0 B12R1.286 COC1=C(Br)C=CC(CC#N)=C1 DY584398 [0,0,0,0,0,0|2,0,2]=4 1 B12R1.286 COC1=C(C)C=CC(CC#N)=C1 NO22339 [0,0,0,0,0,0|2,0,2]=4 2 B12R1.286 C\C=C\c1ccc(O)c(OC)c1 DY580665 [0,0,0,0,0,0|0,0,0]=0 3 B11R1.189 COC1=CC=CC(CC#N)=C1 NO11040 [1,0,0,0,0,0|1,0,2]=4 4 B11R1.189 COC1=CC=CC(CCN)=C1 NO13916 [1,0,0,0,0,0|1,0,2]=4 5 B11R1.189 COC1=CC=CC(CCO)=C1 NO22342 [1,0,0,0,0,0|1,0,2]=4 6 B11R1.189 COC1=CC=CC(N=C=S)=C1 DY794235 [1,0,0,0,0,0|2,0,1]=4 7 B11R1.192 CNCC1=CC=C(O)C(O)=C1 DY502761 [1,0,0,0,0,0|1,0,1]=3 8 B11R1.192 NCCC1=CC=C(O)C(O)=C1 NO15345 [1,0,0,0,0,0|1,0,2]=4 9 B11R1.192 O=CCC1=CC(O)=C(O)C=C1 DY745117 [1,0,0,0,0,0|1,0,1]=3 10 B11R1.280 C=CC1=CC(OC)=C(O)C=C1 NO21640 [1,0,0,0,0,0|0,0,0]=1 11 B11R1.280 COC1=C(Br)C=CC(CO)=C1 NO21375 [1,0,0,0,0,0|2,0,1]=4 12 B11R1.280 COC1=C(C)C=CC(C#N)=C1 NO22338 [1,0,0,0,0,0|2,0,1]=4 13 B11R1.280 COC1=C(C)C=CC(C=O)=C1 NO21938 [1,0,0,0,0,0|2,0,0]=3 14 B11R1.280 COC1=C(Cl)C=CC(C=O)=C1 NO15135 [1,0,0,0,0,0|2,0,0]=3 15 B11R1.280 COC1=C(Cl)C=CC(CO)=C1 NO17422 [1,0,0,0,0,0|2,0,1]=4 16 B11R1.280 COC1=C(F)C=CC(C#N)=C1 DY30271 [1,0,0,0,0,0|2,0,1]=4 17 B11R1.280 COC1=C(F)C=CC(SC)=C1 DY448666 [1,0,0,0,0,0|2,0,0]=3 18 B11R1.280 COC1=C(N)C=CC(C#N)=C1 NO14461 [1,0,0,0,0,0|2,0,1]=4 19 B11R1.280 COC1=C(O)C=CC(C=O)=C1 NO13553 [1,0,0,0,0,0|1,0,0]=2 20 B11R1.280 COC1=C(O)C=CC(CN)=C1 NO22873 [1,0,0,0,0,0|1,0,1]=3 21 B11R1.280 COC1=CC(C=O)=C(O)C=C1 NO20949 [1,0,0,0,0,0|3,0,0]=4 22 B11R1.280 COC1=CC(OC)=C(O)C=C1 NO21112 [1,0,0,0,0,0|1,0,0]=2 23 B11R1.280 COC1=CC(OC)=C(S)C=C1 DY788073 [1,0,0,0,0,0|1,1,0]=3 24 B11R1.280 COC1=CC(OC)=NC=C1Br DY558477 [1,0,0,0,0,0|3,0,0]=4 25 B11R1.280 COC1=CC(SC)=C(F)C=C1 DY452104 [1,0,0,0,0,0|2,1,0]=4 26 B11R1.280 COC1=CC=C(N)C(OC)=N1 NO13926 [1,0,0,0,0,0|3,0,0]=4 27 B13R1.49 CCC(=O)C1=CC(OC)=C(O)C=C1 NO22875 [0,1,0,0,0,0|0,0,1]=2 28 B13R1.49 CCC1=C(Cl)C=CC(C(=O)OC)=C1 