.20 C1=CC=C(CO)C(=C1)CO LN01372805 [1,1,0,0,0,0|1,0,0]=3 294 B10R1.20 CNC1=CC=CC=C1NC AC050961 [1,1,0,0,0,0|2,0,0]=4 295 B10R1.20 COC1=C(C=O)C=CC=C1 AC500195 [1,1,0,0,0,0|1,0,1]=4 296 B10R1.20 COC1=CC=CC=C1C#N AC510922 [1,1,0,0,0,0|1,0,1]=4 297 B10R1.20 COC1=CC=CC=C1NN AC180402 [1,1,0,0,0,0|2,0,0]=4 298 B10R1.20 COC1=NC=CC=C1CCl LN00003497 [1,1,0,0,0,0|2,0,0]=4 299 B10R1.20 NCC1=C(C=CC=C1)C#N AC182058 [1,1,0,0,0,0|2,0,0]=4 300 B10R1.20 NCC1=CC=CC=C1CO AC182374 [1,1,0,0,0,0|1,0,0]=3 301 B10R1.25 C1=CC(=CC(=C1C#N)O)O LN00220924 [1,1,0,0,0,0|1,0,1]=4 302 B10R1.25 CC1=CC(C)=C(CN)C=C1 AC160616 [1,1,0,0,0,0|2,0,0]=4 303 B10R1.25 CC1=CC=C(C=O)C(O)=C1 AC511779 [1,1,0,0,0,0|1,0,1]=4 304 B10R1.25 COC1=C(F)C=C(N)C=C1 AC500320 [1,1,0,0,0,0|2,0,0]=4 305 B10R1.25 COC1=CC=C(Br)C=C1C AC511516 [1,1,0,0,0,0|2,0,0]=4 306 B10R1.25 COC1=CC=C(Br)C=C1F AC180272 [1,1,0,0,0,0|2,0,0]=4 307 B10R1.25 COC1=CC=C(Br)C=C1O AC510743 [1,1,0,0,0,0|1,0,0]=3 308 B10R1.25 COC1=CC=C(F)C=C1Br AC130052 [1,1,0,0,0,0|2,0,0]=4 309 B10R1.25 COC1=CC=C(F)C=C1O AC180763 [1,1,0,0,0,0|1,0,0]=3 310 B10R1.25 COC1=CC=C(N)C=C1Br AC500244 [1,1,0,0,0,0|2,0,0]=4 311 B10R1.25 FC1=C(CBr)C=CC(Br)=C1 AC510954 [1,1,0,0,0,0|2,0,0]=4 312 B10R1.25 FC1=CC(F)=C(CBr)C=C1 AC180270 [1,1,0,0,0,0|2,0,0]=4 313 B10R1.25 FC1=CC=C(CBr)C(Br)=C1 AC181737 [1,1,0,0,0,0|2,0,0]=4 314 B10R1.25 NCC1=C(F)C=C(Br)C=C1 AC510434 [1,1,0,0,0,0|2,0,0]=4 315 B10R1.25 OC1=CC(Br)=CC=C1C#N AC500289 [1,1,0,0,0,0|1,0,1]=4 316 B10R1.25 OC1=CC(Br)=CC=C1C=O AC130078 [1,1,0,0,0,0|1,0,1]=4 317 B10R1.25 OC1=CC(Cl)=CC=C1C=O AC510701 [1,1,0,0,0,0|1,0,1]=4 318 B10R1.25 OC1=CC(O)=C(C=O)C=C1 AC511006 [1,1,0,0,0,0|1,0,1]=4 319 B10R1.25 OCC1=CC=C(Cl)C=C1F AC180759 [1,1,0,0,0,0|2,0,0]=4 320 B10R1.25 OCC1=CC=C(F)C=C1Br AC181077 [1,1,0,0,0,0|2,0,0]=4 321 B10R1.30 C1=C(C=C(CCl)C(=C1)Cl)I LN02224034 [1,1,0,0,0,0|2,0,0]=4 322 B10R1.30 C1=C(C=C(CO)C(=C1)N)Br LN00152170 [1,1,0,0,0,0|2,0,0]=4 323 B10R1.30 CC1=CC=C(Br)C=C1CO AC050486 [1,1,0,0,0,0|2,0,0]=4 324 B10R1.30 CC1=CC=C(O)C(CCl)=N1 AC020394 [1,1,0,0,0,0|2,0,0]=4 325 B10R1.30 