0 B10R1.10 CC#CC1=CC=CC(C)=C1 DY788763 [0,0,0,0,0,0|2,0,2]=4 1 B10R1.10 CC1=CC(CC#N)=CC=C1 NO18941 [0,0,0,0,0,0|1,0,2]=3 2 B10R1.10 CC1=CC(CCN)=NC=C1 DY713209 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.10 CC1=CC(CCO)=CC=C1 NO22372 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.10 CC1=CC=CC(CNN)=C1 DY514611 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.10 CCCC1=CN=CC(O)=C1 DY660255 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.10 CCNC1=NC=CC(Cl)=C1 DY658481 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.10 CCNC1=NC=CC(N)=C1 NO14774 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.10 CCOC1=CC(N)=NC=C1 DY20309 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.10 CCOC1=CC=CC(Cl)=N1 DY655578 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.10 CCSC1=NC(Cl)=NC=C1 DY514233 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.10 CNCC1=CC(Cl)=CC=C1 DY456640 [0,0,0,0,0,0|2,0,0]=2 12 B10R1.10 CNCC1=CC=CC(N)=C1 DY789483 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.10 COCC1=CC(Br)=NC=C1 DY655107 [0,0,0,0,0,0|3,1,0]=4 14 B10R1.10 COCC1=CC(Cl)=NC=N1 DY547875 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.10 COCC1=NC(Cl)=NC=C1 DY516411 [0,0,0,0,0,0|4,0,0]=4 16 B10R1.10 Clc1cccc(CCBr)c1 DY584685 [0,0,0,0,0,0|1,0,0]=1 17 B10R1.10 N#CCC1=CC(Br)=CC=C1 NO18969 [0,0,0,0,0,0|0,1,2]=3 18 B10R1.10 N#CCC1=CC(Cl)=CC=C1 NO13745 [0,0,0,0,0,0|0,0,2]=2 19 B10R1.10 N#CCC1=CC(F)=CC=C1 DY20212 [0,0,0,0,0,0|0,1,2]=3 20 B10R1.10 N#CCC1=CC(I)=CC=C1 DY584378 [0,0,0,0,0,0|0,1,2]=3 21 B10R1.10 N#CCC1=NC(Cl)=NC=C1 DY692860 [0,0,0,0,0,0|2,0,2]=4 22 B10R1.10 N#CCC1=NC=CC(Br)=C1 NO17276 [0,0,0,0,0,0|1,1,2]=4 23 B10R1.10 N#CCC1=NC=CC(F)=C1 DY711241 [0,0,0,0,0,0|1,1,2]=4 24 B10R1.10 NC1=CC=CC(CCO)=C1 NO22105 [0,0,0,0,0,0|2,0,0]=2 25 B10R1.10 NC1=CC=CC(CCO)=N1 DY608453 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.10 NCCC1=CC(Br)=CC=C1 NO15159 [0,0,0,0,0,0|0,1,0]=1 27 B10R1.10 NCCC1=NC(Cl)=CC=C1 DY654324 [0,0,0,0,0,0|1,0,0]=1 28 B10R1.10 NCCc1cccc(O)c1 DY552393 [0,0,0,0,0,0|1,0,0]=1 29 B10R1.10 NNCC1=CC(Cl)=CC=C1 DY544953 [0,0,0,0,0,0|1,0,0]=1 30 B10R1.10 NNCC1=CC(O)=CC=C1 DY10382 [0,0,0,0,0,0|2,0,0]=2 31 B10R1.10 O=C=NC1=CC(F)=CC=C1 DY41043 [0,0,0,0,0,0|2,1,1]=4 32 B10R1.10 OCCC1=CC(Br)=CC=C1 NO22186 [0,0,0,0,0,0|1,1,0]=2 33 B10R1.10 OCCC1=CC(Cl)=CC=C1 NO22241 [0,0,0,0,0,0|1,0,0]=1 34 B10R1.10 OCCC1=NC(Cl)=CC=C1 DY531777 [0,0,0,0,0,0|2,0,0]=2 35 B10R1.10 O\N=C\C1=CC(Br)=CC=C1 DY796005 [0,0,0,0,0,0|2,1,1]=4 36 B10R1.10 S=C=NC1=CC(I)=CC=C1 DY41073 [0,0,0,0,0,0|2,1,1]=4 37 B9R1.2 BrCC1=CC=CC(Br)=C1 NO19344 [1,0,0,0,0,0|1,1,0]=3 38 B9R1.2 C#CC1=CC(F)=CC=C1 NO20642 [1,0,0,0,0,0|0,1,2]=4 39 B9R1.2 C#CC1=CC=CC(N)=C1 NO10819 [1,0,0,0,0,0|1,0,2]=4 40 B9R1.2 CC1=CC(CCl)=NC=C1 NO15442 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.2 CC1=CC(CN)=CC=C1 NO19644 [1,0,0,0,0,0|1,0,0]=2 42 B9R1.2 CC1=CC(CO)=NC=C1 NO11126 [1,0,0,0,0,0|3,0,0]=4 43 B9R1.2 CC1=CC(NN)=CC=C1 NO19574 [1,0,0,0,0,0|2,0,0]=3 44 B9R1.2 CC1=CC(NN)=NC=C1 NO13399 [1,0,0,0,0,0|3,0,0]=4 45 B9R1.2 CC1=CC=CC(C#N)=C1 NO19778 [1,0,0,0,0,0|1,0,2]=4 46 B9R1.2 CC1=CC=CC(C=O)=C1 DY41127 [1,0,0,0,0,0|2,0,1]=4 47 B9R1.2 CC1=CC=CC(CCl)=N1 DY547749 [1,0,0,0,0,0|3,0,0]=4 48 B9R1.2 CC1=CC=CC(CN)=N1 NO18414 [1,0,0,0,0,0|2,0,0]=3 49 B9R1.2 CC1=CC=CC(CO)=N1 DY20920 [1,0,0,0,0,0|3,0,0]=4 50 B9R1.2 CC1=CN=CC(CCl)=C1 NO14445 [1,0,0,0,0,0|3,0,0]=4 51 B9R1.2 CC1=CN=CC(CO)=C1 DY452566 [1,0,0,0,0,0|3,0,0]=4 52 B9R1.2 CC1=NC(CN)=NC=C1 DY580845 [1,0,0,0,0,0|3,0,0]=4 53 B9R1.2 CC1=NC(CN)=NC=C1 DY611424 [1,0,0,0,0,0|3,0,0]=4 54 B9R1.2 CCC1=CC(C)=CN=C1 DY657240 [1,0,0,0,0,0|2,0,0]=3 55 B9R1.2 CCC1=CC=CC(Br)=N1 NO15322 [1,0,0,0,0,0|1,1,0]=3 56 B9R1.2 CCC1=CC=CC(Cl)=C1 DY584271 [1,0,0,0,0,0|0,0,0]=1 57 B9R1.2 CCC1=CN=CC(Br)=C1 NO11907 [1,0,0,0,0,0|1,1,0]=3 58 B9R1.2 CCC1=CN=CC(Cl)=N1 DY447143 [1,0,0,0,0,0|2,0,0]=3 59 B9R1.2 CCC1=NC=CC(Br)=C1 DY658183 [1,0,0,0,0,0|1,1,0]=3 60 B9R1.2 CNC1=CC(Br)=CC=C1 NO22185 [1,0,0,0,0,0|1,1,0]=3 61 B9R1.2 CNC1=CC(Cl)=CC=C1 DY20486 [1,0,0,0,0,0|1,0,0]=2 62 B9R1.2 CNC1=CC(I)=CC=C1 DY563655 [1,0,0,0,0,0|1,1,0]=3 63 B9R1.2 CNC1=CC(N)=CC=C1 NO16640 [1,0,0,0,0,0|2,0,0]=3 64 B9R1.2 CNC1=CC=CC(O)=C1 DY442233 [1,0,0,0,0,0|2,0,0]=3 65 B9R1.2 CNC1=NC(Cl)=CN=C1 NO10695 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.2 CNC1=NC=CC(F)=C1 DY714974 [1,0,0,0,0,0|2,1,0]=4 67 B9R1.2 CNC1=NC=CC(I)=C1 DY452194 [1,0,0,0,0,0|2,1,0]=4 68 B9R1.2 CNC1=NC=CC(N)=C1 NO16967 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.2 COC1=CC(Br)=NC=C1 NO16230 [1,0,0,0,0,0|2,1,0]=4 70 B9R1.2 COC1=CC(C)=CN=C1 DY451846 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.2 COC1=CC(Cl)=NC=C1 NO19311 [1,0,0,0,0,0|2,0,0]=3 72 B9R1.2 COC1=CC(Cl)=NC=N1 NO17690 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.2 COC1=CC(F)=NC=C1 NO14826 [1,0,0,0,0,0|2,1,0]=4 74 B9R1.2 COC1=CC(N)=NC=C1 NO19522 [1,0,0,0,0,0|3,0,0]=4 75 B9R1.2 COC1=CC=CC(Br)=N1 NO14301 [1,0,0,0,0,0|2,1,0]=4 76 B9R1.2 COC1=CC=CC(Cl)=C1 NO19894 [1,0,0,0,0,0|1,0,0]=2 77 B9R1.2 COC1=CC=CC(Cl)=N1 NO13826 [1,0,0,0,0,0|2,0,0]=3 78 B9R1.2 COC1=CC=CC(F)=C1 NO19929 [1,0,0,0,0,0|1,1,0]=3 79 B9R1.2 COC1=CC=CC(F)=N1 NO13652 [1,0,0,0,0,0|2,1,0]=4 80 B9R1.2 COC1=CC=CC(I)=N1 NO18075 [1,0,0,0,0,0|2,1,0]=4 81 B9R1.2 COC1=CC=CC(N)=C1 NO19943 [1,0,0,0,0,0|2,0,0]=3 82 B9R1.2 COC1=CC=CC(N)=N1 NO13845 [1,0,0,0,0,0|3,0,0]=4 83 B9R1.2 COC1=CC=CC(O)=C1 NO18747 [1,0,0,0,0,0|2,0,0]=3 84 B9R1.2 COC1=CC=C[N+]([O-])=C1 NO22349 [1,0,0,0,0,0|3,0,0]=4 85 B9R1.2 COC1=CN=CC(Cl)=N1 NO21483 [1,0,0,0,0,0|3,0,0]=4 86 B9R1.2 COC1=CN=CC(N)=C1 NO19973 [1,0,0,0,0,0|3,0,0]=4 87 B9R1.2 COC1=CN=CC(O)=C1 NO17819 [1,0,0,0,0,0|3,0,0]=4 88 B9R1.2 COC1=CN=NC(Cl)=C1 NO22227 [1,0,0,0,0,0|3,0,0]=4 89 B9R1.2 COC1=NC(C)=CC=C1 NO15396 [1,0,0,0,0,0|3,0,0]=4 90 B9R1.2 COC1=NC(Cl)=NC=C1 NO21447 [1,0,0,0,0,0|3,0,0]=4 91 B9R1.2 COC1=NC=CC(Br)=C1 NO22650 [1,0,0,0,0,0|2,1,0]=4 92 B9R1.2 COC1=NC=CC(C)=C1 NO21637 [1,0,0,0,0,0|3,0,0]=4 93 B9R1.2 COC1=NC=CC(Cl)=C1 NO19313 [1,0,0,0,0,0|2,0,0]=3 94 B9R1.2 COC1=NC=CC(F)=C1 NO11908 [1,0,0,0,0,0|2,1,0]=4 95 B9R1.2 COC1=NC=CC(I)=C1 NO19594 [1,0,0,0,0,0|2,1,0]=4 96 B9R1.2 COC1=NC=CC(N)=C1 NO19525 [1,0,0,0,0,0|3,0,0]=4 97 B9R1.2 CSC1=CC(Cl)=NC=N1 NO12488 [1,0,0,0,0,0|3,0,0]=4 98 B9R1.2 CSC1=CC(N)=CC=C1 DY20570 [1,0,0,0,0,0|2,0,0]=3 99 B9R1.2 CSC1=CC(N)=NC=C1 DY657949 [1,0,0,0,0,0|3,0,0]=4 100 B9R1.2 CSC1=CN=CC(Br)=C1 DY452608 [1,0,0,0,0,0|2,1,0]=4 101 B9R1.2 CSC1=NC(Cl)=NC=C1 NO19934 [1,0,0,0,0,0|3,0,0]=4 102 B9R1.2 CSC1=NC=CC(Cl)=C1 NO12493 [1,0,0,0,0,0|2,0,0]=3 103 B9R1.2 CSC1=NC=CC(Cl)=N1 NO18332 [1,0,0,0,0,0|3,0,0]=4 104 B9R1.2 ClC1=CC=CC(CBr)=C1 NO22235 [1,0,0,0,0,0|1,0,0]=2 105 B9R1.2 ClC1=NC=CC(CBr)=C1 DY657889 [1,0,0,0,0,0|2,0,0]=3 106 B9R1.2 ClCC1=CC(Br)=CC=C1 DY40579 [1,0,0,0,0,0|1,1,0]=3 107 B9R1.2 ClCc1cccc(I)c1 DY585080 [1,0,0,0,0,0|1,1,0]=3 108 B9R1.2 FC1=CC=CC(CBr)=N1 DY500445 [1,0,0,0,0,0|2,1,0]=4 109 B9R1.2 FC1=CC=CC(CCl)=C1 NO19068 [1,0,0,0,0,0|1,1,0]=3 110 B9R1.2 FCC1=CC(Br)=NC=C1 DY512247 [1,0,0,0,0,0|2,1,0]=4 111 B9R1.2 N#CC1=CC(Br)=CC=C1 NO19865 [1,0,0,0,0,0|0,1,2]=4 112 B9R1.2 N#CC1=CC(Cl)=CC=C1 NO19319 [1,0,0,0,0,0|0,0,2]=3 113 B9R1.2 N#CC1=CC(Cl)=NC=C1 NO18691 [1,0,0,0,0,0|1,0,2]=4 114 B9R1.2 N#CC1=CC(F)=CC=C1 DY20044 [1,0,0,0,0,0|0,1,2]=4 115 B9R1.2 N#CC1=CC(N)=CC=C1 NO13394 [1,0,0,0,0,0|1,0,2]=4 116 B9R1.2 N#CC1=CC(O)=CC=C1 NO19377 [1,0,0,0,0,0|1,0,2]=4 117 B9R1.2 N#CC1=NC(Cl)=CC=C1 NO14156 [1,0,0,0,0,0|1,0,2]=4 118 B9R1.2 N#CC1=NC=CC(Cl)=C1 NO18109 [1,0,0,0,0,0|1,0,2]=4 119 B9R1.2 NC1=CC(CBr)=CN=C1 DY659222 [1,0,0,0,0,0|3,0,0]=4 120 B9R1.2 NC1=CC(CO)=NC=C1 DY33483 [1,0,0,0,0,0|3,0,0]=4 121 B9R1.2 NC1=CC=CC(CO)=C1 NO18821 [1,0,0,0,0,0|2,0,0]=3 122 B9R1.2 NC1=CC=CC(CO)=N1 NO16612 [1,0,0,0,0,0|3,0,0]=4 123 B9R1.2 NC1=CN=CC(CO)=C1 NO22079 [1,0,0,0,0,0|3,0,0]=4 124 B9R1.2 NC1=NC=CC(CO)=C1 NO17807 [1,0,0,0,0,0|3,0,0]=4 125 B9R1.2 NCC1=CC(=O)N=CN1 DY112983 [1,0,0,0,0,0|3,0,0]=4 126 B9R1.2 NCC1=CC(Br)=CC=C1 NO19652 [1,0,0,0,0,0|0,1,0]=2 127 B9R1.2 NCC1=CC(Br)=NC=C1 NO17247 [1,0,0,0,0,0|1,1,0]=3 128 B9R1.2 NCC1=CC(Cl)=CC=C1 DY33134 [1,0,0,0,0,0|0,0,0]=1 129 B9R1.2 NCC1=CC(Cl)=NC=C1 NO16037 [1,0,0,0,0,0|1,0,0]=2 130 B9R1.2 NCC1=CC(I)=CC=C1 DY584527 [1,0,0,0,0,0|0,1,0]=2 131 B9R1.2 NCC1=CC(I)=CC=C1 NO22330 [1,0,0,0,0,0|0,1,0]=2 132 B9R1.2 NCC1=CC=CC(=O)N1 DY582837 [1,0,0,0,0,0|2,0,0]=3 133 B9R1.2 NCC1=CC=CC(O)=C1 DY745447 [1,0,0,0,0,0|1,0,0]=2 134 B9R1.2 NCC1=NC(Br)=CC=C1 NO10635 [1,0,0,0,0,0|1,1,0]=3 135 B9R1.2 NCC1=NC(Cl)=CC=C1 DY527445 [1,0,0,0,0,0|1,0,0]=2 136 B9R1.2 NCC1=NC(Cl)=CN=C1 DY106438 [1,0,0,0,0,0|2,0,0]=3 137 B9R1.2 NCC1=NC(F)=CC=C1 NO13193 [1,0,0,0,0,0|1,1,0]=3 138 B9R1.2 NCC1=NC=CC(Br)=C1 NO12824 [1,0,0,0,0,0|1,1,0]=3 139 B9R1.2 NCC1=NC=CC(Br)=C1 NO15559 [1,0,0,0,0,0|1,1,0]=3 140 B9R1.2 NNC1=CC(Br)=CC=C1 NO19465 [1,0,0,0,0,0|1,1,0]=3 141 B9R1.2 NNC1=CC(Cl)=CC=C1 NO19479 [1,0,0,0,0,0|1,0,0]=2 142 B9R1.2 NNC1=CC(Cl)=NC=N1 NO17425 [1,0,0,0,0,0|3,0,0]=4 143 B9R1.2 NNC1=CC(F)=CC=C1 NO19485 [1,0,0,0,0,0|1,1,0]=3 144 B9R1.2 NNC1=CC=CC(Br)=N1 DY545589 [1,0,0,0,0,0|2,1,0]=4 145 B9R1.2 NNC1=CC=CC(Cl)=N1 NO21479 [1,0,0,0,0,0|2,0,0]=3 146 B9R1.2 NNC1=NC(Cl)=NC=C1 NO16010 [1,0,0,0,0,0|3,0,0]=4 147 B9R1.2 O=C1C=CNC(CO)=C1 DY654576 [1,0,0,0,0,0|3,0,0]=4 148 B9R1.2 O=CC1=CC(Br)=CC=C1 NO18958 [1,0,0,0,0,0|1,1,1]=4 149 B9R1.2 O=CC1=CC(Cl)=CC=C1 DY20579 [1,0,0,0,0,0|1,0,1]=3 150 B9R1.2 O=CC1=CC(F)=CC=C1 NO22298 [1,0,0,0,0,0|1,1,1]=4 151 B9R1.2 O=CC1=CC(I)=CC=C1 NO20132 [1,0,0,0,0,0|1,1,1]=4 152 B9R1.2 O=CC1=CC(O)=CC=C1 DY20422 [1,0,0,0,0,0|2,0,1]=4 153 B9R1.2 O=CC1=NC(Cl)=CC=C1 NO19944 [1,0,0,0,0,0|2,0,1]=4 154 B9R1.2 O=CC1=NC=CC(Cl)=C1 NO22794 [1,0,0,0,0,0|2,0,1]=4 155 B9R1.2 OCC1=CC(Br)=CN=C1 NO18272 [1,0,0,0,0,0|2,1,0]=4 156 B9R1.2 