DY450130 [0,1,0,0,0,0|3,0,0]=4 29 B13R1.49 CNC1=C(N)C=CC(C(=O)OC)=C1 NO16777 [0,1,0,0,0,0|3,0,0]=4 30 B13R1.49 COC(=O)C1=CC(OC)=C(Br)C=C1 NO11640 [0,1,0,0,0,0|2,0,0]=3 31 B13R1.49 COC(=O)C1=CC(OC)=C(C)C=C1 NO11629 [0,1,0,0,0,0|2,0,0]=3 32 B13R1.49 COC(=O)C1=CC(OC)=C(F)C=C1 DY450142 [0,1,0,0,0,0|2,0,0]=3 33 B13R1.49 COC(=O)C1=CC(OC)=C(N)C=C1 NO10901 [0,1,0,0,0,0|2,0,0]=3 34 B13R1.49 COC(=O)C1=CC(OC)=C(O)C=C1 NO21130 [0,1,0,0,0,0|1,0,0]=2 35 B13R1.49 COC(=O)C1=NC=C(Br)C(OC)=C1 DY431901 [0,1,0,0,0,0|3,0,0]=4 36 B13R1.52 CC(=O)CC1=CC(CBr)=C(O)C=C1 DY747499 [0,1,0,0,0,0|2,0,1]=4 37 B13R1.52 CC(=O)CC1=CC(CCl)=C(O)C=C1 DY747505 [0,1,0,0,0,0|2,0,1]=4 38 B13R1.52 COC1=C(C)C=CC(CC(=O)O)=C1 DY584674 [0,1,0,0,0,0|2,0,1]=4 39 B13R1.52 COC1=C(F)C=CC(CC(=O)O)=C1 NO19593 [0,1,0,0,0,0|2,0,1]=4 40 B13R1.386 COC1=C(OC)C=C(CC#N)C=C1 NO16297 [0,1,0,0,0,0|1,0,2]=4 41 B13R1.386 COC1=C(OC)C=C(CC=O)C=C1 NO20165 [0,1,0,0,0,0|1,0,1]=3 42 B13R1.386 COC1=C(OC)C=C(CCN)C=C1 DY460524 [0,1,0,0,0,0|1,0,2]=4 43 B13R1.386 COC1=C(OC)C=C(CCO)C=C1 DY10303 [0,1,0,0,0,0|1,0,2]=4 44 B13R1.386 COC1=CC(\C=N\O)=CN=C1OC DY507584 [0,1,0,0,0,0|3,0,0]=4 45 B13R1.575 COC1=C(O)C=CC(\C=C\CO)=C1 DY555423 [0,1,0,0,0,0|0,0,0]=1 46 B13R1.4030 COC1=CC(CC#N)=CC(Br)=C1O DY798297 [0,1,0,0,0,0|1,0,2]=4 47 B13R2.449 Br\C=C\C1=CC2=C(C=C1)OCO2 DY751033 [0,0,0,1,0,0|1,0,0]=2 48 B13R2.449 CNCC1=CC2=C(C=C1)OCO2 DY610535 [0,0,0,1,0,0|1,0,1]=3 49 B13R2.449 N#CCC1=CC2=C(C=C1)OCO2 DY40784 [0,0,0,1,0,0|1,0,2]=4 50 B13R2.599 COC1=C(Br)C=C2NC=CC2=C1 NO15247 [0,0,0,1,0,0|2,0,0]=3 51 B13R2.599 COC1=C(Cl)C=C2C=CNC2=C1 DY579015 [0,0,0,1,0,0|2,0,1]=4 52 B13R2.599 COC1=C(N)C=C2NC=CC2=C1 DY726733 [0,0,0,1,0,0|2,0,0]=3 53 B13R2.599 COC1=CC2=C(C=C1Br)N=CN2 NO16251 [0,0,0,1,0,0|3,0,0]=4 54 B10R1.10 CC#CC1=CC=CC(C)=C1 DY788763 [2,0,0,0,0,0|0,0,2]=4 55 B10R1.172 C=CC1=CC=CC(CCl)=C1 