CC1=CC=C(O)C(CO)=N1 AC021314 [1,1,0,0,0,0|2,0,0]=4 326 B10R1.30 CCC1=CC(=CC=C1F)Br LN01279639 [1,1,0,0,0,0|1,0,0]=3 327 B10R1.30 CCC1=CC(Br)=CC=C1N AC021532 [1,1,0,0,0,0|1,0,0]=3 328 B10R1.30 CCC1=NC(C)=CC=C1O AC181021 [1,1,0,0,0,0|1,0,0]=3 329 B10R1.30 COC1=C(Br)C=CC(Cl)=C1 AC511561 [1,1,0,0,0,0|2,0,0]=4 330 B10R1.30 COC1=C(Cl)C=CC(N)=C1 AC511495 [1,1,0,0,0,0|2,0,0]=4 331 B10R1.30 COC1=CC(=CC=C1Br)O LN00004696 [1,1,0,0,0,0|2,0,0]=4 332 B10R1.30 COC1=CC(Br)=CC=C1N AC510860 [1,1,0,0,0,0|2,0,0]=4 333 B10R1.30 COC1=CC(F)=CC=C1N AC040109 [1,1,0,0,0,0|2,0,0]=4 334 B10R1.30 COC1=CC(N)=CC=C1Br AC500116 [1,1,0,0,0,0|2,0,0]=4 335 B10R1.30 COC1=CC(N)=CC=C1C AC510672 [1,1,0,0,0,0|2,0,0]=4 336 B10R1.30 COC1=CC(N)=CC=C1F AC511952 [1,1,0,0,0,0|2,0,0]=4 337 B10R1.30 ClC1=CC=C(Br)C(CBr)=C1 AC511917 [1,1,0,0,0,0|2,0,0]=4 338 B10R1.30 FC1=CC=C(Br)C(CBr)=C1 AC180448 [1,1,0,0,0,0|2,0,0]=4 339 B10R1.30 NCC1=C(N)C=CC(Cl)=C1 AC200134 [1,1,0,0,0,0|2,0,0]=4 340 B10R1.30 OC1=C(C=O)C=C(Br)C=C1 AC130239 [1,1,0,0,0,0|1,0,1]=4 341 B10R1.30 OC1=C(C=O)C=C(Cl)C=C1 AC510907 [1,1,0,0,0,0|1,0,1]=4 342 B10R1.30 OC1=C(C=O)C=C(F)C=C1 AC131640 [1,1,0,0,0,0|1,0,1]=4 343 B10R1.30 OC1=CC=C(Br)C=C1C#N AC510757 [1,1,0,0,0,0|1,0,1]=4 344 B10R1.245 C1=CC(=C(C#N)C(=C1)O)F LN00118013 [1,1,0,0,0,0|1,0,1]=4 345 B10R1.245 C1=CC(=C(C=O)C(=C1)O)Cl LN00172491 [1,1,0,0,0,0|1,0,1]=4 346 B10R1.245 C1=CC(=C(C=O)C(=C1)O)F LN00011257 [1,1,0,0,0,0|1,0,1]=4 347 B10R1.245 C1=CC(=C(CO)C(=C1)I)F LN02137295 [1,1,0,0,0,0|2,0,0]=4 348 B10R1.245 CC1=CC=CC(C)=C1CBr AC511906 [1,1,0,0,0,0|2,0,0]=4 349 B10R1.245 CC1=CC=CC(C)=C1CN AC511863 [1,1,0,0,0,0|2,0,0]=4 350 B10R1.245 FC1=CC=CC(Cl)=C1CBr AC510387 [1,1,0,0,0,0|2,0,0]=4 351 B10R1.245 FC1=CC=CC(F)=C1CBr AC510972 [1,1,0,0,0,0|2,0,0]=4 352 B10R1.245 NCC1=C(Cl)C=CC=C1Cl AC511864 [1,1,0,0,0,0|2,0,0]=4 353 B10R1.245 NCC1=C(Cl)C=CC=C1F AC020010 [1,1,0,0,0,0|2,0,0]=4 354 B10R1.245 OC1=C(C=O)C(Br)=CC=C1 AC130094 [1,1,0,0,0,0|1,0,1]=4 355 B10R1.245 OC1=C(C=O)C(Cl)=CC=C1 AC511571 [1,1,0,0,0,0|1,0,1]=4 356 B10R1.245 OC1=CC=CC(O)=C1C=O AC130064 [1,1,0,0,0,0|1,0,1]=4 