OCC1=CC(Br)=NC=C1 NO19256 [1,0,0,0,0,0|2,1,0]=4 157 B9R1.2 OCC1=CC(F)=CC=C1 NO19069 [1,0,0,0,0,0|1,1,0]=3 158 B9R1.2 OCC1=CC(F)=CN=C1 DY430713 [1,0,0,0,0,0|2,1,0]=4 159 B9R1.2 OCC1=NC(Br)=CC=C1 NO23004 [1,0,0,0,0,0|2,1,0]=4 160 B9R1.2 OCC1=NC(Cl)=CC=C1 NO10667 [1,0,0,0,0,0|2,0,0]=3 161 B9R1.2 OCC1=NC(Cl)=CC=C1 NO19907 [1,0,0,0,0,0|2,0,0]=3 162 B9R1.2 OCC1=NC(Cl)=CN=C1 NO16124 [1,0,0,0,0,0|3,0,0]=4 163 B9R1.2 OCC1=NC(Cl)=NC=C1 DY550299 [1,0,0,0,0,0|3,0,0]=4 164 B9R1.2 OCC1=NC=CC(Br)=C1 NO18696 [1,0,0,0,0,0|2,1,0]=4 165 B9R1.2 OCC1=NC=CC(Cl)=C1 DY20517 [1,0,0,0,0,0|2,0,0]=3 166 B9R1.2 OCC1=NC=CC(O)=C1 NO17612 [1,0,0,0,0,0|3,0,0]=4 167 B9R1.2 [O-][n+]1cccc(CO)c1 DY567759 [1,0,0,0,0,0|3,0,0]=4 168 B9R1.8 BrCCC1=CC=CN=C1 DY608158 [1,0,0,0,0,0|2,0,0]=3 169 B9R1.8 C#CCC1=CC=CC=C1 DY501873 [1,0,0,0,0,0|1,0,1]=3 170 B9R1.8 CCCC1=CC=CN=C1 NO22402 [1,0,0,0,0,0|2,0,0]=3 171 B9R1.8 CNCC1=CC=CC=C1 DY10559 [1,0,0,0,0,0|2,0,0]=3 172 B9R1.8 CNCC1=CC=CC=C1 DY20323 [1,0,0,0,0,0|2,0,0]=3 173 B9R1.8 CNCC1=CC=CC=C1 DY21006 [1,0,0,0,0,0|2,0,0]=3 174 B9R1.8 CNCC1=CC=CN=C1 NO18846 [1,0,0,0,0,0|3,0,0]=4 175 B9R1.8 CNCC1=CC=NC=C1 DY712153 [1,0,0,0,0,0|3,0,0]=4 176 B9R1.8 CNCC1=NC=CC=C1 DY501242 [1,0,0,0,0,0|3,0,0]=4 177 B9R1.8 CNCC1=NC=CC=C1 DY663671 [1,0,0,0,0,0|3,0,0]=4 178 B9R1.8 COCC1=NC=CC=C1 NO20909 [1,0,0,0,0,0|3,0,0]=4 179 B9R1.8 ClCCC1=CC=NC=C1 NO17913 [1,0,0,0,0,0|2,0,0]=3 180 B9R1.8 ClCCC1=NC=CN=C1 DY585865 [1,0,0,0,0,0|3,0,0]=4 181 B9R1.8 ClCSC1=CC=CC=C1 DY797799 [1,0,0,0,0,0|2,0,0]=3 182 B9R1.8 N#CCC1=CC=CN=C1 NO18407 [1,0,0,0,0,0|1,0,2]=4 183 B9R1.8 N#CCC1=CC=NC=C1 NO20239 [1,0,0,0,0,0|1,0,2]=4 184 B9R1.8 N#CCC1=NC=CC=C1 NO18926 [1,0,0,0,0,0|1,0,2]=4 185 B9R1.8 N#C[Se]C1=CC=CC=C1 DY822031 [1,0,0,0,0,0|1,0,2]=4 186 B9R1.8 NCCC1=CC=CN=C1 NO21892 [1,0,0,0,0,0|1,0,0]=2 187 B9R1.8 NCCC1=CN=CN=C1 DY693160 [1,0,0,0,0,0|2,0,0]=3 188 B9R1.8 NCCC1=NC=CC=C1 NO14064 [1,0,0,0,0,0|1,0,0]=2 189 B9R1.8 NCCC1=NC=CC=N1 DY510693 [1,0,0,0,0,0|2,0,0]=3 190 B9R1.8 NNCC1=CC=CC=C1 NO11006 [1,0,0,0,0,0|1,0,0]=2 191 B9R1.8 NNCC1=CC=CC=C1 NO12127 [1,0,0,0,0,0|1,0,0]=2 192 B9R1.8 NNCC1=CC=NC=C1 DY518961 [1,0,0,0,0,0|2,0,0]=3 193 B9R1.8 NNCC1=NC=CC=C1 DY578445 [1,0,0,0,0,0|2,0,0]=3 194 B9R1.8 NOCC1=CC=CC=C1 NO14063 [1,0,0,0,0,0|1,0,0]=2 195 B9R1.8 OCCC1=CN=CN=C1 NO12401 [1,0,0,0,0,0|3,0,0]=4 196 B9R1.8 ONCC1=CC=CC=C1 DY563853 [1,0,0,0,0,0|2,0,0]=3 197 B9R1.8 ONCC1=CC=CC=C1 NO11753 [1,0,0,0,0,0|2,0,0]=3 198 B11R1.13 CC1=C(CC#N)C=CC=C1Br DY584724 [0,1,0,0,0,0|0,1,2]=4 199 B11R1.13 CC1=C(CC#N)C=CC=C1F DY585162 [0,1,0,0,0,0|0,1,2]=4 200 B11R1.13 CC1=C(CC#N)C=CC=C1I DY584865 [0,1,0,0,0,0|0,1,2]=4 201 B11R1.13 CC1=C(Cl)C=CC=C1N=C=S DY20564 [0,1,0,0,0,0|2,0,1]=4 202 B11R1.13 CC1=CC=CC(CC#N)=C1Br DY584581 [0,1,0,0,0,0|1,0,2]=4 203 B11R1.13 CCNC1=C(N)C(Cl)=NC=C1 DY121212 [0,1,0,0,0,0|3,0,0]=4 204 B11R1.13 CNCC1=C(Cl)C(Cl)=CC=C1 NO20112 [0,1,0,0,0,0|2,0,0]=3 205 B11R1.13 CNCC1=C(F)C(Cl)=CC=C1 DY516897 [0,1,0,0,0,0|2,0,0]=3 206 B11R1.13 N#CCC1=C(Br)C(Cl)=CC=C1 DY584930 [0,1,0,0,0,0|0,0,2]=3 207 B11R1.13 N#CCC1=C(Cl)C(Cl)=CC=C1 NO18973 [0,1,0,0,0,0|0,0,2]=3 208 B11R1.13 O=C=NC1=CC=CC(Cl)=C1F DY584414 [0,1,0,0,0,0|2,0,1]=4 209 B11R1.13 S=C=Nc1cccc(Cl)c1Cl DY584321 [0,1,0,0,0,0|2,0,1]=4 210 B11R1.23 C=CC(O)C1=CC(Br)=CC=C1 DY745051 [0,1,0,0,0,0|1,1,1]=4 211 B11R1.23 CCC(=O)C1=CC(Br)=CC=C1 DY41278 [0,1,0,0,0,0|1,1,1]=4 212 B11R1.23 CCC(=O)C1=CC(C)=CC=C1 DY745657 [0,1,0,0,0,0|2,0,1]=4 213 B11R1.23 CCC(=O)C1=CC(F)=CC=C1 DY41284 [0,1,0,0,0,0|1,1,1]=4 214 B11R1.23 CCC(N)C1=NC(C)=CC=C1 DY606027 [0,1,0,0,0,0|3,0,0]=4 215 B11R1.23 CC[C@@H](N)C1=CC(Cl)=CC=C1 DY508850 [0,1,0,0,0,0|1,0,0]=2 216 B11R1.23 CC[C@H](N)C1=CC(C)=CC=C1 DY585435 [0,1,0,0,0,0|2,0,0]=3 217 B11R1.23 CN[C@H](C)C1=CC(F)=CC=C1 DY744907 [0,1,0,0,0,0|2,1,0]=4 218 B11R1.23 COC(=O)C1=CC(Cl)=CC=C1 NO11622 [0,1,0,0,0,0|2,0,1]=4 219 B11R1.23 NC(CO)C1=CC(Br)=CC=C1 DY535233 [0,1,0,0,0,0|1,1,0]=3 220 B11R1.23 NC(CO)C1=CC(Cl)=CC=C1 DY518181 [0,1,0,0,0,0|1,0,0]=2 221 B11R1.23 NCC(O)C1=CC=CC(O)=C1 DY556047 [0,1,0,0,0,0|1,0,0]=2 222 B11R1.23 NC[C@@H](O)C1=CC(Cl)=CC=C1 DY530577 [0,1,0,0,0,0|0,0,0]=1 223 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 DY741673 [0,1,0,0,0,0|0,0,0]=1 224 B11R1.23 NNC(=O)C1=CC(I)=CC=C1 DY552699 [0,1,0,0,0,0|1,1,1]=4 225 B11R1.23 N[C@@H](CO)C1=CC(Cl)=CC=C1 DY513939 [0,1,0,0,0,0|1,0,0]=2 226 B11R1.23 N[C@H](CO)C1=CC(Cl)=CC=C1 DY563793 [0,1,0,0,0,0|1,0,0]=2 227 B11R1.23 O=C(CBr)C1=CC(Cl)=CC=C1 NO19056 [0,1,0,0,0,0|1,0,1]=3 228 B11R1.23 O=C(CBr)C1=CC(F)=CC=C1 NO15383 [0,1,0,0,0,0|1,1,1]=4 229 B11R1.23 O=C(CCl)C1=CC(Cl)=CC=C1 DY20163 [0,1,0,0,0,0|1,0,1]=3 230 B11R1.23 O=C(CCl)C1=CC=CC(F)=C1 DY584626 [0,1,0,0,0,0|1,1,1]=4 231 B11R1.23 O=C(OO)C1=CC(Cl)=CC=C1 DY20584 [0,1,0,0,0,0|2,0,1]=4 232 B11R1.24 CCCOC1=NC=CC(Br)=C1 DY430459 [0,1,0,0,0,0|2,1,0]=4 233 B11R1.24 CCNCC1=CC=CC(O)=C1 DY579381 [0,1,0,0,0,0|2,0,0]=3 234 B11R1.24 CNCCC1=CC(C)=CC=C1 DY520263 [0,1,0,0,0,0|1,0,0]=2 235 B11R1.24 COCOC1=CC=CC(Cl)=C1 DY449110 [0,1,0,0,0,0|2,0,0]=3 236 B11R1.24 FC1=CC=CC(CN=C=S)=C1 DY41079 [0,1,0,0,0,0|1,1,1]=4 237 B11R1.24 FC1=CC=CC(OCCBr)=C1 DY574785 [0,1,0,0,0,0|1,1,0]=3 238 B11R1.24 N#CCOC1=CC(Cl)=CC=C1 DY744883 [0,1,0,0,0,0|0,0,2]=3 239 B11R1.24 NC1=CC=CC(OCCO)=C1 DY557451 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.24 O=C=NCC1=CC(F)=CC=C1 DY790131 [0,1,0,0,0,0|1,1,1]=4 241 B11R1.24 OCCNC1=NC(Cl)=CC=C1 DY653604 [0,1,0,0,0,0|2,0,0]=3 242 B11R1.34 C#CCC1=CC(F)=CC(F)=C1 DY431174 [0,1,0,0,0,0|1,1,1]=4 243 B11R1.34 CCCC1=CC(Cl)=NC(C)=N1 DY455610 [0,1,0,0,0,0|3,0,0]=4 244 B11R1.34 CCCC1=NC(C)=CC(Cl)=N1 DY603027 [0,1,0,0,0,0|3,0,0]=4 245 B11R1.34 N#CCC1=CC(Cl)=CC(Cl)=C1 NO20845 [0,1,0,0,0,0|0,0,2]=3 246 B11R1.34 N#CCC1=CC(F)=CC(F)=C1 NO20643 [0,1,0,0,0,0|0,1,2]=4 247 B11R1.34 NCCC1=CC(Cl)=CC(Cl)=C1 NO16793 [0,1,0,0,0,0|0,0,0]=1 248 B11R1.34 O=C=NC1=CC(Cl)=CC(Cl)=C1 DY584541 [0,1,0,0,0,0|2,0,1]=4 249 B11R1.157 CC(=O)CC1=CC(Br)=CC=C1 NO22187 [0,1,0,0,0,0|1,1,1]=4 250 B11R1.157 CC(C)CC1=CC=CC(N)=C1 DY822133 [0,1,0,0,0,0|2,0,0]=3 251 B11R1.157 CC(N)CC1=CC(Br)=CC=C1 DY511737 [0,1,0,0,0,0|0,1,0]=2 252 B11R1.157 FC(F)OC1=CC(Cl)=NC=C1 NO16718 [0,1,0,0,0,0|3,0,0]=4 253 B11R1.157 FC(F)Oc1cccc(I)c1 DY585165 [0,1,0,0,0,0|2,1,0]=4 254 B11R1.157 FC1=CC=CC(OC(F)F)=C1 DY722347 [0,1,0,0,0,0|2,1,0]=4 255 B11R1.157 NC(=O)CC1=CC(Cl)=CC=C1 DY799707 [0,1,0,0,0,0|0,0,1]=2 256 B11R1.157 NC(=S)NC1=CC(F)=CC=C1 DY795615 [0,1,0,0,0,0|1,1,1]=4 257 B11R1.157 NC1=CC(OC(F)F)=CC=C1 NO13961 [0,1,0,0,0,0|3,0,0]=4 258 B11R1.157 NC1=CC=CC(CC(=O)O)=C1 NO21911 [0,1,0,0,0,0|2,0,1]=4 259 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 NO10775 [0,1,0,0,0,0|1,1,1]=4 260 B11R1.157 O=C(O)CC1=CC(Cl)=CC=C1 NO21923 [0,1,0,0,0,0|1,0,1]=3 261 B11R1.157 O=C(O)CC1=CC(Cl)=NC=C1 DY577827 [0,1,0,0,0,0|2,0,1]=4 262 B11R1.157 O=C(O)CC1=CC(I)=CC=C1 NO20851 [0,1,0,0,0,0|1,1,1]=4 263 B11R1.157 O=C(O)CC1=CC(O)=CC=C1 NO20944 [0,1,0,0,0,0|2,0,1]=4 264 B11R1.157 O=C(O)CC1=NC(Cl)=CC=C1 NO12801 [0,1,0,0,0,0|2,0,1]=4 265 B11R1.157 OB(O)CC1=CC(F)=CC=C1 DY706879 [0,1,0,0,0,0|2,1,0]=4 266 B11R1.157 OC1=CC(OC(F)F)=CC=C1 DY431656 [0,1,0,0,0,0|3,0,0]=4 267 B11R1.182 CC1=C(CC#N)C=C(Br)C=C1 DY584752 [0,1,0,0,0,0|0,1,2]=4 268 B11R1.182 CC1=C(CC#N)C=C(F)C=C1 NO19339 [0,1,0,0,0,0|0,1,2]=4 269 B11R1.182 CC1=CC(CC#N)=C(C)C=C1 NO21152 [0,1,0,0,0,0|1,0,2]=4 270 B11R1.182 CC1=CC(CCO)=C(C)C=C1 DY40742 [0,1,0,0,0,0|2,0,0]=3 271 B11R1.182 CC1=CC(CNN)=C(C)C=C1 DY519153 [0,1,0,0,0,0|2,0,0]=3 272 B11R1.182 CC1=NN(CCN)C(=O)C=C1 DY549939 [0,1,0,0,0,0|3,0,0]=4 273 B11R1.182 CCOC1=C(Br)C=CC(C)=C1 DY451888 [0,1,0,0,0,0|3,0,0]=4 274 B11R1.182 CCOC1=C(Br)C=CC(N)=C1 NO20424 [0,1,0,0,0,0|3,0,0]=4 275 B11R1.182 CNCC1=C(F)C=CC(F)=C1 DY456646 [0,1,0,0,0,0|2,1,0]=4 276 B11R1.182 N#CCC1=C(Br)C=CC(Br)=C1 DY585001 [0,1,0,0,0,0|0,1,2]=4 277 B11R1.182 N#CCC1=C(Cl)C=CC(Cl)=C1 NO18974 [0,1,0,0,0,0|0,0,2]=3 278 B11R1.182 N#CCC1=C(F)C=CC(Br)=C1 NO16321 [0,1,0,0,0,0|0,1,2]=4 279 B11R1.182 NCCC1=C(Br)C=CC(Cl)=C1 DY522951 [0,1,0,0,0,0|0,0,0]=1 280 B11R1.182 NCCC1=C(Cl)C=CC(Cl)=C1 DY795369 [0,1,0,0,0,0|0,0,0]=1 281 B11R1.189 CCOC1=CC=CC(C#N)=C1 DY584293 [0,1,0,0,0,0|3,0,0]=4 282 B11R1.189 CCOC1=CC=CC(C=O)=C1 DY433437 [0,1,0,0,0,0|3,0,0]=4 283 B11R1.189 COC1=CC=CC(CC#N)=C1 NO11040 [0,1,0,0,0,0|1,0,2]=4 284 B11R1.189 COC1=CC=CC(CCN)=C1 NO13916 [0,1,0,0,0,0|1,0,0]=2 285 B11R1.189 COC1=CC=CC(CCO)=C1 NO22342 [0,1,0,0,0,0|2,0,0]=3 286 B11R1.189 COCC1=CC=CC(C#N)=C1 NO18233 [0,1,0,0,0,0|3,0,0]=4 287 B11R1.189 COCC1=CC=CC(CN)=C1 NO15687 [0,1,0,0,0,0|3,0,0]=4 288 B11R1.189 N#CC1=CC(CNN)=CC=C1 DY686755 [0,1,0,0,0,0|2,0,0]=3 289 B11R1.189 NCC1=CC=CC(CCO)=C1 NO17053 [0,1,0,0,0,0|2,0,0]=3 290 B11R1.192 CC1=C(Br)C=C(CC#N)C=C1 DY584714 [0,1,0,0,0,0|0,1,2]=4 291 B11R1.192 CC1=C(F)C=CC(CC#N)=C1 DY40778 [0,1,0,0,0,0|1,0,2]=4 292 B11R1.192 CCOC1=CC(Cl)=C(Br)C=C1 NO16022 [0,1,0,0,0,0|2,0,0]=3 293 B11R1.192 CNCC1=CC(Cl)=C(Cl)C=C1 NO11711 [0,1,0,0,0,0|2,0,0]=3 294 B11R1.192 CNCC1=CC=C(O)C(O)=C1 DY502761 [0,1,0,0,0,0|3,0,0]=4 295 B11R1.192 FC1=C(F)C=C(CCBr)C=C1 DY584641 [0,1,0,0,0,0|1,1,0]=3 296 B11R1.192 Fc1ccc(C[Zn]Br)cc1F DY794193 [0,1,0,0,0,0|2,1,0]=4 297 B11R1.192 N#CCC1=CC(Cl)=C(Cl)C=C1 NO20633 [0,1,0,0,0,0|0,0,2]=3 298 B11R1.192 N#CCC1=CC(Cl)=C(F)C=C1 NO18657 [0,1,0,0,0,0|0,0,2]=3 299 B11R1.192 N#CCC1=CC(F)=C(Br)C=C1 NO15044 [0,1,0,0,0,0|0,1,2]=4 300 B11R1.192 NCCC1=CC(Cl)=C(Cl)C=C1 NO21933 [0,1,0,0,0,0|0,0,0]=1 301 B11R1.192 NCCC1=CC(F)=C(F)C=C1 DY584648 [0,1,0,0,0,0|0,1,0]=2 302 B11R1.192 NCCC1=CC=C(O)C(O)=C1 NO15345 [0,1,0,0,0,0|1,0,0]=2 303 B11R1.192 O=CCC1=CC(O)=C(O)C=C1 DY745117 [0,1,0,0,0,0|2,0,1]=4 304 B11R1.192 OCCC1=CC(Cl)=C(Cl)C=C1 NO21932 [0,1,0,0,0,0|1,0,0]=2 305 B11R1.192 OCCC1=CC(Cl)=C(F)C=C1 DY584825 [0,1,0,0,0,0|1,0,0]=2 306 B11R1.192 