DY822035 [2,0,0,0,0,0|2,0,0]=4 56 B10R1.172 CCC1=CC=CC(C=O)=C1 NO11688 [2,0,0,0,0,0|2,0,0]=4 57 B10R1.172 CNC1=NC=CC(OC)=C1 DY714716 [2,0,0,0,0,0|2,0,0]=4 58 B10R1.172 COC1=CC(OC)=NC=C1 NO18092 [2,0,0,0,0,0|2,0,0]=4 59 B10R1.172 COC1=CC=CC(C=O)=C1 NO19170 [2,0,0,0,0,0|1,0,0]=3 60 B10R1.172 COC1=CC=CC(C=O)=N1 NO20321 [2,0,0,0,0,0|2,0,0]=4 61 B10R1.172 COC1=CC=CC(CBr)=C1 DY576513 [2,0,0,0,0,0|1,0,1]=4 62 B10R1.172 COC1=CC=CC(CCl)=C1 DY10324 [2,0,0,0,0,0|1,0,1]=4 63 B10R1.172 COC1=CC=CC(CN)=C1 NO19097 [2,0,0,0,0,0|1,0,1]=4 64 B10R1.172 COC1=CC=CC(CO)=C1 NO19269 [2,0,0,0,0,0|1,0,1]=4 65 B10R1.172 COC1=CC=CC(NN)=C1 NO19580 [2,0,0,0,0,0|2,0,0]=4 66 B10R1.172 COC1=CC=CC(OC)=C1 NO19845 [2,0,0,0,0,0|1,0,0]=3 67 B10R1.172 COC1=CN=CC(C=O)=C1 NO17827 [2,0,0,0,0,0|2,0,0]=4 68 B10R1.172 COC1=CN=CC(OC)=C1 NO17332 [2,0,0,0,0,0|2,0,0]=4 69 B10R1.172 COC1=NC=CC(C=O)=C1 NO15775 [2,0,0,0,0,0|2,0,0]=4 70 B10R1.1 CCOC1=CC=C(O)C=C1 DY563859 [2,0,0,0,0,0|1,0,1]=4 71 B10R1.176 C=CC1=CC(F)=C(F)C=C1 NO19052 [2,0,0,0,0,0|2,0,0]=4 72 B10R1.176 CC1=C(Br)C=CC(C=O)=C1 NO22664 [2,0,0,0,0,0|2,0,0]=4 73 B10R1.176 CC1=C(Cl)C=CC(C=O)=C1 DY433419 [2,0,0,0,0,0|2,0,0]=4 74 B10R1.176 CC1=C(O)C=CC(C#N)=C1 NO17416 [2,0,0,0,0,0|1,0,1]=4 75 B10R1.176 CC1=C(O)C=CC(C=O)=C1 NO20934 [2,0,0,0,0,0|1,0,0]=3 76 B10R1.176 CC1=C(O)C=CC(CN)=C1 DY445599 [2,0,0,0,0,0|1,0,1]=4 77 B10R1.176 CCC1=CC(C)=C(I)C=C1 DY575811 [2,0,0,0,0,0|1,0,1]=4 78 B10R1.176 CCC1=CC(O)=C(Cl)C=C1 DY432619 [2,0,0,0,0,0|1,0,1]=4 79 B10R1.176 CCC1=CC(O)=C(N)C=C1 NO16266 [2,0,0,0,0,0|1,0,1]=4 80 B10R1.176 COC1=CC(C)=C(N)C=C1 NO13421 [2,0,0,0,0,0|2,0,0]=4 81 B10R1.176 COC1=CC(C)=C(O)C=C1 NO15470 [2,0,0,0,0,0|1,0,0]=3 82 B10R1.176 COC1=CC(Cl)=C(O)C=C1 NO20293 [2,0,0,0,0,0|2,0,0]=4 83 B10R1.176 COC1=CC(N)=C(O)C=C1 NO21254 [2,0,0,0,0,0|2,0,0]=4 84 B10R1.176 COC1=CC(O)=C(Br)C=C1 NO21376 [2,0,0,0,0,0|2,0,0]=4 