357 B12R1.75 C=CC1=CC=CC=C1OC(C)C LN01306961 [0,1,0,0,0,1|1,0,0]=3 358 B12R1.233 CC(C)OC1=C(Cl)C=C(N)C=C1 AC050038 [0,1,0,0,0,1|1,0,0]=3 359 B12R1.57 COC1=CC(Br)=CC=C1C(C)=O AC512144 [0,2,0,0,0,0|1,0,1]=4 360 B12R1.76 OCC1=CC=CC=C1C(F)(F)F AC180083 [0,2,0,0,0,0|2,0,0]=4 361 B12R1.261 CC(C)C1=CC=CC=C1B(O)O AC181626 [0,2,0,0,0,0|0,0,0]=2 362 B12R1.261 CC(O)C1=C(C=CC=C1)C(F)F AC010384 [0,2,0,0,0,0|2,0,0]=4 363 B12R1.261 C[C@@H](N)C1=CC=CC=C1[N+]([O-])=O AC020485 [0,2,0,0,0,0|1,0,1]=4 364 B12R1.261 C[C@H](N)C1=C(C=CC=C1)[N+]([O-])=O AC020093 [0,2,0,0,0,0|1,0,1]=4 365 B12R1.261 OB(O)C1=C(C=CC=C1)C(F)F AC010381 [0,2,0,0,0,0|2,0,0]=4 366 B12R1.261 OC(=O)C1=CC=CC=C1C(F)F AC010380 [0,2,0,0,0,0|2,0,0]=4 367 B12R1.437 COC1=C(C(C)=O)C(O)=CC=C1 AC180230 [0,2,0,0,0,0|1,0,1]=4 368 B12R1.128 CC(C)(C)C1=CC(N)=CC=C1O AC050545 [0,2,0,0,0,0|0,0,0]=2 369 B12R1.128 CC(C)(C)C1=CC(O)=CC=C1O HY-100489 [0,2,0,0,0,0|0,0,0]=2 370 B12R1.894 C[C@H](O)C1=C(Cl)C=CC(F)=C1Cl AC020899 [0,2,0,0,0,0|2,0,0]=4 371 B12R1.1000 CC(=O)C1=C(C=C(C=C1O)Br)F LN01360961 [0,2,0,0,0,0|1,0,1]=4 372 B12R1.3441 COC(=O)C1=C(O)C=CC=C1O AC130166 [0,2,0,0,0,0|1,0,1]=4 373 B12R1.24 COC(=O)C1=CC=CC(N)=C1O AC051060 [0,2,0,0,0,0|1,0,1]=4 374 B12R1.232 CC(=O)C1=CC(C)=C(C)C=C1O AC160404 [0,2,0,0,0,0|1,0,1]=4 375 B12R1.452 COC1=CC=C(C(C)=O)C(O)=C1 HY-N0159 [0,2,0,0,0,0|1,0,1]=4 376 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1O AC511146 [0,2,0,0,0,0|1,0,1]=4 377 B12R1.1703 COC(=O)C1=CC=C(F)C=C1O AC181401 [0,2,0,0,0,0|1,0,1]=4 378 B12R1.354 COC(=O)C1=CC(Br)=CC=C1O AC510579 [0,2,0,0,0,0|1,0,1]=4 379 B12R1.453 CC(=O)C1=CC(=CC=C1O)C#N AC180690 [0,2,0,0,0,0|1,0,1]=4 380 B12R1.453 CCC1=CC(C(C)=O)=C(O)C=C1 AC160358 [0,2,0,0,0,0|1,0,1]=4 381 B12R1.453 COC1=CC(C(C)=O)=C(O)C=C1 AC130229 [0,2,0,0,0,0|1,0,1]=4 382 B10R1.31 CC(C)C1=COC(C=O)=C1 AC021095 [0,0,1,1,0,0|1,0,0]=3 383 B10R2.7 C1=CC2=C(N=C1)NCC2 LN00151014 [1,0,0,1,0,0|2,0,0]=4 384 B10R2.7 C1CC2=C(C1)N=CC=C2 AC180116 [1,0,0,1,0,0|2,0,0]=4 385 B10R2.7 C1CC2=C(N1)C=CC=C2 AC500074 [1,0,0,1,0,0|1,0,0]=3 386 B10R2.7 C1CC2=C(N1)N=CC=C2 