OCCC1=CC(F)=C(Cl)C=C1 DY584900 [0,1,0,0,0,0|1,1,0]=3 307 B11R1.192 O\N=C\c1ccc(Cl)c(Cl)c1 DY796131 [0,1,0,0,0,0|2,0,1]=4 308 B11R2.35 CC1=CC(C2=NC2)=CC=C1 DY770565 [0,0,0,1,0,0|1,0,2]=4 309 B11R2.36 BrC1=CC2=C(C=C1)NC=N2 NO10238 [0,0,0,1,0,0|1,1,1]=4 310 B11R2.36 BrC1=CC2=C(C=C1)OCC2 DY20389 [0,0,0,1,0,0|1,1,0]=3 311 B11R2.36 BrC1=CC=C2C=CCC2=C1 DY549009 [0,0,0,1,0,0|1,1,1]=4 312 B11R2.36 BrC1=CC=C2CCNC2=C1 NO17623 [0,0,0,1,0,0|2,1,0]=4 313 B11R2.36 BrC1=CC=C2CNCC2=C1 DY20658 [0,0,0,1,0,0|2,1,0]=4 314 B11R2.36 BrC1=CC=C2CNCC2=C1 NO14408 [0,0,0,1,0,0|2,1,0]=4 315 B11R2.36 BrC1=CC=C2NC=CC2=C1 NO17784 [0,0,0,1,0,0|0,1,2]=4 316 B11R2.36 BrC1=CC=C2NCCC2=C1 NO10836 [0,0,0,1,0,0|0,1,0]=2 317 B11R2.36 BrC1=CC=C2NN=CC2=C1 NO15506 [0,0,0,1,0,0|1,1,1]=4 318 B11R2.36 BrC1=CN=C2CCCC2=C1 NO22164 [0,0,0,1,0,0|2,1,0]=4 319 B11R2.36 BrC1=CN=C2NCCC2=C1 DY533421 [0,0,0,1,0,0|1,1,0]=3 320 B11R2.36 BrC1=CN=C2NCCC2=C1 NO18623 [0,0,0,1,0,0|1,1,0]=3 321 B11R2.36 Brc1ccc2c(c1)OCO2 NO19789 [0,0,0,1,0,0|2,1,0]=4 322 B11R2.36 CC1=CC=C2CNCC2=C1 DY431420 [0,0,0,1,0,0|3,0,0]=4 323 B11R2.36 CC1=CC=C2NC=CC2=C1 NO11033 [0,0,0,1,0,0|1,0,2]=4 324 B11R2.36 CC1=CN2CCN=C2C=C1 DY760340 [0,0,0,1,0,0|2,0,1]=4 325 B11R2.36 ClC1=CC2=C(C=C1)N=CN2 DY443515 [0,0,0,1,0,0|1,0,2]=4 326 B11R2.36 ClC1=CC2=C(C=C1)OC=N2 NO19972 [0,0,0,1,0,0|2,0,1]=4 327 B11R2.36 ClC1=CC2=C(C=C1)SC=C2 NO20641 [0,0,0,1,0,0|1,0,2]=4 328 B11R2.36 ClC1=CC2=C(C=C1)SC=N2 NO10346 [0,0,0,1,0,0|2,0,1]=4 329 B11R2.36 ClC1=CC2=C(C=N1)CCN2 NO14935 [0,0,0,1,0,0|3,0,0]=4 330 B11R2.36 ClC1=CC=C2C=CNC2=C1 NO22097 [0,0,0,1,0,0|2,0,1]=4 331 B11R2.36 ClC1=CC=C2C=NNC2=C1 NO18428 [0,0,0,1,0,0|3,0,0]=4 332 B11R2.36 ClC1=CC=C2CCNC2=C1 NO19407 [0,0,0,1,0,0|2,0,0]=3 333 B11R2.36 ClC1=CC=C2CNCC2=C1 NO15340 [0,0,0,1,0,0|2,0,0]=3 334 B11R2.36 ClC1=CC=C2NC=CC2=C1 NO22049 [0,0,0,1,0,0|0,0,2]=3 335 B11R2.36 ClC1=CC=C2NC=CC2=N1 NO10317 [0,0,0,1,0,0|1,0,2]=4 336 B11R2.36 ClC1=CC=C2NCCC2=C1 DY20079 [0,0,0,1,0,0|0,0,0]=1 337 B11R2.36 ClC1=CC=C2NCCC2=C1 DY630382 [0,0,0,1,0,0|0,0,0]=1 338 B11R2.36 ClC1=CC=C2NN=CC2=C1 NO10312 [0,0,0,1,0,0|1,0,1]=3 339 B11R2.36 ClC1=CC=C2NN=CC2=N1 NO18556 [0,0,0,1,0,0|2,0,1]=4 340 B11R2.36 ClC1=CN=C2NC=CC2=C1 NO18515 [0,0,0,1,0,0|1,0,2]=4 341 B11R2.36 ClC1=NC=C2NC=CC2=C1 NO13092 [0,0,0,1,0,0|1,0,2]=4 342 B11R2.36 FC1=CC=C2CCCC2=C1 NO16751 [0,0,0,1,0,0|1,1,0]=3 343 B11R2.36 FC1=CC=C2CCNC2=C1 DY443334 [0,0,0,1,0,0|2,1,0]=4 344 B11R2.36 FC1=CC=C2CNCC2=C1 DY459041 [0,0,0,1,0,0|2,1,0]=4 345 B11R2.36 FC1=CC=C2CNCC2=C1 NO15207 [0,0,0,1,0,0|2,1,0]=4 346 B11R2.36 FC1=CC=C2NN=CC2=C1 NO18254 [0,0,0,1,0,0|1,1,1]=4 347 B11R2.36 IC1=CC=C2NN=CC2=C1 NO10408 [0,0,0,1,0,0|1,1,1]=4 348 B11R2.36 IC1=CN=C2CCCC2=C1 DY675123 [0,0,0,1,0,0|2,1,0]=4 349 B11R2.36 NC1=CC2=C(C=C1)CCO2 DY561471 [0,0,0,1,0,0|3,0,0]=4 350 B11R2.36 NC1=CC2=C(C=C1)OCO2 NO20315 [0,0,0,1,0,0|3,0,0]=4 351 B11R2.36 NC1=CC=C2CNCC2=C1 DY20849 [0,0,0,1,0,0|3,0,0]=4 352 B11R2.36 NC1=CC=C2CNCC2=C1 DY555549 [0,0,0,1,0,0|3,0,0]=4 353 B11R2.36 NC1=CC=C2NC=CC2=C1 NO20917 [0,0,0,1,0,0|1,0,2]=4 354 B11R2.36 NC1=CC=C2NCCC2=C1 DY630744 [0,0,0,1,0,0|1,0,0]=2 355 B11R2.36 NC1=CC=C2NN=CC2=C1 DY444376 [0,0,0,1,0,0|2,0,1]=4 356 B11R2.36 NC1=CN=C2CCCC2=C1 DY100354 [0,0,0,1,0,0|3,0,0]=4 357 B11R2.36 OC1=CC2=C(C=C1)CCO2 NO16031 [0,0,0,1,0,0|3,0,0]=4 358 B11R2.36 OC1=CC=C2CCNC2=C1 DY630750 [0,0,0,1,0,0|3,0,0]=4 359 B11R2.36 OC1=CC=C2CNCC2=C1 DY446903 [0,0,0,1,0,0|3,0,0]=4 360 B11R2.36 OC1=CC=C2NC=CC2=C1 NO20861 [0,0,0,1,0,0|1,0,2]=4 361 B11R2.36 OC1=CC=C2NN=CC2=C1 NO20711 [0,0,0,1,0,0|2,0,1]=4 362 B11R2.106 BrC1=C2CCCC2=CC=C1 NO16754 [0,0,0,1,0,0|1,1,0]=3 363 B11R2.106 BrC1=C2CCNC2=CC=C1 NO18513 [0,0,0,1,0,0|2,1,0]=4 364 B11R2.106 BrC1=C2CNCC2=CC=C1 NO22684 [0,0,0,1,0,0|2,1,0]=4 365 B11R2.106 BrC1=C2NC=CC2=CC=C1 NO10709 [0,0,0,1,0,0|0,1,2]=4 366 B11R2.106 BrC1=CC=CC2=C1OCC2 NO12983 [0,0,0,1,0,0|1,1,0]=3 367 B11R2.106 BrC1=CC=CC2=C1OCO2 NO22623 [0,0,0,1,0,0|2,1,0]=4 368 B11R2.106 CC1=C2CNCC2=CC=C1 NO17946 [0,0,0,1,0,0|3,0,0]=4 369 B11R2.106 CC1=C2NC=CC2=CC=C1 NO11034 [0,0,0,1,0,0|1,0,2]=4 370 B11R2.106 CC1=C2NCCC2=CC=C1 NO18412 [0,0,0,1,0,0|1,0,0]=2 371 B11R2.106 CC1=C2NN=CC2=CC=C1 NO10824 [0,0,0,1,0,0|2,0,1]=4 372 B11R2.106 ClC1=C2C=CNC2=CC=C1 NO10725 [0,0,0,1,0,0|2,0,1]=4 373 B11R2.106 ClC1=C2C=NNC2=CC=C1 NO22715 [0,0,0,1,0,0|3,0,0]=4 374 B11R2.106 ClC1=C2CCCC2=NC=C1 NO12915 [0,0,0,1,0,0|2,0,0]=3 375 B11R2.106 ClC1=C2CCNC2=CC=C1 NO10845 [0,0,0,1,0,0|2,0,0]=3 376 B11R2.106 ClC1=C2CCNC2=CN=C1 DY585263 [0,0,0,1,0,0|3,0,0]=4 377 B11R2.106 ClC1=C2CNCC2=CC=C1 DY630146 [0,0,0,1,0,0|2,0,0]=3 378 B11R2.106 ClC1=C2CNCC2=CC=C1 NO15338 [0,0,0,1,0,0|2,0,0]=3 379 B11R2.106 ClC1=C2NC=CC2=CC=C1 NO14936 [0,0,0,1,0,0|0,0,2]=3 380 B11R2.106 ClC1=C2NC=CC2=CC=N1 NO18260 [0,0,0,1,0,0|1,0,2]=4 381 B11R2.106 ClC1=C2NC=CC2=CN=C1 DY105224 [0,0,0,1,0,0|1,0,2]=4 382 B11R2.106 ClC1=C2NC=NC2=NC=C1 NO10503 [0,0,0,1,0,0|2,0,1]=4 383 B11R2.106 ClC1=C2NCCC2=CC=N1 DY518367 [0,0,0,1,0,0|1,0,0]=2 384 B11R2.106 ClC1=C2NN=CC2=CC=N1 NO12890 [0,0,0,1,0,0|2,0,1]=4 385 B11R2.106 ClC1=CC=CC2=C1N=CS2 NO12362 [0,0,0,1,0,0|1,0,2]=4 386 B11R2.106 ClC1=CC=CC2=NSN=C12 DY784954 [0,0,0,1,0,0|2,0,1]=4 387 B11R2.106 ClC1=NC=CC2=C1CNC2 DY676268 [0,0,0,1,0,0|3,0,0]=4 388 B11R2.106 ClC1=NC=CC2=C1NN=N2 NO15777 [0,0,0,1,0,0|3,0,0]=4 389 B11R2.106 FC1=C2CCNC2=CC=C1 DY433917 [0,0,0,1,0,0|2,1,0]=4 390 B11R2.106 FC1=C2CNCC2=CC=C1 DY430022 [0,0,0,1,0,0|2,1,0]=4 391 B11R2.106 FC1=C2CNCC2=CC=C1 DY580305 [0,0,0,1,0,0|2,1,0]=4 392 B11R2.106 FC1=C2NC=CC2=CC=C1 NO10747 [0,0,0,1,0,0|0,1,2]=4 393 B11R2.106 FC1=C2NN=CC2=CC=C1 NO10814 [0,0,0,1,0,0|1,1,1]=4 394 B11R2.106 IC1=C2CCNC2=CC=C1 DY630170 [0,0,0,1,0,0|2,1,0]=4 395 B11R2.106 IC1=CC=CC2=C1NC=N2 DY427402 [0,0,0,1,0,0|1,1,1]=4 396 B11R2.106 IC1=CC=CC2=C1OCO2 NO12923 [0,0,0,1,0,0|2,1,0]=4 397 B11R2.106 NC1=C2NC=CC2=CC=C1 NO10501 [0,0,0,1,0,0|1,0,2]=4 398 B11R2.106 NC1=CC=CC2=C1CCN2 NO11498 [0,0,0,1,0,0|3,0,0]=4 399 B11R2.106 NC1=CC=CC2=C1NC=N2 DY20436 [0,0,0,1,0,0|2,0,1]=4 400 B11R2.106 OC1=C2NN=CC2=CC=C1 NO17029 [0,0,0,1,0,0|2,0,1]=4 401 B11R2.106 OC1=CC=CC2=C1CCC2 NO22898 [0,0,0,1,0,0|2,0,0]=3 402 B11R2.106 OC1=CC=CC2=C1NN=N2 DY545445 [0,0,0,1,0,0|3,0,0]=4 403 B11R2.106 [O-][N+]1=CC=CC2=C1CCC2 DY579003 [0,0,0,1,0,0|3,0,0]=4 404 B9R1.7 C=CCC1=CC=C(Cl)S1 DY787408 [0,0,0,0,1,0|2,0,1]=4 405 B9R1.7 NCCC1=CN=C(O)S1 DY110548 [0,0,0,0,1,0|3,0,0]=4 406 B9R1.7 NCCC1=CSC(N)=N1 DY602437 [0,0,0,0,1,0|3,0,0]=4 407 B9R1.7 NCCN1C=C(F)C=N1 DY646050 [0,0,0,0,1,0|2,1,0]=4 408 B9R1.7 NNCC1=CSC(Cl)=C1 DY104510 [0,0,0,0,1,0|2,0,0]=3 409 B9R1.7 OCCC1=CC=C(Br)S1 DY447413 [0,0,0,0,1,0|2,1,0]=4 410 B9R1.33 CC1=CN=CN1CCN DY725977 [0,0,0,0,1,0|3,0,0]=4 411 B9R1.33 CN1C=CC=C1CCO DY106498 [0,0,0,0,1,0|3,0,0]=4 412 B8R1.2 BrCC1=CC=NC=C1 NO22459 [2,0,0,0,0,0|2,0,0]=4 413 B8R1.2 C#CC1=CC=CC=C1 NO19127 [2,0,0,0,0,0|0,0,2]=4 414 B8R1.2 CCC1=CC=CN=C1 NO22277 [2,0,0,0,0,0|1,0,0]=3 415 B8R1.2 CCC1=NC=CN=C1 NO21534 [2,0,0,0,0,0|2,0,0]=4 416 B8R1.2 CNC1=CC=CC=C1 NO11792 [2,0,0,0,0,0|1,0,0]=3 417 B8R1.2 CNC1=CC=CN=C1 NO13856 [2,0,0,0,0,0|2,0,0]=4 418 B8R1.2 COC1=CC=CN=C1 NO22348 [2,0,0,0,0,0|2,0,0]=4 419 B8R1.2 COC1=CC=NC=C1 NO19206 [2,0,0,0,0,0|2,0,0]=4 420 B8R1.2 COC1=CC=[C-]C=C1 DY747109 [2,0,0,0,0,0|1,0,1]=4 421 B8R1.2 COC1=NC=CC=C1 NO18780 [2,0,0,0,0,0|2,0,0]=4 422 B8R1.2 ClCC1=CC=CN=C1 NO19291 [2,0,0,0,0,0|2,0,0]=4 423 B8R1.2 ClCC1=NC=CC=C1 NO19289 [2,0,0,0,0,0|2,0,0]=4 424 B8R1.2 ClSC1=CC=CC=C1 DY799077 [2,0,0,0,0,0|2,0,0]=4 425 B8R1.2 ICC1=CC=CC=C1 NO11000 [2,0,0,0,0,0|1,0,0]=3 426 B8R1.2 N#Cc1ccccc1 NO13696 [2,0,0,0,0,0|0,0,2]=4 427 B8R1.2 NCC1=CC=CN=C1 NO14226 [2,0,0,0,0,0|1,0,0]=3 428 B8R1.2 NCC1=CC=NC=C1 NO11906 [2,0,0,0,0,0|1,0,0]=3 429 B8R1.2 NCC1=CC=NC=C1 NO19023 [2,0,0,0,0,0|1,0,0]=3 430 B8R1.2 NCC1=CN=NC=C1 NO15014 [2,0,0,0,0,0|2,0,0]=4 431 B8R1.2 NCC1=CN=NC=C1 NO15515 [2,0,0,0,0,0|2,0,0]=4 432 B8R1.2 NCC1=NC=CC=C1 DY663911 [2,0,0,0,0,0|1,0,0]=3 433 B8R1.2 NCC1=NC=CC=N1 NO21304 [2,0,0,0,0,0|2,0,0]=4 434 B8R1.2 NCC1=NC=CN=C1 DY710323 [2,0,0,0,0,0|2,0,0]=4 435 B8R1.2 NCC1=NC=CN=C1 NO19691 [2,0,0,0,0,0|2,0,0]=4 436 B8R1.2 NCC1=NC=CN=C1 NO20245 [2,0,0,0,0,0|2,0,0]=4 437 B8R1.2 NNC1=CC=CC=C1 NO15210 [2,0,0,0,0,0|1,0,0]=3 438 B8R1.2 NNC1=CC=CN=C1 NO15491 [2,0,0,0,0,0|2,0,0]=4 439 B8R1.2 NNC1=CC=CN=C1 NO22308 [2,0,0,0,0,0|2,0,0]=4 440 B8R1.2 NNC1=CC=NC=C1 DY20777 [2,0,0,0,0,0|2,0,0]=4 441 B8R1.2 NNC1=NC=CC=C1 NO15589 [2,0,0,0,0,0|2,0,0]=4 442 B8R1.2 NNC1=NC=CC=C1 NO21573 [2,0,0,0,0,0|2,0,0]=4 443 B8R1.2 OCC1=CC=CN=C1 NO22409 [2,0,0,0,0,0|2,0,0]=4 444 B8R1.2 OCC1=CC=NC=C1 NO19163 [2,0,0,0,0,0|2,0,0]=4 445 B8R1.2 OCC1=NC=CC=C1 NO19164 [2,0,0,0,0,0|2,0,0]=4 446 B8R1.4 BrC1=CC(I)=CC=C1 DY433479 [2,0,0,0,0,0|1,1,0]=4 447 B8R1.4 BrC1=CC=CC(Br)=C1 NO19814 [2,0,0,0,0,0|1,1,0]=4 448 B8R1.4 CC1=CC(Cl)=NC=C1 NO23009 [2,0,0,0,0,0|1,0,0]=3 449 B8R1.4 CC1=CC(Cl)=NC=N1 NO22963 [2,0,0,0,0,0|2,0,0]=4 450 B8R1.4 CC1=CC(F)=NC=C1 NO21868 [2,0,0,0,0,0|1,1,0]=4 451 B8R1.4 CC1=CC(N)=NC=C1 NO15630 [2,0,0,0,0,0|2,0,0]=4 452 B8R1.4 CC1=CC(O)=NC=C1 NO23034 [2,0,0,0,0,0|2,0,0]=4 453 B8R1.4 CC1=CC=CC(Br)=C1 NO19957 [2,0,0,0,0,0|0,1,0]=3 454 B8R1.4 CC1=CC=CC(Br)=N1 NO21841 [2,0,0,0,0,0|1,1,0]=4 455 B8R1.4 CC1=CC=CC(C)=N1 NO18597 [2,0,0,0,0,0|2,0,0]=4 456 B8R1.4 CC1=CC=CC(Cl)=N1 NO23010 [2,0,0,0,0,0|1,0,0]=3 457 B8R1.4 CC1=CC=CC(F)=C1 NO19910 [2,0,0,0,0,0|0,1,0]=3 458 B8R1.4 CC1=CC=CC(F)=N1 NO19330 [2,0,0,0,0,0|1,1,0]=4 459 B8R1.4 CC1=CC=CC(I)=C1 NO19968 [2,0,0,0,0,0|0,1,0]=3 460 B8R1.4 CC1=CC=CC(N)=C1 NO11698 [2,0,0,0,0,0|1,0,0]=3 461 B8R1.4 CC1=CC=CC(N)=N1 NO18078 [2,0,0,0,0,0|2,0,0]=4 462 B8R1.4 CC1=CN=CC(C)=C1 DY714404 [2,0,0,0,0,0|2,0,0]=4 463 B8R1.4 CC1=CN=CC(Cl)=C1 NO13884 [2,0,0,0,0,0|1,0,0]=3 464 B8R1.4 CC1=CN=CC(Cl)=N1 NO21486 [2,0,0,0,0,0|2,0,0]=4 465 B8R1.4 CC1=CN=CC(F)=C1 NO19335 [2,0,0,0,0,0|1,1,0]=4 466 B8R1.4 CC1=CN=CC(N)=C1 NO14172 [2,0,0,0,0,0|2,0,0]=4 467 B8R1.4 CC1=CN=CC(O)=C1 NO14332 [2,0,0,0,0,0|2,0,0]=4 468 B8R1.4 CC1=NC(Cl)=NC=C1 NO13591 [2,0,0,0,0,0|2,0,0]=4 469 B8R1.4 CC1=NC=CC(Br)=C1 DY658195 [2,0,0,0,0,0|1,1,0]=4 470 B8R1.4 CC1=NC=CC(Br)=C1 NO13967 [2,0,0,0,0,0|1,1,0]=4 471 B8R1.4 CC1=NC=CC(Cl)=C1 NO14214 [2,0,0,0,0,0|1,0,0]=3 472 B8R1.4 CC1=NC=CC(Cl)=N1 DY694223 [2,0,0,0,0,0|2,0,0]=4 473 B8R1.4 CC1=NC=CC(Cl)=N1 NO22751 [2,0,0,0,0,0|2,0,0]=4 474 B8R1.4 CC1=NC=CC(F)=C1 NO15882 [2,0,0,0,0,0|1,1,0]=4 475 B8R1.4 CC1=NC=CC(I)=C1 NO22899 [2,0,0,0,0,0|1,1,0]=4 476 B8R1.4 CC1=NC=CC(N)=C1 NO19520 [2,0,0,0,0,0|2,0,0]=4 477 B8R1.4 CC1=NC=CC(O)=C1 NO22867 [2,0,0,0,0,0|2,0,0]=4 478 B8R1.4 ClC1=CC(Br)=NC=C1 NO13973 [2,0,0,0,0,0|2,0,0]=4 479 B8R1.4 ClC1=CC(Cl)=NC=C1 NO17291 [2,0,0,0,0,0|2,0,0]=4 480 B8R1.4 ClC1=CC(I)=CC=C1 NO20663 [2,0,0,0,0,0|1,0,0]=3 481 B8R1.4 ClC1=CC=CC(Br)=C1 NO22170 [2,0,0,0,0,0|1,0,0]=3 482 B8R1.4 ClC1=CC=CC(Br)=N1 NO14668 [2,0,0,0,0,0|2,0,0]=4 483 B8R1.4 ClC1=CC=CC(Cl)=N1 NO18899 [2,0,0,0,0,0|2,0,0]=4 484 B8R1.4 ClC1=CN=CC(Br)=C1 NO15808 [2,0,0,0,0,0|2,0,0]=4 485 B8R1.4 ClC1=CN=CC(Cl)=C1 NO14008 [2,0,0,0,0,0|2,0,0]=4 486 B8R1.4 ClC1=NC=CC(Br)=C1 NO21986 [2,0,0,0,0,0|2,0,0]=4 487 B8R1.4 ClC1=NC=CC(I)=C1 NO22695 [2,0,0,0,0,0|2,0,0]=4 488 B8R1.4 FC1=CC(Cl)=NC=C1 NO17300 [2,0,0,0,0,0|2,0,0]=4 489 B8R1.4 FC1=CC(I)=CC=C1 NO18882 [2,0,0,0,0,0|1,1,0]=4 490 B8R1.4 FC1=CC=CC(Cl)=N1 NO18859 [2,0,0,0,0,0|2,0,0]=4 491 B8R1.4 FC1=CC=CC(S)=C1 DY20298 [2,0,0,0,0,0|1,1,0]=4 492 B8R1.4 FC1=CN=CC(Cl)=C1 NO19936 [2,0,0,0,0,0|2,0,0]=4 493 B8R1.4 FC1=NC=CC(Cl)=C1 NO14178 [2,0,0,0,0,0|2,0,0]=4 494 B8R1.4 IC1=CC=CC(I)=C1 DY433521 [2,0,0,0,0,0|1,1,0]=4 495 B8R1.4 NC1=CC(Br)=CC=C1 NO19169 [2,0,0,0,0,0|0,1,0]=3 496 B8R1.4 NC1=CC(Br)=CN=C1 NO22730 [2,0,0,0,0,0|1,1,0]=4 497 B8R1.4 NC1=CC(Br)=NC=C1 NO21962 [2,0,0,0,0,0|1,1,0]=4 498 B8R1.4 NC1=CC(Cl)=CC=C1 NO22234 [2,0,0,0,0,0|0,0,0]=2 499 B8R1.4 NC1=CC(Cl)=CN=C1 DY31090 [2,0,0,0,0,0|1,0,0]=3 500 B8R1.4 NC1=CC(Cl)=NC=C1 NO21964 [2,0,0,0,0,0|1,0,0]=3 501 B8R1.4 NC1=CC(F)=CC=C1 NO19913 [2,0,0,0,0,0|0,1,0]=3 502 B8R1.4 NC1=CC(F)=CN=C1 NO13934 [2,0,0,0,0,0|1,1,0]=4 503 B8R1.4 NC1=CC(I)=CC=C1 NO19215 [2,0,0,0,0,0|0,1,0]=3 504 B8R1.4 NC1=CC(N)=NC=C1 NO11909 [2,0,0,0,0,0|2,0,0]=4 505 B8R1.4 NC1=CC(O)=NC=C1 NO18280 [2,0,0,0,0,0|2,0,0]=4 506 B8R1.4 NC1=CC=CC(=O)N1 NO22760 [2,0,0,0,0,0|2,0,0]=4 507 B8R1.4 NC1=CC=CC(N)=N1 NO13686 [2,0,0,0,0,0|2,0,0]=4 508 B8R1.4 NC1=CN=CC(N)=C1 NO21958 [2,0,0,0,0,0|2,0,0]=4 509 B8R1.4 NC1=CN=CC(O)=C1 NO12372 [2,0,0,0,0,0|2,0,0]=4 510 B8R1.4 NC1=CN=CC(O)=C1 NO22080 [2,0,0,0,0,0|2,0,0]=4 511 B8R1.4 NC1=CN=NC(Cl)=C1 NO13017 [2,0,0,0,0,0|2,0,0]=4 512 B8R1.4 NC1=NC(Br)=CC=C1 NO17641 [2,0,0,0,0,0|1,1,0]=4 513 B8R1.4 NC1=NC(Cl)=CC=C1 NO17675 [2,0,0,0,0,0|1,0,0]=3 514 B8R1.4 NC1=NC(Cl)=CN=C1 DY20457 [2,0,0,0,0,0|2,0,0]=4 515 B8R1.4 NC1=NC(F)=CC=C1 NO17727 [2,0,0,0,0,0|1,1,0]=4 516 B8R1.4 NC1=NC=CC(Br)=C1 NO16114 [2,0,0,0,0,0|1,1,0]=4 517 B8R1.4 NC1=NC=CC(Cl)=C1 NO17669 [2,0,0,0,0,0|1,0,0]=3 518 B8R1.4 NC1=NC=CC(Cl)=N1 NO15619 [2,0,0,0,0,0|2,0,0]=4 519 B8R1.4 NC1=NC=CC(F)=C1 NO21251 [2,0,0,0,0,0|1,1,0]=4 520 B8R1.4 NC1=NC=CC(O)=C1 NO14161 [2,0,0,0,0,0|2,0,0]=4 521 B8R1.4 NC1=NC=NC(Cl)=C1 NO15652 [2,0,0,0,0,0|2,0,0]=4 522 B8R1.4 O=C1C=CC=C(Cl)N1 NO10672 [2,0,0,0,0,0|2,0,0]=4 523 B8R1.4 OC1=CC(Br)=CC=C1 NO15169 [2,0,0,0,0,0|1,1,0]=4 524 B8R1.4 OC1=CC(Cl)=NC=C1 NO22712 [2,0,0,0,0,0|2,0,0]=4 525 B8R1.4 OC1=CC(F)=CC=C1 NO19021 [2,0,0,0,0,0|1,1,0]=4 526 B8R1.4 OC1=CC(I)=CC=C1 NO19969 [2,0,0,0,0,0|1,1,0]=4 527 B8R1.4 OC1=NC=CC(Cl)=C1 NO18294 [2,0,0,0,0,0|2,0,0]=4 528 B8R1.4 SC1=CC(Br)=CC=C1 DY564537 [2,0,0,0,0,0|1,1,0]=4 529 B8R1.4 SC1=CC(Cl)=NC=C1 DY712051 [2,0,0,0,0,0|2,0,0]=4 530 B8R1.4 [O-][N+]1=CC(Cl)=CC=C1 DY442468 [2,0,0,0,0,0|2,0,0]=4 531 B10R1.2 CC1=C(Br)C=CC=C1CBr DY584771 [1,1,0,0,0,0|1,1,0]=4 532 B10R1.2 CC1=C(CBr)C=CC=C1I DY584958 [1,1,0,0,0,0|1,1,0]=4 533 B10R1.2 CC1=C(CN)C=CC=C1Br DY769683 [1,1,0,0,0,0|0,1,0]=3 534 B10R1.2 CC1=C(CO)C=CC=C1Cl DY452962 [1,1,0,0,0,0|1,0,0]=3 535 B10R1.2 CC1=C(CO)C=CC=C1I DY584812 [1,1,0,0,0,0|1,1,0]=4 536 B10R1.2 CC1=C(CO)C=CC=C1N DY584258 [1,1,0,0,0,0|2,0,0]=4 537 B10R1.2 CC1=CC=CC(CBr)=C1Br DY584774 [1,1,0,0,0,0|2,0,0]=4 538 B10R1.2 CC1=CC=CC(CBr)=C1C NO10894 [1,1,0,0,0,0|2,0,0]=4 539 B10R1.2 CC1=CC=CC(CN)=C1Cl DY584892 [1,1,0,0,0,0|1,0,0]=3 540 B10R1.2 CC1=CC=CC(CN)=C1F DY585032 [1,1,0,0,0,0|1,0,0]=3 541 B10R1.2 CC1=CC=CC(CO)=C1C NO20113 [1,1,0,0,0,0|2,0,0]=4 542 B10R1.2 CC1=CC=CC(CO)=C1F DY451600 [1,1,0,0,0,0|2,0,0]=4 543 B10R1.2 CCC1=C(F)C(Cl)=NC=N1 NO23008 [1,1,0,0,0,0|2,0,0]=4 544 B10R1.2 CCC1=C(O)C(C)=CC=C1 DY584282 [1,1,0,0,0,0|1,0,0]=3 545 B10R1.2 COC1=C(Br)C(C)=CC=C1 DY584924 [1,1,0,0,0,0|2,0,0]=4 546 B10R1.2 COC1=C(Br)C(Cl)=NC=C1 NO17952 [1,1,0,0,0,0|2,0,0]=4 547 B10R1.2 COC1=C(C)C(C)=CC=C1 DY20206 [1,1,0,0,0,0|2,0,0]=4 548 B10R1.2 COC1=C(Cl)C(C)=CC=C1 DY822113 [1,1,0,0,0,0|2,0,0]=4 549 B10R1.2 COC1=C(Cl)C(Cl)=NC=C1 DY503313 [1,1,0,0,0,0|2,0,0]=4 550 B10R1.2 COC1=C(F)C(Br)=CC=C1 DY20208 [1,1,0,0,0,0|1,1,0]=4 551 B10R1.2 COC1=C(F)C(Cl)=CC=C1 DY450850 [1,1,0,0,0,0|1,0,0]=3 552 B10R1.2 COC1=C(N)C(N)=CC=C1 NO12559 [1,1,0,0,0,0|2,0,0]=4 553 B10R1.2 COC1=CC=CC(Br)=C1C DY442371 [1,1,0,0,0,0|1,1,0]=4 554 B10R1.2 COC1=CC=CC(Br)=C1I NO14393 [1,1,0,0,0,0|1,1,0]=4 555 B10R1.2 COC1=CC=CC(Br)=C1O DY442834 [1,1,0,0,0,0|1,1,0]=4 556 B10R1.2 COC1=CC=CC(Cl)=C1N NO16113 [1,1,0,0,0,0|1,0,0]=3 557 B10R1.2 COC1=CC=CC(N)=C1Br NO21335 [1,1,0,0,0,0|2,0,0]=4 558 B10R1.2 COC1=CC=CC(N)=C1C NO10556 [1,1,0,0,0,0|2,0,0]=4 559 B10R1.2 COC1=CC=CC(N)=C1Cl NO18618 [1,1,0,0,0,0|2,0,0]=4 560 B10R1.2 COC1=CC=CC(N)=C1F NO12736 [1,1,0,0,0,0|2,0,0]=4 561 B10R1.2 COC1=CC=CC(N)=C1O NO17187 [1,1,0,0,0,0|2,0,0]=4 562 B10R1.2 COC1=CC=CC(O)=C1Cl NO21434 [1,1,0,0,0,0|2,0,0]=4 563 B10R1.2 COC1=CC=CC(O)=C1N NO16742 [1,1,0,0,0,0|2,0,0]=4 564 B10R1.2 CSC1=C(C)C(Cl)=CC=C1 DY20573 [1,1,0,0,0,0|1,0,0]=3 565 B10R1.2 CSC1=C(F)C(Br)=CC=C1 DY451930 [1,1,0,0,0,0|1,1,0]=4 566 B10R1.2 CSC1=C(F)C(Cl)=NC=C1 DY450214 [1,1,0,0,0,0|2,0,0]=4 567 B10R1.2 CSC1=CC=CC(O)=C1F DY451822 [1,1,0,0,0,0|2,0,0]=4 568 B10R1.2 ClC1=C(CBr)C=CC=C1Br DY585014 [1,1,0,0,0,0|1,1,0]=4 569 B10R1.2 ClC1=CC=CC(CBr)=C1Cl NO19151 [1,1,0,0,0,0|1,0,0]=3 570 B10R1.2 FC1=C(CBr)C=CC=C1Cl NO19361 [1,1,0,0,0,0|1,0,0]=3 571 B10R1.2 FC1=C(Cl)C=CC=C1CCl DY584895 [1,1,0,0,0,0|1,0,0]=3 572 B10R1.2 FC1=CC=CC(CBr)=C1Cl NO19380 [1,1,0,0,0,0|1,1,0]=4 573 B10R1.2 FC1=CC=CC(CBr)=C1F NO18619 [1,1,0,0,0,0|1,1,0]=4 574 B10R1.2 N#CC1=C(Br)C(Cl)=CC=C1 DY744739 [1,1,0,0,0,0|0,0,2]=4 575 B10R1.2 N#CC1=C(Cl)C(Cl)=CC=C1 NO19663 [1,1,0,0,0,0|0,0,2]=4 576 B10R1.2 N#CC1=C(N)C(Cl)=CC=C1 NO10337 [1,1,0,0,0,0|0,0,2]=4 577 B10R1.2 NC1=C(CO)C=CC=C1Br DY552981 [1,1,0,0,0,0|1,1,0]=4 578 B10R1.2 NC1=C(CO)C=CC=C1Cl NO14362 [1,1,0,0,0,0|1,0,0]=3 579 B10R1.2 NC1=CC=CC(CO)=C1Cl DY586503 [1,1,0,0,0,0|2,0,0]=4 580 B10R1.2 NC1=CC=CC(CO)=C1F NO12522 [1,1,0,0,0,0|2,0,0]=4 581 B10R1.2 NCC1=C(Br)C(F)=CC=C1 DY686413 [1,1,0,0,0,0|0,1,0]=3 582 B10R1.2 NCC1=C(F)C(Cl)=CC=C1 DY33194 [1,1,0,0,0,0|0,0,0]=2 583 B10R1.2 NNC1=C(Br)C(Cl)=CC=C1 DY584586 [1,1,0,0,0,0|1,0,0]=3 584 B10R1.2 NNC1=C(Cl)C(Cl)=CC=C1 DY541383 [1,1,0,0,0,0|1,0,0]=3 585 B10R1.2 O=CC1=C(Br)C(Cl)=CC=C1 NO13248 [1,1,0,0,0,0|1,0,1]=4 586 B10R1.2 O=CC1=C(Cl)C(Cl)=CC=C1 NO13389 [1,1,0,0,0,0|1,0,1]=4 587 B10R1.2 O=CC1=C(F)C(Cl)=CC=C1 NO10263 [1,1,0,0,0,0|1,0,1]=4 588 B10R1.2 O=CC1=C(O)C(Cl)=CC=C1 DY20676 [1,1,0,0,0,0|1,0,1]=4 589 B10R1.8 CC1=CC(C#N)=CC(Cl)=C1 DY584883 [1,1,0,0,0,0|0,0,2]=4 590 B10R1.8 CC1=CC(C)=CC(CBr)=C1 NO18923 [1,1,0,0,0,0|2,0,0]=4 591 B10R1.8 CC1=CC(C)=CC(NN)=C1 NO10557 [1,1,0,0,0,0|2,0,0]=4 592 B10R1.8 CC1=CC(C=O)=CC(Cl)=C1 DY20818 [1,1,0,0,0,0|1,0,1]=4 593 B10R1.8 CC1=CC(CBr)=CC(Br)=C1 DY584778 [1,1,0,0,0,0|1,1,0]=4 594 B10R1.8 CC1=CC(CO)=CC(Cl)=C1 DY451882 [1,1,0,0,0,0|1,0,0]=3 595 B10R1.8 CC1=CC(CO)=CC(I)=C1 DY747043 [1,1,0,0,0,0|1,1,0]=4 596 B10R1.8 CCC1=CC(Cl)=NC(Cl)=N1 DY692644 [1,1,0,0,0,0|2,0,0]=4 597 B10R1.8 CCC1=CC(Cl)=NC(N)=N1 NO22775 [1,1,0,0,0,0|2,0,0]=4 598 B10R1.8 CCC1=CC(F)=CC(F)=C1 NO20675 [1,1,0,0,0,0|0,1,0]=3 599 B10R1.8 CCC1=CC(N)=CC(Br)=C1 NO12529 [1,1,0,0,0,0|0,1,0]=3 600 B10R1.8 CCC1=NC(Cl)=CC(Cl)=N1 NO17845 [1,1,0,0,0,0|2,0,0]=4 601 B10R1.8 CCC1=NC(Cl)=CC(N)=N1 NO19692 [1,1,0,0,0,0|2,0,0]=4 602 B10R1.8 CCC1=NC(Cl)=NC(C)=C1 DY693334 [1,1,0,0,0,0|2,0,0]=4 603 B10R1.8 COC1=CC(Br)=CC(Br)=C1 NO10386 [1,1,0,0,0,0|1,1,0]=4 604 B10R1.8 COC1=CC(Br)=CC(Cl)=C1 NO12661 [1,1,0,0,0,0|1,0,0]=3 605 B10R1.8 COC1=CC(Br)=CC(Cl)=N1 NO17141 [1,1,0,0,0,0|2,0,0]=4 606 B10R1.8 COC1=CC(Br)=CC(F)=C1 NO10395 [1,1,0,0,0,0|1,1,0]=4 607 B10R1.8 COC1=CC(C)=CC(Br)=C1 NO20982 [1,1,0,0,0,0|1,1,0]=4 608 B10R1.8 COC1=CC(C)=CC(N)=C1 NO13172 [1,1,0,0,0,0|2,0,0]=4 609 B10R1.8 COC1=CC(Cl)=CC(Cl)=C1 DY20180 [1,1,0,0,0,0|1,0,0]=3 610 B10R1.8 COC1=CC(Cl)=CC(N)=N1 NO17883 [1,1,0,0,0,0|2,0,0]=4 611 B10R1.8 COC1=CC(Cl)=NC(C)=C1 DY512931 [1,1,0,0,0,0|2,0,0]=4 612 B10R1.8 COC1=CC(Cl)=NC(Cl)=C1 NO13167 [1,1,0,0,0,0|2,0,0]=4 613 B10R1.8 COC1=CC(F)=CC(F)=C1 DY20076 [1,1,0,0,0,0|1,1,0]=4 614 B10R1.8 COC1=CC(N)=CC(Br)=C1 DY40874 [1,1,0,0,0,0|1,1,0]=4 615 B10R1.8 COC1=CC(N)=CC(F)=C1 NO12734 [1,1,0,0,0,0|1,1,0]=4 616 B10R1.8 COC1=CC(N)=CC(N)=C1 DY686929 [1,1,0,0,0,0|2,0,0]=4 617 B10R1.8 COC1=CC(N)=NC(Cl)=C1 NO17149 [1,1,0,0,0,0|2,0,0]=4 618 B10R1.8 COC1=CC(O)=CC(Cl)=C1 NO22226 [1,1,0,0,0,0|1,0,0]=3 619 B10R1.8 COC1=CC(O)=CC(F)=C1 NO14749 [1,1,0,0,0,0|1,1,0]=4 620 B10R1.8 COC1=CC(O)=CC(I)=C1 DY430212 [1,1,0,0,0,0|1,1,0]=4 621 B10R1.8 COC1=CC(O)=CC(O)=C1 DY541089 [1,1,0,0,0,0|2,0,0]=4 622 B10R1.8 COC1=NC(C)=CC(Cl)=C1 DY658371 [1,1,0,0,0,0|2,0,0]=4 623 B10R1.8 ClC1=CC(CBr)=CC(Cl)=N1 NO22458 [1,1,0,0,0,0|2,0,0]=4 