AC020599 [1,0,0,1,0,0|2,0,0]=4 387 B10R2.7 C1CC2=CC=CC=C2O1 AC020850 [1,0,0,1,0,0|0,0,0]=2 388 B10R2.7 C1CC2=CC=CN=C2N1 AC021071 [1,0,0,1,0,0|2,0,0]=4 389 B10R2.7 C1NCC2=C1C=CC=C2 AC181687 [1,0,0,1,0,0|2,0,0]=4 390 B10R2.7 C1OCC2=C1C=CC=C2 AC010325 [1,0,0,1,0,0|2,0,0]=4 391 B10R2.7 O1C=NC2=CC=CC=C12 AC511074 [1,0,0,1,0,0|1,0,1]=4 392 B12R2.24 NC1CCC2=C(C1)C=CC=C2 AC511993 [0,0,0,1,0,1|2,0,0]=4 393 B12R2.24 NC1CSC2=CC=CC=C2C1 AC320002 [0,0,0,1,0,1|1,1,0]=4 394 B12R2.24 N[C@@H]1COC2=C(C1)C=CC=C2 AC182794 [0,0,0,1,0,1|1,0,0]=3 395 B12R2.24 O=C1COC2=CC=CC=C2N1 AC180799 [0,0,0,1,0,1|1,0,1]=4 396 B12R2.24 OC1CCC2=CC=CC=C2C1 AC220098 [0,0,0,1,0,1|2,0,0]=4 397 B12R2.95 FC1(F)OC2=CC=CC=C2O1 AC180964 [0,0,0,1,0,1|2,0,0]=4 398 B12R2.1081 C1=CC=C2C(=C1)CCCC2N LN00224938 [0,1,0,1,0,0|2,0,0]=4 399 B12R2.1081 CC1CNCC2=C1C=CC=C2 LN00001946 [0,1,0,1,0,0|1,0,0]=3 400 B12R2.1081 CC1CNCC2=CC=CC=C12 LN00245503 [0,1,0,1,0,0|1,0,0]=3 401 B12R2.1081 CC1NCCC2=C1C=CC=C2 AC181112 [0,1,0,1,0,0|1,0,0]=3 402 B12R2.1081 NC1CCOC2=C1C=CC=C2 AC051203 [0,1,0,1,0,0|1,0,0]=3 403 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 AC182356 [0,1,0,1,0,0|1,0,0]=3 404 B12R2.1081 O=C1CCOC2=C1C=CC=C2 AC510788 [0,1,0,1,0,0|1,0,1]=4 405 B12R2.1081 O=C1COCC2=C1C=CC=C2 AC182447 [0,1,0,1,0,0|1,0,1]=4 406 B12R2.1081 OC1CCCC2=C1C=CC=C2 AC220110 [0,1,0,1,0,0|2,0,0]=4 407 B12R2.2028 BrC1CC(=O)C2=C1C=CC=C2 AC182462 [0,1,0,1,0,0|1,0,1]=4 408 B12R2.203 NC1CCC2=C1C(Br)=CC=C2 AC051018 [0,1,0,1,0,0|2,0,0]=4 409 B12R2.203 NC1CCC2=C1C(O)=CC=C2 AC051050 [0,1,0,1,0,0|1,0,0]=3 410 B12R2.612 OC1=CC=C2C(=O)COC2=C1 AC080307 [0,1,0,1,0,0|1,0,1]=4 411 B12R2.132 CC1=NOC2=CC=C(Br)C=C12 AC040073 [0,1,0,1,0,0|1,0,1]=4 412 B12R2.1 C#CC1CCC2=CC=CC=C12 AC020078 [0,1,0,1,0,0|1,0,1]=4 413 B12R2.18 CC1=CC2=CC=CC=C2N1C LN00009059 [0,1,0,1,0,0|2,0,0]=4 414 B12R2.18 N[C@@H]1[C@H](O)CC2=C1C=CC=C2 AC180902 [0,1,0,1,0,0|2,0,0]=4 415 B8R1.7 CC(C)C1=CC=CO1 LN00338375 [1,0,0,0,1,0|1,0,0]=3 416 B8R1.7 CC(C)C1=NC=CN1 AC130259 [1,0,0,0,1,0|2,0,0]=4 417 B8R1.7 CC(C)N1C=CC=N1 AC130056 [1,0,0,0,1,0|2,0,0]=4