624 B10R1.8 ClCC1=CC(Cl)=CC(Br)=N1 DY655113 [1,1,0,0,0,0|2,0,0]=4 625 B10R1.8 FC1=CC(CBr)=CC(Cl)=C1 DY40531 [1,1,0,0,0,0|1,0,0]=3 626 B10R1.8 FC1=CC(F)=CC(CBr)=C1 NO18723 [1,1,0,0,0,0|1,1,0]=4 627 B10R1.8 FC1=CC(F)=CC(CCl)=C1 DY584373 [1,1,0,0,0,0|1,1,0]=4 628 B10R1.8 N#CC1=CC(Cl)=CC(I)=C1 DY433755 [1,1,0,0,0,0|0,0,2]=4 629 B10R1.8 NC1=NC(Cl)=CC(CO)=C1 DY518205 [1,1,0,0,0,0|2,0,0]=4 630 B10R1.8 NCC1=CC(Cl)=CC(Cl)=C1 NO19043 [1,1,0,0,0,0|0,0,0]=2 631 B10R1.8 NCC1=CC(Cl)=CC(F)=C1 DY33218 [1,1,0,0,0,0|0,0,0]=2 632 B10R1.8 NCC1=CC(Cl)=NC(Cl)=C1 NO21172 [1,1,0,0,0,0|1,0,0]=3 633 B10R1.8 NCC1=NC(Cl)=CC(Br)=C1 DY431845 [1,1,0,0,0,0|1,0,0]=3 634 B10R1.8 NNC1=CC(Cl)=CC(Cl)=C1 NO19276 [1,1,0,0,0,0|1,0,0]=3 635 B10R1.8 NNC1=CC(F)=CC(F)=C1 DY40995 [1,1,0,0,0,0|1,1,0]=4 636 B10R1.8 O=CC1=CC(Br)=CC(Cl)=C1 NO19822 [1,1,0,0,0,0|1,0,1]=4 637 B10R1.8 O=CC1=CC(Cl)=CC(Cl)=C1 DY20139 [1,1,0,0,0,0|1,0,1]=4 638 B10R1.8 O=CC1=CC(Cl)=CC(F)=C1 NO19946 [1,1,0,0,0,0|1,0,1]=4 639 B10R1.8 O=CC1=CC(Cl)=CC(O)=C1 NO22223 [1,1,0,0,0,0|1,0,1]=4 640 B10R1.8 OCC1=CC(Br)=CC(F)=C1 NO22159 [1,1,0,0,0,0|1,1,0]=4 641 B10R1.8 OCC1=CC(Br)=CC(I)=C1 DY107686 [1,1,0,0,0,0|1,1,0]=4 642 B10R1.8 OCC1=CC(Cl)=CC(Cl)=C1 NO20191 [1,1,0,0,0,0|1,0,0]=3 643 B10R1.30 BrCC1=C(Br)C=CC(I)=C1 DY584787 [1,1,0,0,0,0|1,1,0]=4 644 B10R1.30 BrCC1=C(I)C=CC(Br)=C1 DY584786 [1,1,0,0,0,0|1,1,0]=4 645 B10R1.30 CC1=C(C#N)C=C(Cl)C=C1 DY40633 [1,1,0,0,0,0|0,0,2]=4 646 B10R1.30 CC1=C(CCl)C=C(F)C=C1 DY584262 [1,1,0,0,0,0|1,1,0]=4 647 B10R1.30 CC1=C(CO)C=C(F)C=C1 DY452638 [1,1,0,0,0,0|1,1,0]=4 648 B10R1.30 CC1=CC(CBr)=C(C)C=C1 DY584839 [1,1,0,0,0,0|2,0,0]=4 649 B10R1.30 CC1=CC(CN)=C(C)C=C1 DY20405 [1,1,0,0,0,0|1,0,0]=3 650 B10R1.30 CC1=CC(CO)=C(F)C=C1 DY450466 [1,1,0,0,0,0|2,0,0]=4 651 B10R1.30 CC1=CC(NN)=C(C)C=C1 NO20501 [1,1,0,0,0,0|2,0,0]=4 652 B10R1.30 CC1=NC=C(Br)C=C1CN DY656602 [1,1,0,0,0,0|1,1,0]=4 653 B10R1.30 CCC1=NC(C)=CC=C1O NO13984 [1,1,0,0,0,0|2,0,0]=4 654 B10R1.30 CCC1=NC(Cl)=NC=C1C DY606669 [1,1,0,0,0,0|2,0,0]=4 655 B10R1.30 CNC1=CC(Br)=CC=C1N NO13254 [1,1,0,0,0,0|1,1,0]=4 656 B10R1.30 COC1=C(Br)C=CC(Br)=C1 NO12737 [1,1,0,0,0,0|1,1,0]=4 657 B10R1.30 COC1=C(Br)C=CC(C)=C1 DY20209 [1,1,0,0,0,0|2,0,0]=4 658 B10R1.30 COC1=C(Br)C=CC(Cl)=C1 NO21371 [1,1,0,0,0,0|1,0,0]=3 659 B10R1.30 COC1=C(Br)C=CC(F)=C1 NO10394 [1,1,0,0,0,0|1,1,0]=4 660 B10R1.30 COC1=C(Br)C=CC(N)=C1 NO18102 [1,1,0,0,0,0|2,0,0]=4 661 B10R1.30 COC1=C(Cl)C=CC(C)=C1 DY456622 [1,1,0,0,0,0|2,0,0]=4 662 B10R1.30 COC1=C(Cl)C=CC(I)=C1 DY20290 [1,1,0,0,0,0|1,1,0]=4 663 B10R1.30 COC1=C(Cl)C=CC(N)=C1 NO22759 [1,1,0,0,0,0|2,0,0]=4 664 B10R1.30 COC1=C(F)C=CC(Br)=C1 NO19804 [1,1,0,0,0,0|1,1,0]=4 665 B10R1.30 COC1=C(F)C=CC(I)=C1 DY571347 [1,1,0,0,0,0|1,1,0]=4 666 B10R1.30 COC1=C(F)C=CC(N)=C1 NO10516 [1,1,0,0,0,0|2,0,0]=4 667 B10R1.30 COC1=C(I)C=CC(Cl)=C1 DY20291 [1,1,0,0,0,0|1,0,0]=3 668 B10R1.30 COC1=C(N)C=CC(Br)=C1 NO19178 [1,1,0,0,0,0|1,1,0]=4 669 B10R1.30 COC1=C(N)C=CC(F)=C1 NO12096 [1,1,0,0,0,0|1,1,0]=4 670 B10R1.30 COC1=C(N)C=CC(I)=C1 DY21014 [1,1,0,0,0,0|1,1,0]=4 671 B10R1.30 COC1=C(N)C=CC(N)=C1 NO21132 [1,1,0,0,0,0|2,0,0]=4 672 B10R1.30 COC1=C(O)C=CC(Br)=C1 NO22682 [1,1,0,0,0,0|1,1,0]=4 673 B10R1.30 COC1=C(O)C=CC(C)=C1 NO16322 [1,1,0,0,0,0|2,0,0]=4 674 B10R1.30 COC1=CC(Cl)=NC=C1Br NO14850 [1,1,0,0,0,0|2,0,0]=4 675 B10R1.30 COC1=CC(Cl)=NC=C1C DY655410 [1,1,0,0,0,0|2,0,0]=4 676 B10R1.30 COC1=CC(Cl)=NC=C1Cl NO15874 [1,1,0,0,0,0|2,0,0]=4 677 B10R1.30 COC1=NC(Cl)=CC=C1Br NO16211 [1,1,0,0,0,0|2,0,0]=4 678 B10R1.30 COC1=NC(Cl)=CC=C1N NO10669 [1,1,0,0,0,0|2,0,0]=4 679 B10R1.30 CSC1=C(Br)C=CC(Br)=C1 DY453532 [1,1,0,0,0,0|1,1,0]=4 680 B10R1.30 CSC1=C(Br)C=CC(F)=C1 DY525105 [1,1,0,0,0,0|1,1,0]=4 681 B10R1.30 CSC1=C(C)C=CC(Br)=C1 DY452878 [1,1,0,0,0,0|1,1,0]=4 682 B10R1.30 ClC1=C(CBr)C=C(I)C=C1 DY433851 [1,1,0,0,0,0|1,1,0]=4 683 B10R1.30 ClC1=CC(CBr)=C(Cl)C=C1 DY40541 [1,1,0,0,0,0|1,0,0]=3 684 B10R1.30 ClCC1=C(Cl)C=CC(Br)=C1 NO16839 [1,1,0,0,0,0|1,1,0]=4 685 B10R1.30 FC1=CC(CBr)=C(Br)C=C1 DY20074 [1,1,0,0,0,0|1,1,0]=4 686 B10R1.30 FC1=NC=C(Cl)C=C1CBr DY452554 [1,1,0,0,0,0|2,0,0]=4 687 B10R1.30 N#CC1=C(Br)C=CC(Cl)=C1 NO19784 [1,1,0,0,0,0|0,0,2]=4 688 B10R1.30 N#CC1=C(Cl)C=CC(Cl)=C1 DY33078 [1,1,0,0,0,0|0,0,2]=4 689 B10R1.30 N#CC1=C(F)C=CC(Cl)=C1 NO10190 [1,1,0,0,0,0|0,0,2]=4 690 B10R1.30 N#CC1=C(N)C=CC(Cl)=C1 NO20097 [1,1,0,0,0,0|0,0,2]=4 691 B10R1.30 NC1=C(C=O)C=C(Cl)C=C1 DY20404 [1,1,0,0,0,0|1,0,1]=4 692 B10R1.30 NC1=C(CO)C=C(Br)C=C1 NO20119 [1,1,0,0,0,0|1,1,0]=4 693 B10R1.30 NC1=CN=C(Cl)C=C1CO DY712933 [1,1,0,0,0,0|2,0,0]=4 694 B10R1.30 NCC1=C(Br)C=CC(F)=C1 DY792813 [1,1,0,0,0,0|0,1,0]=3 695 B10R1.30 NCC1=C(Cl)C=CC(Br)=C1 NO12614 [1,1,0,0,0,0|0,1,0]=3 696 B10R1.30 NCC1=C(Cl)C=CC(Cl)=C1 DY584885 [1,1,0,0,0,0|0,0,0]=2 697 B10R1.30 NCC1=C(F)C=CC(Br)=C1 DY40802 [1,1,0,0,0,0|0,1,0]=3 698 B10R1.30 NCC1=C(F)C=CC(Cl)=C1 NO20282 [1,1,0,0,0,0|0,0,0]=2 699 B10R1.30 NCC1=C(N)C=CC(Br)=C1 NO17921 [1,1,0,0,0,0|0,1,0]=3 700 B10R1.30 NCC1=C(O)C=CC(Br)=C1 NO18138 [1,1,0,0,0,0|0,1,0]=3 701 B10R1.30 NCC1=CC(Br)=NC=C1F DY650797 [1,1,0,0,0,0|1,1,0]=4 702 B10R1.30 NCC1=NC(Cl)=CC=C1Br DY651043 [1,1,0,0,0,0|1,0,0]=3 703 B10R1.30 NCC1=NC(Cl)=CC=C1Cl DY651001 [1,1,0,0,0,0|1,0,0]=3 704 B10R1.30 NNC1=C(Br)C=CC(Br)=C1 NO16988 [1,1,0,0,0,0|1,1,0]=4 705 B10R1.30 NNC1=C(Br)C=CC(F)=C1 DY40989 [1,1,0,0,0,0|1,1,0]=4 706 B10R1.30 NNC1=C(F)C=CC(F)=C1 NO23013 [1,1,0,0,0,0|1,1,0]=4 707 B10R1.30 O=CC1=C(Br)C=CC(Cl)=C1 NO18798 [1,1,0,0,0,0|1,0,1]=4 708 B10R1.30 O=CC1=C(Cl)C=CC(Cl)=C1 NO19231 [1,1,0,0,0,0|1,0,1]=4 709 B10R1.30 O=CC1=C(F)C=CC(Cl)=C1 NO10265 [1,1,0,0,0,0|1,0,1]=4 710 B10R1.30 O=CC1=C(O)C=CC(Cl)=C1 NO20107 [1,1,0,0,0,0|1,0,1]=4 711 B10R1.30 OCC1=C(Br)C=CC(F)=C1 NO13914 [1,1,0,0,0,0|1,1,0]=4 712 B10R1.30 OCC1=C(Cl)C=CC(F)=C1 NO21464 [1,1,0,0,0,0|1,1,0]=4 713 B10R1.30 OCC1=C(I)C=CC(Br)=C1 DY537399 [1,1,0,0,0,0|1,1,0]=4 714 B10R1.30 OCC1=CC(Br)=CC=C1O NO20280 [1,1,0,0,0,0|1,1,0]=4 715 B10R1.30 OCC1=CC(Cl)=CN=C1Br DY450346 [1,1,0,0,0,0|2,0,0]=4 716 B10R1.30 OCC1=CC(Cl)=NC=C1F NO19536 [1,1,0,0,0,0|2,0,0]=4 717 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 NO18865 [1,1,0,0,0,0|0,1,1]=4 718 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 NO19798 [1,1,0,0,0,0|0,0,1]=3 719 B10R1.113 CC(=O)C1=CC(F)=CC=C1 NO19067 [1,1,0,0,0,0|0,1,1]=4 720 B10R1.113 CC(=O)C1=CC(N)=CC=C1 NO19441 [1,1,0,0,0,0|1,0,1]=4 721 B10R1.113 CC(=O)C1=CC(O)=CC=C1 NO18681 [1,1,0,0,0,0|1,0,1]=4 722 B10R1.113 CC(=O)C1=CC=CC(C)=C1 NO19159 [1,1,0,0,0,0|1,0,1]=4 723 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 DY441210 [1,1,0,0,0,0|1,0,1]=4 724 B10R1.113 CC(C)C1=CC=CC(Cl)=N1 DY454324 [1,1,0,0,0,0|1,0,0]=3 725 B10R1.113 CC(C)C1=NC=CC(Br)=C1 DY579081 [1,1,0,0,0,0|1,1,0]=4 726 B10R1.113 CC(N)C1=CC(Br)=CC=C1 DY447729 [1,1,0,0,0,0|0,1,0]=3 727 B10R1.113 CC(O)C1=CC(Cl)=CC=C1 DY797607 [1,1,0,0,0,0|0,0,0]=2 728 B10R1.113 CC(O)C1=CC(N)=CC=C1 NO21787 [1,1,0,0,0,0|1,0,0]=3 729 B10R1.113 CC(O)C1=NC(Br)=CC=C1 NO14015 [1,1,0,0,0,0|1,1,0]=4 730 B10R1.113 CC1=CC(C(C)N)=NC=C1 DY561633 [1,1,0,0,0,0|2,0,0]=4 731 B10R1.113 CC1=CC(C(C)N)=NC=C1 DY605899 [1,1,0,0,0,0|2,0,0]=4 732 B10R1.113 CC1=CC([C@@H](C)N)=CC=C1 NO17345 [1,1,0,0,0,0|1,0,0]=3 733 B10R1.113 CC1=CC=CC(C(=N)N)=C1 NO20438 [1,1,0,0,0,0|1,0,1]=4 734 B10R1.113 CC1=CC=CC([C@@H](C)N)=N1 DY511947 [1,1,0,0,0,0|2,0,0]=4 735 B10R1.113 CC1=NC=CC(C(C)N)=C1 DY110560 [1,1,0,0,0,0|2,0,0]=4 736 B10R1.113 CN(C)C1=CC(N)=CC=C1 DY550845 [1,1,0,0,0,0|2,0,0]=4 737 B10R1.113 CN(C)C1=CC(N)=CC=C1 DY584521 [1,1,0,0,0,0|2,0,0]=4 738 B10R1.113 C[C@@H](N)C1=CC(F)=CC=C1 NO19312 [1,1,0,0,0,0|0,1,0]=3 739 B10R1.113 C[C@@H](N)C1=CC(F)=CN=C1 DY106300 [1,1,0,0,0,0|1,1,0]=4 740 B10R1.113 C[C@@H](N)C1=CC(F)=CN=C1 DY621603 [1,1,0,0,0,0|1,1,0]=4 741 B10R1.113 C[C@@H](N)C1=CC(F)=NC=C1 DY621477 [1,1,0,0,0,0|1,1,0]=4 742 B10R1.113 C[C@@H](N)C1=CC=CC(O)=C1 DY558015 [1,1,0,0,0,0|1,0,0]=3 743 B10R1.113 C[C@@H](N)C1=NC(F)=CC=C1 DY716816 [1,1,0,0,0,0|1,1,0]=4 744 B10R1.113 C[C@H](N)C1=CC(F)=CC=C1 NO19671 [1,1,0,0,0,0|0,1,0]=3 745 B10R1.113 C[C@H](N)C1=CC(F)=NC=C1 DY623626 [1,1,0,0,0,0|1,1,0]=4 746 B10R1.113 FC(F)C1=CC(I)=CC=C1 DY584299 [1,1,0,0,0,0|1,1,0]=4 747 B10R1.113 N=C(N)C1=CC(Cl)=CC=C1 DY746971 [1,1,0,0,0,0|0,0,1]=3 748 B10R1.113 N=C(N)C1=CC(F)=CC=C1 DY603586 [1,1,0,0,0,0|0,1,1]=4 749 B10R1.113 N=C(N)C1=NC(Cl)=CC=C1 DY712849 [1,1,0,0,0,0|1,0,1]=4 750 B10R1.113 NC(=O)C1=CC(Br)=CC=C1 NO22167 [1,1,0,0,0,0|0,1,1]=4 751 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 NO17785 [1,1,0,0,0,0|1,0,1]=4 752 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 DY20489 [1,1,0,0,0,0|1,0,1]=4 753 B10R1.113 O=C(O)C1=CC(Cl)=CC=C1 NO14882 [1,1,0,0,0,0|1,0,1]=4 754 B10R1.113 O=[N+]([O-])C1=CC=CC(Cl)=C1 NO20664 [1,1,0,0,0,0|2,0,0]=4 755 B10R1.113 OB(O)C1=CC(Cl)=CC=C1 NO22999 [1,1,0,0,0,0|2,0,0]=4 756 B10R1.172 C=CC1=CC=CC(CCl)=C1 DY822035 [1,1,0,0,0,0|0,0,2]=4 757 B10R1.172 CCC1=CC=CC(C=O)=C1 NO11688 [1,1,0,0,0,0|1,0,0]=3 758 B10R1.172 COC1=CC(CCl)=NC=C1 DY564207 [1,1,0,0,0,0|2,0,0]=4 759 B10R1.172 COC1=CC(CN)=NC=C1 NO12102 [1,1,0,0,0,0|2,0,0]=4 760 B10R1.172 COC1=CC=CC(C=O)=C1 NO19170 [1,1,0,0,0,0|2,0,0]=4 761 B10R1.172 COC1=CC=CC(CBr)=C1 DY576513 [1,1,0,0,0,0|1,1,0]=4 762 B10R1.172 COC1=CC=CC(CCl)=C1 DY10324 [1,1,0,0,0,0|1,0,0]=3 763 B10R1.172 COC1=CC=CC(CCl)=N1 NO16831 [1,1,0,0,0,0|2,0,0]=4 764 B10R1.172 COC1=CC=CC(CN)=C1 NO19097 [1,1,0,0,0,0|1,0,0]=3 765 B10R1.172 COC1=CC=CC(CO)=C1 NO19269 [1,1,0,0,0,0|2,0,0]=4 766 B10R1.172 COC1=CC=CC(NN)=C1 NO19580 [1,1,0,0,0,0|2,0,0]=4 767 B10R1.172 COC1=CC=CC(OC)=C1 NO19845 [1,1,0,0,0,0|2,0,0]=4 768 B10R1.172 COC1=NC=CC(CN)=C1 NO16830 [1,1,0,0,0,0|2,0,0]=4 769 B10R1.172 ClCC1=CC=CC(CCl)=C1 DY20408 [1,1,0,0,0,0|1,0,0]=3 770 B10R1.172 ClCC1=CC=CC(CCl)=N1 DY10384 [1,1,0,0,0,0|2,0,0]=4 771 B10R1.172 N#CC1=CC(CO)=CC=C1 NO22259 [1,1,0,0,0,0|2,0,0]=4 772 B10R1.172 N#CC1=CC(NN)=CC=C1 NO18806 [1,1,0,0,0,0|2,0,0]=4 773 B10R1.172 N#CC1=CC=CC(NN)=C1 DY20412 [1,1,0,0,0,0|2,0,0]=4 774 B10R1.172 N#CC1=NC(CN)=CC=C1 DY660549 [1,1,0,0,0,0|2,0,0]=4 775 B10R1.172 N#CC1=NC=CC(CN)=C1 DY657864 [1,1,0,0,0,0|2,0,0]=4 776 B10R1.172 NCC1=CC(C=O)=CN=C1 DY33471 [1,1,0,0,0,0|2,0,0]=4 777 B10R1.172 NCC1=CC=CC(CN)=N1 DY550317 [1,1,0,0,0,0|2,0,0]=4 778 B10R1.172 OCC1=CC(CBr)=CC=C1 NO10867 [1,1,0,0,0,0|1,1,0]=4 779 B10R1.176 CC1=C(Br)C=C(CBr)C=C1 NO16721 [1,1,0,0,0,0|1,1,0]=4 780 B10R1.176 CC1=C(Br)C=CC(CN)=C1 DY525519 [1,1,0,0,0,0|1,0,0]=3 781 B10R1.176 CC1=C(Br)N=CC(CN)=C1 DY651722 [1,1,0,0,0,0|2,0,0]=4 782 B10R1.176 CC1=C(C)C=C(CO)C=C1 DY40706 [1,1,0,0,0,0|2,0,0]=4 783 B10R1.176 CC1=C(C)C=C(NN)C=C1 NO20502 [1,1,0,0,0,0|2,0,0]=4 784 B10R1.176 CC1=C(C)N=C(CN)C=C1 DY651451 [1,1,0,0,0,0|2,0,0]=4 785 B10R1.176 CC1=C(F)C=C(NN)C=C1 NO22289 [1,1,0,0,0,0|1,1,0]=4 786 B10R1.176 CC1=C(O)C=CC(CN)=C1 DY445599 [1,1,0,0,0,0|1,0,0]=3 787 B10R1.176 CCC1=CC(C)=C(I)C=C1 DY575811 [1,1,0,0,0,0|1,0,0]=3 788 B10R1.176 CCC1=CC(O)=C(Cl)C=C1 DY432619 [1,1,0,0,0,0|1,0,0]=3 789 B10R1.176 CCC1=CC(O)=C(N)C=C1 NO16266 [1,1,0,0,0,0|1,0,0]=3 790 B10R1.176 CN1C=C(CN)C=CC1=O DY103927 [1,1,0,0,0,0|2,0,0]=4 791 B10R1.176 CNC1=CC(F)=C(Br)C=C1 DY584691 [1,1,0,0,0,0|1,1,0]=4 792 B10R1.176 CNC1=CC(F)=C(F)C=C1 DY686725 [1,1,0,0,0,0|1,1,0]=4 793 B10R1.176 COC1=CC(Br)=C(Br)C=C1 DY442365 [1,1,0,0,0,0|1,1,0]=4 794 B10R1.176 COC1=CC(Br)=C(C)C=C1 NO16376 [1,1,0,0,0,0|1,1,0]=4 795 B10R1.176 COC1=CC(Br)=C(F)C=C1 NO15238 [1,1,0,0,0,0|1,1,0]=4 796 B10R1.176 COC1=CC(Br)=C(N)C=C1 NO21359 [1,1,0,0,0,0|1,1,0]=4 797 B10R1.176 COC1=CC(C)=C(N)C=C1 NO13421 [1,1,0,0,0,0|2,0,0]=4 798 B10R1.176 COC1=CC(C)=C(O)C=C1 NO15470 [1,1,0,0,0,0|2,0,0]=4 799 B10R1.176 COC1=CC(Cl)=C(Br)C=C1 NO14601 [1,1,0,0,0,0|1,0,0]=3 800 B10R1.176 COC1=CC(Cl)=C(N)C=C1 NO14656 [1,1,0,0,0,0|1,0,0]=3 801 B10R1.176 COC1=CC(Cl)=C(O)C=C1 NO20293 [1,1,0,0,0,0|1,0,0]=3 802 B10R1.176 COC1=CC(F)=C(Br)C=C1 DY460476 [1,1,0,0,0,0|1,1,0]=4 803 B10R1.176 COC1=CC(F)=C(Br)C=C1 NO10396 [1,1,0,0,0,0|1,1,0]=4 804 B10R1.176 COC1=CC(F)=C(C)C=C1 NO10872 [1,1,0,0,0,0|1,1,0]=4 805 B10R1.176 COC1=CC(I)=C(N)C=C1 DY20577 [1,1,0,0,0,0|1,1,0]=4 806 B10R1.176 COC1=CC(N)=C(Br)C=C1 NO18386 [1,1,0,0,0,0|2,0,0]=4 807 B10R1.176 COC1=CC(N)=C(C)C=C1 NO14868 [1,1,0,0,0,0|2,0,0]=4 808 B10R1.176 COC1=CC(N)=C(Cl)C=C1 NO13990 [1,1,0,0,0,0|2,0,0]=4 809 B10R1.176 COC1=CC(N)=C(F)C=C1 NO12726 [1,1,0,0,0,0|2,0,0]=4 810 B10R1.176 COC1=CC(N)=C(I)C=C1 NO15023 [1,1,0,0,0,0|2,0,0]=4 811 B10R1.176 COC1=CC(N)=C(O)C=C1 NO21254 [1,1,0,0,0,0|2,0,0]=4 812 B10R1.176 COC1=CC(O)=C(Br)C=C1 NO21376 [1,1,0,0,0,0|2,0,0]=4 813 B10R1.176 COC1=CC(O)=C(Cl)C=C1 DY442395 [1,1,0,0,0,0|2,0,0]=4 814 B10R1.176 COC1=CC(O)=C(N)C=C1 NO21584 [1,1,0,0,0,0|2,0,0]=4 815 B10R1.176 COC1=CC(S)=C(N)C=C1 DY797031 [1,1,0,0,0,0|2,0,0]=4 816 B10R1.176 COC1=CC=C(N)C(Cl)=N1 NO21484 [1,1,0,0,0,0|2,0,0]=4 817 B10R1.176 COC1=NC=C(Br)C(Cl)=C1 NO12897 [1,1,0,0,0,0|2,0,0]=4 818 B10R1.176 CSC1=CC(F)=C(F)C=C1 DY452068 [1,1,0,0,0,0|1,1,0]=4 819 B10R1.176 ClC1=C(Cl)C=C(CBr)C=C1 NO18826 [1,1,0,0,0,0|1,0,0]=3 820 B10R1.176 FC1=C(Cl)C=C(CBr)C=C1 DY20082 [1,1,0,0,0,0|1,0,0]=3 821 B10R1.176 FC1=C(Cl)C=CC(CBr)=C1 NO19666 [1,1,0,0,0,0|1,1,0]=4 822 B10R1.176 FC1=C(Cl)C=CC(CCl)=C1 DY40585 [1,1,0,0,0,0|1,1,0]=4 823 B10R1.176 FC1=C(F)C=C(CCl)C=C1 DY433089 [1,1,0,0,0,0|1,1,0]=4 824 B10R1.176 FC1=C(I)C=CC(CBr)=C1 DY584601 [1,1,0,0,0,0|1,1,0]=4 825 B10R1.176 FC1=NC=C(CBr)C=C1Cl DY430835 [1,1,0,0,0,0|2,0,0]=4 826 B10R1.176 N#CC1=CC(Cl)=C(Br)C=C1 DY20651 [1,1,0,0,0,0|0,0,2]=4 827 B10R1.176 N#CC1=CC(Cl)=C(Cl)C=C1 DY20181 [1,1,0,0,0,0|0,0,2]=4 828 B10R1.176 N#CC1=CC(Cl)=C(F)C=C1 NO19686 [1,1,0,0,0,0|0,0,2]=4 829 B10R1.176 N#CC1=CC(Cl)=C(I)C=C1 DY769701 [1,1,0,0,0,0|0,0,2]=4 830 B10R1.176 N#CC1=CC(Cl)=C(O)C=C1 NO18887 [1,1,0,0,0,0|0,0,2]=4 831 B10R1.176 NCC1=CC(Br)=C(F)C=C1 DY584425 [1,1,0,0,0,0|0,1,0]=3 832 B10R1.176 NCC1=CC(Br)=C(F)N=C1 DY651547 [1,1,0,0,0,0|1,1,0]=4 833 B10R1.176 NCC1=NC(Cl)=C(Cl)C=C1 DY536751 [1,1,0,0,0,0|1,0,0]=3 834 B10R1.176 NNC1=CC(Cl)=C(Cl)C=C1 NO19870 [1,1,0,0,0,0|1,0,0]=3 835 B10R1.176 NNC1=CC(F)=C(Br)C=C1 DY542625 [1,1,0,0,0,0|1,1,0]=4 836 B10R1.176 NNC1=CC(F)=C(F)C=C1 DY20003 [1,1,0,0,0,0|1,1,0]=4 837 B10R1.176 NNC1=CC(F)=C(F)C=C1 DY610770 [1,1,0,0,0,0|1,1,0]=4 838 B10R1.176 NNC1=CC(F)=C(F)C=C1 NO23015 [1,1,0,0,0,0|1,1,0]=4 839 B10R1.176 O=CC1=CC(Cl)=C(Br)C=C1 NO12259 [1,1,0,0,0,0|1,0,1]=4 840 B10R1.176 O=CC1=CC(Cl)=C(Cl)C=C1 NO19889 [1,1,0,0,0,0|1,0,1]=4 841 B10R1.176 O=CC1=CC(Cl)=C(F)C=C1 DY20026 [1,1,0,0,0,0|1,0,1]=4 842 B10R1.176 OCC1=CC(Br)=C(O)C=C1 NO21356 [1,1,0,0,0,0|1,1,0]=4 843 B10R1.176 OCC1=CC(Cl)=C(Cl)C=C1 NO18809 [1,1,0,0,0,0|1,0,0]=3 844 B10R1.176 OCC1=CC(F)=C(Br)C=C1 NO20190 [1,1,0,0,0,0|1,1,0]=4 845 B10R1.176 OCC1=CC(F)=C(Cl)C=C1 DY40694 [1,1,0,0,0,0|1,1,0]=4 846 B10R1.176 OCC1=CC(F)=C(F)C=C1 NO19362 [1,1,0,0,0,0|1,1,0]=4 847 B10R1.176 OCC1=CC(F)=C(I)C=C1 DY585015 [1,1,0,0,0,0|1,1,0]=4 848 B10R1.176 OCC1=CC(I)=C(Br)C=C1 DY584846 [1,1,0,0,0,0|1,1,0]=4 849 B10R1.176 OCC1=CC(O)=C(Br)C=C1 NO16027 [1,1,0,0,0,0|2,0,0]=4 850 B10R1.1 BrCCC1=CC=C(Br)C=C1 DY531753 [1,1,0,0,0,0|1,0,0]=3 851 B10R1.1 CC1=CC=C(CC#N)C=C1 NO21709 [1,1,0,0,0,0|0,0,2]=4 852 B10R1.1 CC1=CC=C(CCBr)C=C1 NO19977 [1,1,0,0,0,0|1,0,0]=3 853 B10R1.1 CC1=CC=C(CCN)C=C1 NO18979 [1,1,0,0,0,0|0,0,0]=2 854 B10R1.1 CC1=CC=C(CNN)C=C1 NO20201 [1,1,0,0,0,0|1,0,0]=3 855 B10R1.1 CC1=CN=C(CCN)C=C1 DY654264 [1,1,0,0,0,0|1,0,0]=3 856 B10R1.1 CCCC1=CC=C(Br)C=C1 NO10896 [1,1,0,0,0,0|1,0,0]=3 857 B10R1.1 CCNC1=CC=C(C)C=C1 DY822062 [1,1,0,0,0,0|2,0,0]=4 858 B10R1.1 CCNC1=CC=C(Cl)C=C1 DY745663 [1,1,0,0,0,0|2,0,0]=4 859 B10R1.1 CCOC1=CC=C(I)C=C1 NO22907 [1,1,0,0,0,0|2,0,0]=4 860 B10R1.1 CCOC1=CC=C(N)C=C1 NO11879 [1,1,0,0,0,0|2,0,0]=4 861 B10R1.1 CCOC1=CC=C(O)C=C1 DY563859 [1,1,0,0,0,0|2,0,0]=4 862 B10R1.1 CNCC1=CC=C(Br)C=C1 NO19272 [1,1,0,0,0,0|2,0,0]=4 863 B10R1.1 CNCC1=CC=C(C)C=C1 NO11795 [1,1,0,0,0,0|2,0,0]=4 864 B10R1.1 CNCC1=CC=C(Cl)C=C1 DY455886 [1,1,0,0,0,0|2,0,0]=4 865 B10R1.1 CNCC1=CC=C(F)C=C1 DY585104 [1,1,0,0,0,0|2,0,0]=4 866 B10R1.1 ClC1=CC=C(CCBr)C=C1 NO10835 [1,1,0,0,0,0|1,0,0]=3 867 B10R1.1 ClCCC1=CN=C(Cl)C=C1 DY714175 [1,1,0,0,0,0|2,0,0]=4 868 B10R1.1 FC1=CC=C(CCBr)C=C1 NO10866 [1,1,0,0,0,0|1,0,0]=3 869 B10R1.1 FC1=CC=C(CCCl)C=C1 DY584346 [1,1,0,0,0,0|1,0,0]=3 870 B10R1.1 N#CCC1=CC=C(Br)C=C1 NO20687 [1,1,0,0,0,0|0,0,2]=4 871 B10R1.1 N#CCC1=CC=C(Cl)C=C1 DY20790 [1,1,0,0,0,0|0,0,2]=4 872 B10R1.1 N#CCC1=CC=C(F)C=C1 NO14479 [1,1,0,0,0,0|0,0,2]=4 873 B10R1.1 N#CCC1=CC=C(O)C=C1 DY522681 [1,1,0,0,0,0|0,0,2]=4 874 B10R1.1 NC1=CC=C(CCO)C=C1 NO13450 [1,1,0,0,0,0|1,0,0]=3 875 B10R1.1 NCCC1=CC=C(Br)C=C1 NO19296 [1,1,0,0,0,0|0,0,0]=2 876 B10R1.1 NCCC1=CC=C(F)C=C1 NO13766 [1,1,0,0,0,0|0,0,0]=2 877 B10R1.1 NNCC1=CC=C(Cl)C=C1 DY570291 [1,1,0,0,0,0|1,0,0]=3 878 B10R1.1 NNCC1=CC=C(Cl)C=C1 DY583979 [1,1,0,0,0,0|1,0,0]=3 879 B10R1.1 NNCC1=CC=C(F)C=C1 DY567861 [1,1,0,0,0,0|1,0,0]=3 880 B10R1.1 NNCC1=CC=C(F)C=C1 NO17057 [1,1,0,0,0,0|1,0,0]=3 881 B10R1.1 O=CCC1=CC=C(Br)C=C1 NO18203 [1,1,0,0,0,0|1,0,1]=4 882 B10R1.1 OCCC1=CC=C(Br)C=C1 NO14491 [1,1,0,0,0,0|1,0,0]=3 883 B10R1.1 OCCC1=CC=C(Cl)C=C1 NO22791 [1,1,0,0,0,0|1,0,0]=3 884 B10R1.1 OCCC1=CC=C(Cl)N=C1 DY509192 [1,1,0,0,0,0|2,0,0]=4 885 B10R1.1 OCCC1=CC=C(O)C=C1 NO20458 [1,1,0,0,0,0|1,0,0]=3 886 B10R1.4 CC1=NC=CC=C1CCN DY653840 [1,1,0,0,0,0|1,0,0]=3 887 B10R1.4 CCOC1=C(Br)C=CC=C1 DY20149 [1,1,0,0,0,0|2,0,0]=4 888 B10R1.4 CCOC1=C(F)C=CC=C1 DY452620 [1,1,0,0,0,0|2,0,0]=4 889 B10R1.4 CNCC1=C(Br)C=CC=C1 DY455892 [1,1,0,0,0,0|2,0,0]=4 890 B10R1.4 N#CCC1=C(Br)C=CC=C1 NO10707 [1,1,0,0,0,0|0,0,2]=4 891 B10R1.4 N#CCC1=C(Cl)C=CC=C1 NO21495 [1,1,0,0,0,0|0,0,2]=4 892 B10R1.4 N#CCC1=C(F)C=CC=C1 NO20772 [1,1,0,0,0,0|0,0,2]=4 893 B10R1.4 N#CCC1=C(N)C=CC=C1 NO20914 [1,1,0,0,0,0|0,0,2]=4 894 B10R1.4 NCCC1=C(Br)C=CC=C1 NO15138 [1,1,0,0,0,0|0,0,0]=2 895 B10R1.4 NCCC1=C(F)C=CC=C1 NO14793 [1,1,0,0,0,0|0,0,0]=2 896 B10R1.4 NCCC1=C(N)C=CC=C1 DY584423 [1,1,0,0,0,0|0,0,0]=2 897 B10R1.4 NCCC1=C(N)C=CC=C1 NO15970 [1,1,0,0,0,0|0,0,0]=2 898 B10R1.4 NCCC1=CC=CN=C1Cl DY585655 [1,1,0,0,0,0|1,0,0]=3 899 B10R1.4 NNCC1=C(F)C=CC=C1 NO20134 [1,1,0,0,0,0|1,0,0]=3 900 B10R1.4 OCCC1=C(Br)C=CC=C1 NO21407 [1,1,0,0,0,0|1,0,0]=3 901 B10R1.4 OCCC1=C(I)C=CC=C1 DY545007 [1,1,0,0,0,0|1,0,0]=3 902 B10R1.15 C#CC(O)C1=CC=CC=C1 DY460116 [1,1,0,0,0,0|1,0,1]=4 903 B10R1.15 C#C[C@H](O)C1=CC=CC=C1 DY565311 [1,1,0,0,0,0|1,0,1]=4 904 B10R1.15 C=C(CBr)C1=CC=CC=C1 NO20091 [1,1,0,0,0,0|1,0,1]=4 905 B10R1.15 CC(CN)C1=CC=CC=C1 DY822021 [1,1,0,0,0,0|0,0,0]=2 906 B10R1.15 CC(NN)C1=CC=CN=C1 DY656338 [1,1,0,0,0,0|2,0,0]=4 907 B10R1.15 CCC(C)C1=CC=CC=C1 NO11947 [1,1,0,0,0,0|1,0,0]=3 908 B10R1.15 CCC(O)C1=CC=CC=C1 DY580677 [1,1,0,0,0,0|1,0,0]=3 909 B10R1.15 CCS(=O)C1=CC=CC=C1 DY746839 [1,1,0,0,0,0|2,0,0]=4 910 B10R1.15 CC[C@H](N)C1=CC=CC=C1 DY20337 [1,1,0,0,0,0|1,0,0]=3 911 B10R1.15 CC[C@H](N)C1=CC=NC=C1 DY623825 [1,1,0,0,0,0|2,0,0]=4 912 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 NO10909 [1,1,0,0,0,0|0,0,0]=2 913 B10R1.15 NC(CO)C1=CC=CC=C1 NO15860 [1,1,0,0,0,0|1,0,0]=3 914 B10R1.15 NC(CO)C1=CC=CN=C1 DY654840 [1,1,0,0,0,0|2,0,0]=4 915 B10R1.15 NC(CO)C1=NC=CC=C1 DY111155 [1,1,0,0,0,0|2,0,0]=4 916 B10R1.15 NC(CO)C1=NC=CC=C1 DY509906 [1,1,0,0,0,0|2,0,0]=4 917 B10R1.15 NCC(=O)C1=CC=CC=C1 NO10874 [1,1,0,0,0,0|0,0,1]=3 918 B10R1.15 NC[C@H](O)C1=CC=CC=C1 NO20485 [1,1,0,0,0,0|0,0,0]=2 919 B10R1.15 NNC(=O)C1=CC=CC=C1 NO10971 [1,1,0,0,0,0|1,0,1]=4 920 B10R1.15 NNC(=S)C1=CC=CC=C1 DY721675 [1,1,0,0,0,0|1,0,1]=4 921 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 NO10553 [1,1,0,0,0,0|1,0,0]=3 922 B10R1.15 N[C@H](CO)C1=CC=CC=C1 NO10555 [1,1,0,0,0,0|1,0,0]=3 923 B10R1.15 N[C@H](CO)C1=NC=CC=C1 DY624391 [1,1,0,0,0,0|2,0,0]=4 924 B10R1.15 O=C(CBr)C1=CC=CC=C1 NO19274 [1,1,0,0,0,0|1,0,1]=4 925 B10R1.15 OC(CBr)C1=CC=CC=C1 NO18840 [1,1,0,0,0,0|1,0,0]=3 926 B10R1.15 OC[C@@H](O)c1ccccc1 DY459384 [1,1,0,0,0,0|1,0,0]=3 927 B10R1.15 O[C@@H](CBr)C1=CC=CC=C1 DY608146 [1,1,0,0,0,0|1,0,0]=3 928 B10R1.17 BrCCCC1=CC=CN=C1 DY604503 [1,1,0,0,0,0|2,0,0]=4 929 B10R1.17 BrCCOC1=CC=CC=C1 DY20150 [1,1,0,0,0,0|1,0,0]=3 930 B10R1.17 CCCC[N+]1=CC=CC=C1 DY538095 [1,1,0,0,0,0|2,0,0]=4 931 B10R1.17 CCOCC1=CC=NC=C1 DY657931 [1,1,0,0,0,0|2,0,0]=4 932 B10R1.17 CNCCC1=CC=CC=N1 DY455430 [1,1,0,0,0,0|1,0,0]=3 933 B10R1.17 ClCCCC1=CC=CN=C1 DY656440 [1,1,0,0,0,0|2,0,0]=4 934 B10R1.17 ClC\C=C\C1=CC=CC=C1 DY41818 [1,1,0,0,0,0|1,0,1]=4 935 B10R1.17 ClC\C=C\C1=CC=CC=C1 DY539883 [1,1,0,0,0,0|1,0,1]=4 936 B10R1.17 N#C[Se]CC1=CC=CC=C1 DY822032 [1,1,0,0,0,0|0,0,2]=4 937 B10R1.17 NCCCC1=CC=NC=C1 DY425564 [1,1,0,0,0,0|1,0,0]=3 938 B10R1.17 NCCCC1=NC=CC=N1 DY737570 [1,1,0,0,0,0|2,0,0]=4 939 B10R1.17 NCCNC1=CC=NC=C1 DY657683 [1,1,0,0,0,0|1,0,0]=3 940 B10R1.17 NCCNC1=NC=CC=C1 NO11746 [1,1,0,0,0,0|1,0,0]=3 941 B10R1.17 NCCOC1=CC=CC=C1 NO20484 [1,1,0,0,0,0|0,0,0]=2 942 B10R1.17 NCCOC1=CC=CN=C1 NO16368 [1,1,0,0,0,0|1,0,0]=3 943 B10R1.17 NCCOC1=NC=CN=C1 DY508970 [1,1,0,0,0,0|2,0,0]=4 944 B10R1.17 NNCCc1ccccc1 DY527511 [1,1,0,0,0,0|0,0,0]=2 945 B10R1.17 O=C=NCC1=CC=CC=C1 DY585959 [1,1,0,0,0,0|1,0,1]=4 946 B10R1.17 O=CCCC1=CC=CN=C1 DY585487 [1,1,0,0,0,0|2,0,0]=4 947 B10R1.17 O=CCSC1=CC=CC=C1 DY566091 [1,1,0,0,0,0|1,0,1]=4 948 B10R1.17 OCCCC1=CC=NC=C1 NO22019 [1,1,0,0,0,0|2,0,0]=4 949 B10R1.17 OC\C=C\C1=CC=CC=C1 DY503697 [1,1,0,0,0,0|1,0,1]=4 950 B10R1.18 CC(C)NC1=CC=CC=C1 NO11787 [1,1,0,0,0,0|2,0,0]=4 951 B10R1.18 CC(N)CC1=NC=CC=C1 DY652737 [1,1,0,0,0,0|1,0,0]=3 952 B10R1.18 N=C(N)CC1=CC=CN=C1 DY610010 [1,1,0,0,0,0|1,0,1]=4 953 B10R1.18 NC(=O)NC1=CC=CC=C1 NO10533 [1,1,0,0,0,0|1,0,1]=4 954 B10R1.18 O=S([O-])CC1=CC=CC=C1 DY745429 [1,1,0,0,0,0|2,0,0]=4 955 B10R1.131 CC1=C(Cl)SC(CCN)=N1 DY602431 [0,1,0,0,1,0|2,0,0]=4 956 B10R1.149 CC1=C(C(O)CN)SC=C1 DY107758 [0,1,0,0,1,0|2,0,0]=4 957 B12R1.24 CCC(=O)C1=C(F)C(Cl)=CC=C1 DY584969 [0,2,0,0,0,0|1,0,1]=4 958 B12R1.25 FC1=CC=CC(CCCBr)=C1Cl DY748747 [0,2,0,0,0,0|1,1,0]=4 959 B12R1.40 CCOC1=CC(F)=CC(Cl)=C1Cl DY748243 [0,2,0,0,0,0|2,0,0]=4 960 B12R1.224 NC1=C(Cl)C=CC=C1OC(F)F DY584879 [0,2,0,0,0,0|2,0,0]=4 961 B12R1.224 O=C(O)CC1=C(Br)C(Cl)=CC=C1 DY585028 [0,2,0,0,0,0|1,0,1]=4 962 B12R1.224 O=C(O)CC1=C(F)C(Cl)=CC=C1 DY545097 [0,2,0,0,0,0|1,0,1]=4 963 B12R1.542 COC1=C(CON)C=CC=C1C DY521109 [0,2,0,0,0,0|2,0,0]=4 964 B12R1.544 N#CCC1=C(F)C(Cl)=C(F)C=C1 DY585058 [0,2,0,0,0,0|0,0,2]=4 965 B12R1.10 CC1=CC(C(F)(F)CO)=CC=C1 DY579651 [0,2,0,0,0,0|2,0,0]=4 966 B12R1.17 CC1=CC=CC(C(N)CCO)=C1 DY788349 [0,2,0,0,0,0|2,0,0]=4 967 B12R1.17 CNCC(O)C1=CC=CC(O)=C1 DY526923 [0,2,0,0,0,0|1,0,0]=3 968 B12R1.17 CNC[C@H](O)c1cccc(O)c1 DY562101 [0,2,0,0,0,0|1,0,0]=3 969 B12R1.17 N#CCC(=O)C1=CC(Cl)=CC=C1 NO21429 [0,2,0,0,0,0|0,0,2]=4 970 B12R1.17 NC(CCO)C1=CC(Cl)=CC=C1 NO19263 [0,2,0,0,0,0|1,0,0]=3 971 B12R1.225 CC(C)[C@@H](N)C1=CC(Cl)=CC=C1 DY511899 [0,2,0,0,0,0|1,0,0]=3 972 B12R1.225 N[C@@H](C(=O)O)c1cccc(Cl)c1 DY544773 [0,2,0,0,0,0|1,0,1]=4 973 B12R1.225 O=C(O)[C@H](O)C1=CC(Cl)=CC=C1 DY563121 [0,2,0,0,0,0|1,0,1]=4 974 B12R1.354 NCC(=O)C1=C(F)C=CC(F)=C1 NO17892 [0,2,0,0,0,0|0,1,1]=4 975 B12R1.358 O=C(CBr)C1=CC(Cl)=CC(Cl)=C1 NO16723 [0,2,0,0,0,0|1,0,1]=4 976 B12R1.367 CCC(N)C1=CC(C)=C(C)C=C1 DY609145 [0,2,0,0,0,0|2,0,0]=4 977 B12R1.367 NCC(=O)C1=CC(O)=C(O)C=C1 DY461310 [0,2,0,0,0,0|1,0,1]=4 978 B12R1.367 NCC(O)c1ccc(O)c(O)c1 DY557481 [0,2,0,0,0,0|1,0,0]=3 979 B12R1.367 NC[C@H](O)C1=CC=C(O)C(O)=C1 DY797643 [0,2,0,0,0,0|1,0,0]=3 980 B12R1.367 N[C@H](CO)C1=CC(F)=C(F)C=C1 DY624373 [0,2,0,0,0,0|1,1,0]=4 981 B12R1.367 O=C(CBr)C1=CC(Cl)=C(Br)C=C1 DY686653 [0,2,0,0,0,0|1,0,1]=4 982 B12R1.435 CC[C@@H](N)C1=CC=CC(C#N)=C1 DY622185 [0,2,0,0,0,0|2,0,0]=4 983 B12R1.28 COCCOC1=CC(Cl)=NC=C1 DY714698 [0,2,0,0,0,0|2,0,0]=4 984 B12R1.28 NCCCOC1=CC(Cl)=CC=C1 DY425612 [0,2,0,0,0,0|0,0,0]=2 985 B12R1.50 CCC(C)OC1=NC=CC(Cl)=C1 DY654774 [0,2,0,0,0,0|2,0,0]=4 986 B12R1.50 N[C@H](CO)CC1=CC(Cl)=CC=C1 DY624403 [0,2,0,0,0,0|0,0,0]=2 987 B12R1.50 O=C(CBr)CC1=CC(S)=CC=C1 DY748993 [0,2,0,0,0,0|2,0,0]=4 988 B12R1.100 COCOC1=CC(Br)=CC(Cl)=C1 DY449050 [0,2,0,0,0,0|2,0,0]=4 989 B12R1.100 O=CCCC1=CC(Cl)=CC(Cl)=C1 DY582471 [0,2,0,0,0,0|1,0,0]=3 990 B12R1.226 O=C(O)CCC1=CC(Br)=CC=C1 NO21658 [0,2,0,0,0,0|1,1,0]=4 991 B12R1.226 O=C(O)CCC1=CC(Cl)=CC=C1 NO13948 [0,2,0,0,0,0|1,0,0]=3 992 B12R1.374 BrCCOC1=C(Br)C=CC(Br)=C1 DY106792 [0,2,0,0,0,0|1,1,0]=4 993 B12R1.374 FC1=CC(CCCBr)=C(Cl)C=C1 DY748735 [0,2,0,0,0,0|1,1,0]=4 994 B12R1.382 C#CCCC1=CC(OC)=CC=C1 DY569085 [0,2,0,0,0,0|2,0,0]=4 995 B12R1.382 CSC1=CC=CC(CCC#N)=C1 DY748681 [0,2,0,0,0,0|1,0,1]=4 996 B12R1.382 N#CCCC1=CC(CO)=CC=C1 DY748957 [0,2,0,0,0,0|1,0,1]=4 997 B12R1.382 O=CC1=CC(OCCO)=CC=C1 DY796785 [0,2,0,0,0,0|2,0,0]=4 998 B12R1.385 CC1=C(O)C=C(NCCO)C=C1 NO21891 [0,2,0,0,0,0|2,0,0]=4 999 B12R1.385 FC1=C(Cl)C=CC(CCCBr)=C1 DY748723 [0,2,0,0,0,0|1,1,0]=4 1000 B12R1.385 FC1=C(I)C=CC(CCCCl)=C1 DY748729 [0,2,0,0,0,0|1,1,0]=4 1001 B12R1.385 O=CCCC1=CC(Br)=C(F)C=C1 DY513777 [0,2,0,0,0,0|1,1,0]=4 1002 B12R1.385 OCCCC1=CC(F)=C(F)C=C1 DY547239 [0,2,0,0,0,0|1,1,0]=4 1003 B12R1.385 S=C=NCc1ccc(Cl)c(Cl)c1 DY584545 [0,2,0,0,0,0|1,0,1]=4 1004 B12R1.44 CCCC1=CC(F)=C(O)C(F)=C1 DY822093 [0,2,0,0,0,0|1,1,0]=4 1005 B12R1.44 N#CCC1=CC(Cl)=C(F)C(Cl)=C1 DY109774 [0,2,0,0,0,0|0,0,2]=4 1006 B12R1.101 O=C(O)CC1=CC(Cl)=CC(Cl)=C1 NO20844 [0,2,0,0,0,0|1,0,1]=4 1007 B12R1.19 CC(=O)CC1=CC(Cl)=C(N)C=C1 DY749143 [0,2,0,0,0,0|1,0,1]=4 1008 B12R1.19 CC(C)OC1=CC(Cl)=C(Br)C=C1 DY453112 [0,2,0,0,0,0|2,0,0]=4 1009 B12R1.19 NC(=O)NC1=CC(Cl)=C(Cl)C=C1 NO20402 [0,2,0,0,0,0|1,0,1]=4 1010 B12R1.19 NC1=C(Cl)C=C(OC(F)F)C=C1 DY514113 [0,2,0,0,0,0|2,0,0]=4 1011 B12R1.19 O=C(O)CC1=CC(Cl)=C(Cl)C=C1 NO20693 [0,2,0,0,0,0|1,0,1]=4 1012 B12R1.19 O=C(O)CC1=CC(Cl)=C(F)C=C1 NO10724 [0,2,0,0,0,0|1,0,1]=4 1013 B12R1.119 FC(F)(F)OC1=CC=CC(Cl)=C1 NO21882 [0,2,0,0,0,0|2,0,0]=4 1014 B12R1.268 COC1=C(CC#N)C=C(Cl)C=C1 NO20218 [0,2,0,0,0,0|0,0,2]=4 1015 B12R1.1123 N#CCC1=C(F)C=C(F)C(Cl)=C1 DY584929 [0,2,0,0,0,0|0,0,2]=4 1016 B12R1.279 NCCC1=CC=CC(C(N)=O)=C1 DY747001 [0,2,0,0,0,0|1,0,0]=3 1017 B12R1.279 NNCC1=CC([N+](=O)[O-])=CC=C1 DY557775 [0,2,0,0,0,0|2,0,0]=4 1018 B12R1.288 COC1=C(C)C=C(CCN)C=N1 DY111257 [0,2,0,0,0,0|2,0,0]=4 1019 B10R1.25 NCC1=C(Cl)C=C(Cl)C=C1 DY40814 [0,0,1,1,0,0|1,0,1]=4 1020 B10R1.25 NCC1=C(F)C=C(Cl)C=C1 DY585043 [0,0,1,1,0,0|1,0,1]=4 1021 B10R2.31 BrC1=CC=C2CCC2=C1 DY505107 [1,0,0,1,0,0|0,1,0]=3 1022 B10R2.31 NC1=CC=C2CCC2=C1 DY686977 [1,0,0,1,0,0|1,0,0]=3 1023 B10R2.6 C1=CC=C([C@@H]2CO2)C=C1 DY20326 [1,0,0,1,0,0|1,0,0]=3 1024 B10R2.7 C1=CC2=C(C=C1)CSC2 DY114506 [1,0,0,1,0,0|2,0,0]=4 1025 B10R2.7 C1=CC2=C(C=C1)OCC2 NO20929 [1,0,0,1,0,0|1,0,0]=3 1026 B10R2.7 C1=CC2=NCCN2C=C1 DY760292 [1,0,0,1,0,0|1,0,1]=4 1027 B10R2.7 C1=CC=C2CC=CC2=C1 DY20914 [1,0,0,1,0,0|1,0,1]=4 1028 B10R2.7 C1=CC=C2CNCC2=C1 NO11516 [1,0,0,1,0,0|2,0,0]=4 1029 B10R2.7 C1=CC=C2NC=CC2=C1 NO11496 [1,0,0,1,0,0|0,0,2]=4 1030 B10R2.7 C1=CC=C2NCCC2=C1 NO19084 [1,0,0,1,0,0|0,0,0]=2 1031 B10R2.7 C1=CC=C2NN=CC2=C1 NO11488 [1,0,0,1,0,0|1,0,1]=4 1032 B10R2.7 C1=CN=C2CCCC2=C1 NO14838 [1,0,0,1,0,0|2,0,0]=4 1033 B10R2.7 C1=CN=C2CCNC2=C1 DY107728 [1,0,0,1,0,0|1,0,0]=3 1034 B10R2.7 C1=NC=C2NCCC2=C1 DY570663 [1,0,0,1,0,0|1,0,0]=3 1035 B10R2.320 BrC1CC2=CC=CC=C21 DY539943 [1,0,0,1,0,0|1,0,0]=3 1036 B12R2.82 ClC1=C(Cl)C2=C(C=C1)NC=N2 DY430308 [0,1,0,1,0,0|1,0,1]=4 1037 B12R2.82 FC1=C2CCNC2=CC=C1Br NO17575 [0,1,0,1,0,0|0,1,0]=3 1038 B12R2.82 OC1=C(Br)C2=C(C=C1)OCC2 DY751405 [0,1,0,1,0,0|2,0,0]=4 1039 B12R2.202 NC1=NC2=C(C=CC=C2Cl)N1 NO16891 [0,1,0,1,0,0|1,0,1]=4 1040 B12R2.202 NC1=NC2=C(C=CC=C2Cl)S1 NO20101 [0,1,0,1,0,0|1,0,1]=4 1041 B12R2.202 NC1=NC2=C(S1)C(Cl)=CC=C2 DY538245 [0,1,0,1,0,0|1,0,1]=4 1042 B12R2.202 O=C1CC2=CC=CC(Br)=C2N1 NO14679 [0,1,0,1,0,0|0,1,1]=4 1043 B12R2.202 O=C1CC2=CC=CC(Cl)=C2C1 NO22741 [0,1,0,1,0,0|1,0,1]=4 1044 B12R2.202 O=C1CC2=CC=CC(Cl)=C2N1 DY10111 [0,1,0,1,0,0|0,0,1]=3 1045 B12R2.202 O=C1CC2=CC=CC(F)=C2N1 DY10168 [0,1,0,1,0,0|0,1,1]=4 1046 B12R2.202 O=C1CC2=NC=CC(Cl)=C2N1 DY510146 [0,1,0,1,0,0|1,0,1]=4 1047 B12R2.1081 BrC1=C2CCCCC2=CC=C1 DY768527 [0,1,0,1,0,0|1,1,0]=4 1048 B12R2.1081 BrC1=C2CCCNC2=CC=C1 NO18620 [0,1,0,1,0,0|1,1,0]=4 1049 B12R2.1081 BrC1=C2CCCOC2=CC=C1 DY677682 [0,1,0,1,0,0|1,1,0]=4 1050 B12R2.1081 BrC1=C2CCNCC2=CC=C1 NO19342 [0,1,0,1,0,0|1,1,0]=4 1051 B12R2.1081 BrC1=C2CNCCC2=CC=C1 NO12481 [0,1,0,1,0,0|0,1,0]=3 1052 B12R2.1081 BrC1=C2CNCCC2=CC=C1 NO15449 [0,1,0,1,0,0|0,1,0]=3 1053 B12R2.1081 BrC1=C2OCCCC2=CC=C1 DY551733 [0,1,0,1,0,0|1,1,0]=4 1054 B12R2.1081 CC1=C2NCCCC2=CC=C1 DY784858 [0,1,0,1,0,0|1,0,0]=3 1055 B12R2.1081 ClC1=C2CCC=CC2=CC=C1 DY764075 [0,1,0,1,0,0|1,0,1]=4 1056 B12R2.1081 ClC1=C2CCCNC2=CC=C1 NO19411 [0,1,0,1,0,0|1,0,0]=3 1057 B12R2.1081 ClC1=C2CNCCC2=CC=C1 NO17691 [0,1,0,1,0,0|0,0,0]=2 1058 B12R2.1081 ClC1=CC=NC2=C1CCCC2 NO16900 [0,1,0,1,0,0|2,0,0]=4 1059 B12R2.1081 Clc1ncnc2c1CNCC2 DY100168 [0,1,0,1,0,0|2,0,0]=4 1060 B12R2.1081 FC1=C2CCNCC2=CC=C1 NO19337 [0,1,0,1,0,0|1,1,0]=4 1061 B12R2.1081 FC1=CC=CC2=C1NCCO2 DY443372 [0,1,0,1,0,0|0,1,0]=3 1062 B12R2.1081 NC1=C2CNCCC2=CC=C1 DY580317 [0,1,0,1,0,0|1,0,0]=3 1063 B12R2.1081 OC1=CC=CC2=C1OCCO2 NO12196 [0,1,0,1,0,0|2,0,0]=4 1064 B12R2.80 NC1CC1C2=CC(Cl)=CC=C2 DY744457 [0,1,0,1,0,0|0,0,0]=2 1065 B12R2.132 ClC1=CC=C2NC=C(Br)C2=C1 DY20448 [0,1,0,1,0,0|0,0,2]=4 1066 B12R2.132 ClC1=CC=C2NN=C(I)C2=C1 NO18257 [0,1,0,1,0,0|1,0,1]=4 1067 B12R2.132 NC1=NNC2=CC=C(Cl)C=C21 NO13250 [0,1,0,1,0,0|1,0,1]=4 1068 B12R2.132 NC1CCC2=CC=C(Br)C=C21 DY579057 [0,1,0,1,0,0|1,1,0]=4 1069 B12R2.132 NC1CCC2=CC=C(F)C=C21 DY530697 [0,1,0,1,0,0|1,1,0]=4 1070 B12R2.132 NC1COC2=C1C=C(Br)C=C2 DY577467 [0,1,0,1,0,0|1,1,0]=4 1071 B12R2.132 NC1COC2=C1C=C(F)C=C2 DY431482 [0,1,0,1,0,0|1,1,0]=4 1072 B12R2.132 N[C@@H]1CCC2=CC=C(O)C=C21 DY104168 [0,1,0,1,0,0|2,0,0]=4 1073 B12R2.132 N[C@@H]1COC2=C1C=C(Br)C=C2 DY625417 [0,1,0,1,0,0|1,1,0]=4 1074 B12R2.132 O=C1CCC2=CC=C(Cl)C=C12 NO13722 [0,1,0,1,0,0|1,0,1]=4 1075 B12R2.132 O=C1ONC2=C1C=C(Cl)C=C2 DY751765 [0,1,0,1,0,0|1,0,1]=4 1076 B12R2.132 OC1CCC2=CC=C(F)C=C21 DY447461 [0,1,0,1,0,0|1,1,0]=4 1077 B12R2.196 CC1=C2CC[C@H](N)C2=CC=C1 DY625369 [0,1,0,1,0,0|2,0,0]=4 1078 B12R2.196 CC1=CC=CC2=C1OC[C@@H]2N DY622563 [0,1,0,1,0,0|2,0,0]=4 1079 B12R2.196 NC1CCC2=C(F)C=CC=C21 NO18746 [0,1,0,1,0,0|1,1,0]=4 1080 B12R2.196 N[C@@H]1CCC2=C(Br)C=CC=C21 NO14533 [0,1,0,1,0,0|1,1,0]=4 1081 B12R2.196 N[C@H]1CCC2=C(Br)C=CC=C21 NO14534 [0,1,0,1,0,0|1,1,0]=4 1082 B12R2.196 O=C1CCC2=C(Cl)C=CC=C12 NO18751 [0,1,0,1,0,0|1,0,1]=4 1083 B12R2.196 OC1CCC2=C(Cl)C=CN=C21 NO12906 [0,1,0,1,0,0|2,0,0]=4 1084 B12R2.1282 CC1=CC=CC(C2(N)CC2)=C1 DY557103 [0,1,0,1,0,0|2,0,0]=4 1085 B12R2.1282 NC1(C2=NC(Cl)=CC=C2)CC1 DY116274 [0,1,0,1,0,0|2,0,0]=4 1086 B12R2.2313 FC1=CC=CC(C2CCN2)=C1 DY586321 [0,1,0,1,0,0|0,1,0]=3 1087 B12R2.24 BrC1=CC2=C(C=C1)NCCO2 NO10787 [0,1,0,1,0,0|0,1,0]=3 1088 B12R2.24 BrC1=CC2=C(C=C1)NCCO2 NO15185 [0,1,0,1,0,0|0,1,0]=3 1089 B12R2.24 BrC1=CC2=C(C=C1)OCCN2 NO15468 [0,1,0,1,0,0|1,1,0]=4 1090 B12R2.24 BrC1=CC2=C(C=C1)OCCO2 NO10776 [0,1,0,1,0,0|1,1,0]=4 1091 B12R2.24 BrC1=CC=C2CCCCC2=C1 NO16753 [0,1,0,1,0,0|1,1,0]=4 1092 B12R2.24 BrC1=CC=C2CCCNC2=C1 DY784852 [0,1,0,1,0,0|1,1,0]=4 1093 B12R2.24 BrC1=CC=C2CCCNC2=C1 NO18621 [0,1,0,1,0,0|1,1,0]=4 1094 B12R2.24 BrC1=CC=C2CCNCC2=C1 NO19606 [0,1,0,1,0,0|1,1,0]=4 1095 B12R2.24 BrC1=CC=C2CCOCC2=C1 NO16547 [0,1,0,1,0,0|1,1,0]=4 1096 B12R2.24 BrC1=CC=C2CNCCC2=C1 NO10618 [0,1,0,1,0,0|0,1,0]=3 1097 B12R2.24 BrC1=CC=C2CNCCC2=C1 NO17620 [0,1,0,1,0,0|0,1,0]=3 1098 B12R2.24 BrC1=CC=C2COCCC2=C1 DY441107 [0,1,0,1,0,0|1,1,0]=4 1099 B12R2.24 BrC1=CC=C2NCCCC2=C1 NO19737 [0,1,0,1,0,0|0,1,0]=3 1100 B12R2.24 BrC1=CC=C2OCCCC2=C1 NO19916 [0,1,0,1,0,0|1,1,0]=4 1101 B12R2.24 BrC1=NC2=C(C=C1)CNCC2 DY100126 [0,1,0,1,0,0|1,1,0]=4 1102 B12R2.24 BrC1=NC2=C(C=C1)NCCO2 DY511035 [0,1,0,1,0,0|1,1,0]=4 1103 B12R2.24 CC1=CC=C2CCCCC2=C1 NO10746 [0,1,0,1,0,0|2,0,0]=4 1104 B12R2.24 CC1=CC=C2CCNCC2=C1 DY553959 [0,1,0,1,0,0|2,0,0]=4 1105 B12R2.24 CC1=CC=C2CCNCC2=C1 NO18155 [0,1,0,1,0,0|2,0,0]=4 1106 B12R2.24 CC1=CC=C2CNCCC2=C1 DY431469 [0,1,0,1,0,0|1,0,0]=3 1107 B12R2.24 ClC1=CC2=C(CCNC2)N=C1 DY674829 [0,1,0,1,0,0|2,0,0]=4 1108 B12R2.24 ClC1=CC2=C(CNCC2)N=N1 DY20767 [0,1,0,1,0,0|2,0,0]=4 1109 B12R2.24 ClC1=CC2=C(N=C1)SCCN2 DY680571 [0,1,0,1,0,0|2,0,0]=4 1110 B12R2.24 ClC1=CC=C2CNCCC2=C1 DY549387 [0,1,0,1,0,0|0,0,0]=2 1111 B12R2.24 ClC1=CC=C2NCCCC2=C1 NO14585 [0,1,0,1,0,0|0,0,0]=2 1112 B12R2.24 ClC1=CC=C2NCCNC2=C1 DY744199 [0,1,0,1,0,0|0,0,0]=2 1113 B12R2.24 ClC1=NC2=C(C=C1)CCCC2 NO16899 [0,1,0,1,0,0|2,0,0]=4 1114 B12R2.24 ClC1=NC2=C(C=C1)CNCC2 NO12512 [0,1,0,1,0,0|1,0,0]=3 1115 B12R2.24 ClC1=NC2=C(C=C1)NCCN2 NO12186 [0,1,0,1,0,0|1,0,0]=3 1116 B12R2.24 FC1=CC=C2CNCCC2=C1 DY572409 [0,1,0,1,0,0|0,1,0]=3 1117 B12R2.24 FC1=CC=C2OCCCC2=C1 DY584315 [0,1,0,1,0,0|1,1,0]=4 1118 B12R2.24 IC1=CC=C2CCCNC2=C1 DY450838 [0,1,0,1,0,0|1,1,0]=4 1119 B12R2.24 NC1=CC2=C(C=C1)CCCC2 DY541887 [0,1,0,1,0,0|2,0,0]=4 1120 B12R2.24 NC1=CC=C2CCCNC2=C1 DY526875 [0,1,0,1,0,0|2,0,0]=4 1121 B12R2.24 OC1=CC2=C(C=C1)CCCC2 NO13514 [0,1,0,1,0,0|2,0,0]=4 1122 B12R2.24 OC1=CC2=C(C=C1)NCCO2 DY442455 [0,1,0,1,0,0|1,0,0]=3 1123 B12R2.24 OC1=CC=C2CCCNC2=C1 NO10898 [0,1,0,1,0,0|2,0,0]=4 1124 B12R2.24 OC1=CC=C2CCNCC2=C1 NO17696 [0,1,0,1,0,0|2,0,0]=4 1125 B12R2.24 OC1=CC=C2CNCCC2=C1 NO18391 [0,1,0,1,0,0|1,0,0]=3 1126 B12R2.203 NC1=NNC2=CC=CC(Cl)=C21 NO12860 [0,1,0,1,0,0|1,0,1]=4 1127 B12R2.203 NC1CCC2=CC=CC(F)=C21 DY741805 [0,1,0,1,0,0|0,1,0]=3 1128 B12R2.203 O=C1CCC2=CC=CC(F)=C12 NO15500 [0,1,0,1,0,0|1,1,0]=4 1129 B12R2.203 OC1CCC2=CC=CC(Br)=C21 DY510501 [0,1,0,1,0,0|1,1,0]=4 1130 B12R2.203 OC1CSC2=C1C(Br)=CC=C2 DY569607 [0,1,0,1,0,0|1,1,0]=4 1131 B12R2.612 CN1CCC2=CC(F)=CC=C21 DY630394 [0,1,0,1,0,0|0,1,0]=3 1132 B12R2.612 CN1CCC2=CC(N)=CC=C21 DY629369 [0,1,0,1,0,0|1,0,0]=3 1133 B12R2.612 ClC1CCC2=CC(Br)=CC=C21 NO16081 [0,1,0,1,0,0|1,1,0]=4 1134 B12R2.612 NC1CCC2=CC(F)=CC=C21 DY431475 [0,1,0,1,0,0|0,1,0]=3 1135 B12R2.612 NN1C=CC2=CC(Cl)=CC=C21 DY728353 [0,1,0,1,0,0|0,0,2]=4 1136 B12R2.612 N[C@@H]1CCC2=CC(Cl)=CC=C21 DY572883 [0,1,0,1,0,0|0,0,0]=2 1137 B12R2.612 N[C@@H]1COC2=C1C=CC(Br)=C2 DY625465 [0,1,0,1,0,0|0,1,0]=3 1138 B12R2.612 O=C1CCC2=CC(Br)=CC=C12 NO21498 [0,1,0,1,0,0|1,1,0]=4 1139 B12R2.612 O=C1CCC2=CC(Cl)=CC=C12 NO22043 [0,1,0,1,0,0|1,0,0]=3 1140 B12R2.612 O=C1CCC2=CC(Cl)=CN=C12 DY674865 [0,1,0,1,0,0|2,0,0]=4 1141 B12R2.612 O=C1CCC2=CC(F)=CC=C12 DY10164 [0,1,0,1,0,0|1,1,0]=4 1142 B12R2.612 O=C1CCC2=CC(O)=CC=C12 NO11017 [0,1,0,1,0,0|2,0,0]=4 1143 B12R2.612 O=C1COC2=C1C=CC(Cl)=C2 NO15082 [0,1,0,1,0,0|1,0,1]=4 1144 B12R2.612 O=C1NCC2=CC(Cl)=CC=C12 NO10349 [0,1,0,1,0,0|1,0,1]=4 1145 B12R2.612 O=C1OCC2=CC(Cl)=CC=C12 DY751351 [0,1,0,1,0,0|1,0,1]=4 1146 B12R2.612 OC1COC2=C1C=CC(Br)=C2 DY586466 [0,1,0,1,0,0|1,1,0]=4 1147 B12R2.612 O[C@H]1COC2=C1C=CC(Br)=C2 DY586465 [0,1,0,1,0,0|1,1,0]=4 1148 B12R2.246 CC1=CC(N)=C2NCCC2=C1 DY741895 [0,1,0,1,0,0|1,0,0]=3 1149 B12R2.246 ClC1=C2NC=CC2=CC(Br)=C1 DY533283 [0,1,0,1,0,0|0,0,2]=4 1150 B12R2.246 ClC1=C2NN=CC2=CC(Br)=C1 DY441342 [0,1,0,1,0,0|1,0,1]=4 1151 B12R2.246 ClC1=CC(Br)=C2NC=CC2=C1 NO12110 [0,1,0,1,0,0|0,0,2]=4 1152 B12R2.246 ClC1=CC(Cl)=C2CCCC2=N1 NO16898 [0,1,0,1,0,0|2,0,0]=4 1153 B12R2.246 ClC1=CC(Cl)=C2NC=CC2=C1 DY107692 [0,1,0,1,0,0|0,0,2]=4 1154 B12R2.246 ClC1=CN2CCN=C2C(Cl)=C1 DY760826 [0,1,0,1,0,0|1,0,1]=4 1155 B12R2.246 FC1=CC(Cl)=C2NC=CC2=C1 DY544941 [0,1,0,1,0,0|0,0,2]=4 1156 B12R2.246 NC1=C2NC=CC2=CC(Cl)=C1 DY546789 [0,1,0,1,0,0|0,0,2]=4 1157 B12R2.246 NC1=CC(Cl)=C2NN=CC2=C1 DY586502 [0,1,0,1,0,0|1,0,1]=4 1158 B12R2.246 OC1=CC(Br)=CC2=C1CCC2 DY532533 [0,1,0,1,0,0|1,1,0]=4 1159 B12R2.606 CC1=CC=C2NC(=O)CC2=C1 NO15472 [0,1,0,1,0,0|1,0,1]=4 1160 B12R2.606 NC1=NC2=C(C=CC(Cl)=C2)S1 NO20102 [0,1,0,1,0,0|1,0,1]=4 1161 B12R2.606 NC1CC2=CC=C(Br)C=C2C1 DY447233 [0,1,0,1,0,0|0,1,0]=3 1162 B12R2.606 NC1CC2=CC=C(Br)C=C2C1 NO18236 [0,1,0,1,0,0|0,1,0]=3 1163 B12R2.606 NC1CC2=CC=C(I)C=C2C1 DY21023 [0,1,0,1,0,0|0,1,0]=3 1164 B12R2.606 Nc1nc2cc(Cl)ccc2o1 DY563103 [0,1,0,1,0,0|1,0,1]=4 1165 B12R2.606 O=C1CC2=CC(Br)=CC=C2N1 NO22042 [0,1,0,1,0,0|0,1,1]=4 1166 B12R2.606 O=C1CC2=CC(Cl)=CC=C2N1 NO22052 [0,1,0,1,0,0|0,0,1]=3 1167 B12R2.606 O=C1NC2=C(C=C(Cl)C=C2)N1 NO10315 [0,1,0,1,0,0|1,0,1]=4 1168 B12R2.606 O=C1NC2=C(C=C(Cl)C=C2)S1 DY31174 [0,1,0,1,0,0|1,0,1]=4 1169 B12R2.606 OC1CC2=CC=C(Br)C=C2C1 NO12609 [0,1,0,1,0,0|1,1,0]=4 1170 B12R2.606 S=C1NC2=C(C=C(Cl)C=C2)O1 DY542775 [0,1,0,1,0,0|1,0,1]=4 1171 B12R2.221 ClC1=C2C=NNC2=C(Cl)C=C1 DY441197 [0,1,0,1,0,0|1,0,1]=4 1172 B12R2.221 OC1=C2CCOC2=C(F)C=C1 DY459005 [0,1,0,1,0,0|1,1,0]=4 1173 B12R2.43 N#CC1=CC(C2CC2)=CC=C1 DY757555 [0,1,0,1,0,0|2,0,0]=4 1174 B12R2.43 NCC1=CC(C2CC2)=CC=C1 NO16620 [0,1,0,1,0,0|2,0,0]=4 1175 B12R2.44 C#CC1=CC=C2CCCC2=C1 DY517785 [0,1,0,1,0,0|2,0,0]=4 1176 B12R2.44 COC1=CC=C2NCCC2=C1 DY456370 [0,1,0,1,0,0|1,0,0]=3 1177 B12R2.44 COC1=CC=C2NCCC2=C1 NO17324 [0,1,0,1,0,0|1,0,0]=3 1178 B12R2.44 ClCC1=CC2=C(C=C1)OCC2 DY796377 [0,1,0,1,0,0|1,0,0]=3 1179 B12R2.44 O=CC1=CC2=C(C=C1)OCC2 NO21622 [0,1,0,1,0,0|2,0,0]=4 1180 B12R2.44 O=CC1=CC=C2CCCC2=C1 DY547221 [0,1,0,1,0,0|2,0,0]=4 1181 B12R2.315 COC1=C2NCCC2=CC=C1 DY549339 [0,1,0,1,0,0|1,0,0]=3 1182 B12R2.315 ClCC1=C2NN=CC2=CC=C1 DY581937 [0,1,0,1,0,0|1,0,1]=4 1183 B12R2.315 O=CC1=CC=CC2=C1CCC2 DY744601 [0,1,0,1,0,0|2,0,0]=4 1184 B12R2.100 CC1=C(Cl)C=C2C=CNC2=C1 NO10342 [0,1,0,1,0,0|0,0,2]=4 1185 B12R2.100 CC1=C(Cl)C=C2C=NNC2=C1 DY762854 [0,1,0,1,0,0|1,0,1]=4 1186 B12R2.100 CC1=C(Cl)C=C2CCNC2=C1 DY630376 [0,1,0,1,0,0|0,0,0]=2 1187 B12R2.100 ClC1=C(Br)C=C2NC=CC2=C1 NO16087 [0,1,0,1,0,0|0,0,2]=4 1188 B12R2.100 ClC1=C(Br)C=C2NN=CC2=C1 NO17929 [0,1,0,1,0,0|1,0,1]=4 1189 B12R2.100 ClC1=C(Cl)C=C2NC=CC2=C1 NO12279 [0,1,0,1,0,0|0,0,2]=4 1190 B12R2.100 ClC1=CC2=C(C=C1Br)OCO2 NO16791 [0,1,0,1,0,0|2,0,0]=4 1191 B12R2.100 FC1=C(Cl)C=C2C=CNC2=C1 NO10341 [0,1,0,1,0,0|0,0,2]=4 1192 B12R2.100 FC1=C(F)C=C2NCCC2=C1 NO12554 [0,1,0,1,0,0|0,1,0]=3 1193 B12R2.100 NC1=C(Cl)C=C2C=CNC2=C1 DY576453 [0,1,0,1,0,0|0,0,2]=4 1194 B8R1.1 CCC1=CC(C)=CS1 DY447443 [1,0,0,0,1,0|2,0,0]=4 1195 B8R1.1 ClCC1=CC=C(Cl)S1 NO17500 [1,0,0,0,1,0|2,0,0]=4 1196 B8R1.1 NCC1=CC=C(Br)O1 DY432586 [1,0,0,0,1,0|1,1,0]=4 1197 B8R1.1 NCC1=CC=C(Br)O1 DY759704 [1,0,0,0,1,0|1,1,0]=4 1198 B8R1.1 NCC1=CN=C(Cl)S1 NO12616 [1,0,0,0,1,0|2,0,0]=4 1199 B8R1.1 NCC1=CN=C(Cl)S1 NO19827 [1,0,0,0,1,0|2,0,0]=4 1200 B8R1.11 CC1=C(CN)SC=C1 DY609391 [1,0,0,0,1,0|2,0,0]=4 1201 B8R1.11 CN1C=CC=C1CN DY717975 [1,0,0,0,1,0|2,0,0]=4 1202 B8R1.11 ClC1=C(CBr)C=CS1 NO14290 [1,0,0,0,1,0|2,0,0]=4 1203 B8R1.11 OCC1=C(Cl)C=CS1 DY536271 [1,0,0,0,1,0|2,0,0]=4 1204 B8R1.8 NCCC1=CC=CN1 DY717219 [1,0,0,0,1,0|1,0,0]=3 1205 B8R1.8 NCCC1=CN=CS1 DY785962 [1,0,0,0,1,0|2,0,0]=4 1206 B8R1.8 NCCC1=CNC=N1 DY557493 [1,0,0,0,1,0|2,0,0]=4 1207 B8R1.8 NCCC1=CNC=N1 NO18264 [1,0,0,0,1,0|2,0,0]=4 1208 B8R1.8 NCCC1=CSC=C1 NO22098 [1,0,0,0,1,0|1,0,0]=3 1209 B8R1.8 NCCC1=NC=CN1 DY725263 [1,0,0,0,1,0|2,0,0]=4 1210 B8R1.8 NCCN1C=CC=N1 DY501807 [1,0,0,0,1,0|2,0,0]=4 1211 B8R1.8 NNCC1=CC=CS1 DY607641 [1,0,0,0,1,0|2,0,0]=4 1212 B8R1.8 OCCC1=CC=CS1 NO14939 [1,0,0,0,1,0|2,0,0]=4 1213 B8R1.8 OCCC1=CSC=C1 NO20858 [1,0,0,0,1,0|2,0,0]=4