85 B10R1.176 COC1=CC(O)=C(Cl)C=C1 DY442395 [2,0,0,0,0,0|2,0,0]=4 86 B10R1.176 COC1=CC(O)=C(N)C=C1 NO21584 [2,0,0,0,0,0|2,0,0]=4 87 B10R1.176 COC1=CC=C(O)C(C)=N1 DY661236 [2,0,0,0,0,0|2,0,0]=4 88 B10R1.176 N#CC1=CC(O)=C(O)C=C1 DY20147 [2,0,0,0,0,0|1,0,1]=4 89 B10R1.176 O=CC1=CC(Br)=C(O)C=C1 DY20184 [2,0,0,0,0,0|2,0,0]=4 90 B10R1.176 O=CC1=CC(F)=C(O)C=C1 NO10367 [2,0,0,0,0,0|2,0,0]=4 91 B10R1.176 O=CC1=CC(O)=C(Cl)C=C1 NO15259 [2,0,0,0,0,0|2,0,0]=4 92 B10R1.176 O=CC1=CC(O)=C(F)C=C1 DY41115 [2,0,0,0,0,0|2,0,0]=4 93 B10R1.176 O=CC1=CC(O)=C(I)C=C1 DY584669 [2,0,0,0,0,0|2,0,0]=4 94 B10R1.176 O=CC1=CC(O)=C(O)C=C1 NO18720 [2,0,0,0,0,0|1,0,0]=3 95 B10R1.30 CCC1=NC(C)=CC=C1O NO13984 [2,0,0,0,0,0|2,0,0]=4 96 B10R1.30 COC1=C(Br)C=CC(Br)=C1 NO12737 [2,0,0,0,0,0|2,0,0]=4 97 B10R1.30 COC1=C(Br)C=CC(C)=C1 DY20209 [2,0,0,0,0,0|1,0,0]=3 98 B10R1.30 COC1=C(Br)C=CC(Cl)=C1 NO21371 [2,0,0,0,0,0|2,0,0]=4 99 B10R1.30 COC1=C(Br)C=CC(F)=C1 NO10394 [2,0,0,0,0,0|2,0,0]=4 100 B10R1.30 COC1=C(Br)C=CC(N)=C1 NO18102 [2,0,0,0,0,0|2,0,0]=4 101 B10R1.30 COC1=C(Cl)C=CC(C)=C1 DY456622 [2,0,0,0,0,0|1,0,0]=3 102 B10R1.30 COC1=C(Cl)C=CC(I)=C1 DY20290 [2,0,0,0,0,0|2,0,0]=4 103 B10R1.30 COC1=C(Cl)C=CC(N)=C1 NO22759 [2,0,0,0,0,0|2,0,0]=4 104 B10R1.30 COC1=C(F)C=CC(Br)=C1 NO19804 [2,0,0,0,0,0|2,0,0]=4 105 B10R1.30 COC1=C(F)C=CC(I)=C1 DY571347 [2,0,0,0,0,0|2,0,0]=4 106 B10R1.30 COC1=C(F)C=CC(N)=C1 NO10516 [2,0,0,0,0,0|2,0,0]=4 107 B10R1.30 COC1=C(I)C=CC(Cl)=C1 DY20291 [2,0,0,0,0,0|2,0,0]=4 108 B10R1.30 COC1=C(N)C=CC(Br)=C1 NO19178 [2,0,0,0,0,0|2,0,0]=4 109 B10R1.30 COC1=C(N)C=CC(F)=C1 NO12096 [2,0,0,0,0,0|2,0,0]=4 110 B10R1.30 COC1=C(N)C=CC(I)=C1 DY21014 [2,0,0,0,0,0|2,0,0]=4 111 B10R1.30 COC1=C(N)C=CC(N)=C1 NO21132 [2,0,0,0,0,0|2,0,0]=4 112 B10R1.30 COC1=C(O)C=CC(Br)=C1 NO22682 [2,0,0,0,0,0|1,0,0]=3 113 B10R1.30 COC1=C(O)C=CC(C)=C1 NO16322 [2,0,0,0,0,0|0,0,0]=2 114 B10R1.30 COC1=CC(C)=CN=C1O DY657387 [2,0,0,0,0,0|1,0,0]=3 115 B10R1.30 COC1=NC(C)=CC=C1Br NO19284 [2,0,0,0,0,0|2,0,0]=4 116 B12R1.278 CCOC1=CC=CC(CNC)=C1 DY614616 [1,1,0,0,0,0|1,0,1]=4 117 B12R1.280 COC1=CC=CC(\C=N\O)=C1O DY745705 [1,1,0,0,0,0|2,0,0]=4 118 B12R1.280 COCC1=CC=CC(OC)=C1Br DY449290 [1,1,0,0,0,0|1,0,1]=4 119 B12R1.435 CCC(=O)C1=CC(OC)=CC=C1 NO22346 [1,1,0,0,0,0|0,0,1]=3 120 B12R1.435 COC(=O)C1=CC(OC)=NC=C1 NO11608 [1,1,0,0,0,0|2,0,0]=4 121 B12R1.435 COC1=CC=CC(C(=O)CBr)=C1 NO11021 [1,1,0,0,0,0|1,0,1]=4 122 B12R1.438 COC1=CC=CC(CC(=O)Cl)=C1 DY584620 [1,1,0,0,0,0|1,0,1]=4 123 B12R1.438 COC1=CC=CC(CC(C)=O)=C1 NO22343 [1,1,0,0,0,0|0,0,1]=3 124 B12R1.19 CC1=C(O)C=CC(CC(=O)O)=C1 DY584932 [1,1,0,0,0,0|1,0,1]=4 125 B12R1.19 O=C(O)CC1=CC(O)=C(O)C=C1 NO20953 [1,1,0,0,0,0|1,0,1]=4 126 B12R1.367 COC(=O)C1=CC(Br)=C(O)C=C1 NO13829 [1,1,0,0,0,0|2,0,0]=4 127 B12R1.367 COC(=O)C1=CC(C)=C(Br)C=C1 NO13733 [1,1,0,0,0,0|2,0,0]=4 128 B12R1.367 COC(=O)C1=CC(C)=C(Cl)C=C1 NO11642 [1,1,0,0,0,0|2,0,0]=4 129 B12R1.367 COC(=O)C1=CC(C)=C(F)C=C1 NO13467 [1,1,0,0,0,0|2,0,0]=4 130 B12R1.367 COC(=O)C1=CC(I)=C(O)C=C1 NO11645 [1,1,0,0,0,0|2,0,0]=4 131 B12R1.367 COC(=O)C1=CC(N)=C(O)C=C1 NO11617 [1,1,0,0,0,0|2,0,0]=4 132 B12R1.367 COC(=O)C1=CC(O)=C(Br)C=C1 NO11639 [1,1,0,0,0,0|2,0,0]=4 133 B12R1.367 COC(=O)C1=CC(O)=C(Cl)C=C1 NO15706 [1,1,0,0,0,0|2,0,0]=4 134 B12R1.367 COC(=O)C1=CC(O)=C(I)C=C1 NO11687 [1,1,0,0,0,0|2,0,0]=4 135 B12R1.367 COC(=O)C1=CC(O)=C(N)C=C1 NO21024 [1,1,0,0,0,0|2,0,0]=4 136 B12R1.367 COC(=O)C1=CC(O)=C(O)C=C1 NO20955 [1,1,0,0,0,0|1,0,0]=3 137 B12R1.367 COC(=O)C1=NC=C(O)C(C)=C1 DY511803 [1,1,0,0,0,0|2,0,0]=4 138 B12R1.367 COC(=O)c1ccc(O)c(C)c1 DY584287 [1,1,0,0,0,0|1,0,0]=3 139 B12R1.367 NCC(=O)C1=CC(O)=C(O)C=C1 DY461310 [1,1,0,0,0,0|1,0,1]=4 140 B12R1.56 COC1=C(Br)C=CC(C(=O)O)=C1 NO22663 [1,1,0,0,0,0|2,0,0]=4 141 B12R1.56 COC1=C(Br)C=CC(C(N)=O)=C1 DY532143 [1,1,0,0,0,0|2,0,0]=4 142 B12R1.56 COC1=C(C)C=CC(C(=O)O)=C1 NO21939 [1,1,0,0,0,0|2,0,0]=4 143 B12R1.56 COC1=C(C)C=CC(C(C)=O)=C1 DY584953 [1,1,0,0,0,0|1,0,0]=3 144 B12R1.56 COC1=C(Cl)C=CC(C(=O)O)=C1 NO20832 [1,1,0,0,0,0|2,0,0]=4 145 B12R1.56 COC1=C(F)C=CC(C(=O)O)=C1 NO16067 [1,1,0,0,0,0|2,0,0]=4 146 B12R1.56 COC1=C(F)C=CC([C@H](C)N)=C1 DY576201 [1,1,0,0,0,0|1,0,1]=4 147 B12R1.56 COC1=C(I)C=CC(C(=O)O)=C1 DY584570 [1,1,0,0,0,0|2,0,0]=4 148 B12R1.56 COC1=C(N)C=CC(C(=O)O)=C1 NO21016 [1,1,0,0,0,0|2,0,0]=4 149 B12R1.56 COC1=C(N)C=CC(C(C)O)=C1 DY746539 [1,1,0,0,0,0|1,0,1]=4 150 B12R1.56 COC1=C(N)C=CC(N(C)C)=C1 DY745891 [1,1,0,0,0,0|2,0,0]=4 151 B12R1.56 COC1=C(O)C=CC(C(=O)O)=C1 NO20951 [1,1,0,0,0,0|1,0,0]=3 152 B12R1.56 COC1=C(O)C=CC(C(C)=O)=C1 NO14549 [1,1,0,0,0,0|0,0,0]=2 153 B12R1.56 COC1=C(O)C=CC([C@@H](C)N)=C1 DY518919 [1,1,0,0,0,0|0,0,1]=3 154 B12R1.56 COC1=C(O)C=CC([N+](=O)[O-])=C1 NO20340 [1,1,0,0,0,0|2,0,0]=4 155 B12R1.78 COC1=C(OC)C=C(C=O)C=C1 DY10449 [1,1,0,0,0,0|1,0,0]=3 156 B12R1.78 COC1=C(OC)C=C(CBr)C=C1 NO21945 [1,1,0,0,0,0|1,0,1]=4 157 B12R1.78 COC1=C(OC)C=C(CCl)C=C1 DY10289 [1,1,0,0,0,0|1,0,1]=4 158 B12R1.78 COC1=C(OC)C=C(CO)C=C1 NO19420 [1,1,0,0,0,0|1,0,1]=4 159 B12R1.78 COC1=C(OC)N=C(C=O)C=C1 DY431779 [1,1,0,0,0,0|2,0,0]=4 160 B12R1.78 COC1=CC(OC)=C(C=O)C=C1 NO15286 [1,1,0,0,0,0|1,0,1]=4 161 B12R1.78 COC1=CC(OC)=C(CCl)C=C1 DY10526 [1,1,0,0,0,0|2,0,0]=4 162 B12R1.78 COC1=CC(OC)=C(CN)C=C1 DY538965 [1,1,0,0,0,0|2,0,0]=4 163 B12R1.78 COC1=CC(OC)=C(CN)C=C1 NO15120 [1,1,0,0,0,0|2,0,0]=4 164 B12R1.78 COC1=CC(OC)=C(CO)C=C1 NO21200 [1,1,0,0,0,0|1,0,0]=3 165 B12R1.78 COC1=CC(OC)=C(OC)C=C1 NO18710 [1,1,0,0,0,0|1,0,0]=3 166 B12R1.300 COC1=CC(C=O)=CC(F)=C1O NO20848 [1,1,0,0,0,0|1,0,0]=3 167 B12R1.300 COC1=CC(F)=C(Br)C(OC)=C1 DY20136 [1,1,0,0,0,0|2,0,0]=4 168 B12R1.300 COC1=CC(O)=C(Cl)C(OC)=C1 DY533457 [1,1,0,0,0,0|2,0,0]=4 169 B12R1.449 COC1=CC(C=O)=C(Br)C=C1F DY575637 [1,1,0,0,0,0|2,0,0]=4 170 B12R1.449 COC1=CC(OC)=C(Br)C=C1Cl DY449788 [1,1,0,0,0,0|2,0,0]=4 171 B12R1.453 COC1=CC(C(C)=O)=C(O)C=C1 DY446638 [1,1,0,0,0,0|2,0,0]=4 172 B12R1.654 COC1=C(Br)C=CC(C=O)=C1O DY585702 [1,1,0,0,0,0|2,0,0]=4 173 B12R1.654 COC1=C(O)C=CC(C=O)=C1N DY578607 [1,1,0,0,0,0|1,0,0]=3 174 B12R1.654 COC1=C(O)C=CC(C=O)=C1O DY562071 [1,1,0,0,0,0|1,0,0]=3 175 B14R1.626 COC1=C(N)C=CC(C(=O)CCCl)=C1 DY749407 [0,2,0,0,0,0|1,0,1]=4 176 B14R1.1864 COC(=O)C1=CC(OC)=C(C=O)C=C1 DY433695 [0,2,0,0,0,0|1,0,1]=4 177 B14R1.1864 COC(=O)C1=CC(OC)=C(CBr)C=C1 DY568059 [0,2,0,0,0,0|2,0,0]=4 178 B14R1.1864 COC1=C(OC)C=C(C(=O)C=O)C=C1 NO21946 [0,2,0,0,0,0|1,0,0]=3 179 B14R1.3405 COC(=O)CC1=CC(OC)=C(Br)C=C1 DY430369 [0,2,0,0,0,0|1,0,1]=4 180 B14R1.3405 COC(=O)CC1=CC(OC)=C(F)C=C1 DY585023 [0,2,0,0,0,0|1,0,1]=4 181 B14R1.3651 COC1=C(OC)C=C(CC(=O)O)C=C1 NO16307 [0,2,0,0,0,0|1,0,1]=4 182 B14R1.3651 COC1=C(OC)C=C(CC(C)=O)C=C1 DY571455 [0,2,0,0,0,0|0,0,1]=3 183 B14R1.3651 COC1=C(OC)C=C(CC(N)=O)C=C1 DY560847 [0,2,0,0,0,0|1,0,1]=4 184 B14R1.6787 CCOC1=C(OC)C=CC(CNC)=C1 DY612719 [0,2,0,0,0,0|1,0,1]=4 185 B14R1.3237 CCOC1=CC(OC)=C(OC)C(F)=C1 DY748255 [0,2,0,0,0,0|1,0,1]=4 186 B14R1.42 COC1=C(F)C=CC(\C=C\C(=O)O)=C1 DY585177 [0,2,0,0,0,0|1,0,1]=4 187 B14R1.42 COC1=C(O)C=CC(\C=C\C(=O)O)=C1 NO11068 [0,2,0,0,0,0|0,0,1]=3 188 B14R1.42 COC1=C(O)C=CC(\C=C\[N+](=O)[O-])=C1 DY563631 [0,2,0,0,0,0|1,0,0]=3 189 B14R1.3236 C=CCC1=CC(C=O)=C(O)C(OC)=C1 DY793239 [0,2,0,0,0,0|0,0,2]=4 190 B12R1.450 COC1=CC(Br)=C(C=O)C=C1O NO10777 [0,0,1,1,0,0|2,0,0]=4 191 B12R1.450 COc1cc(Br)c(OC)cc1O DY452902 [0,0,1,1,0,0|2,0,0]=4 192 B12R2.44 COC1=CC2=C(C=C1)N=CS2 NO10718 [1,0,0,1,0,0|2,0,0]=4 193 B12R2.44 COC1=CC2=C(C=C1)ON=C2 NO10418 [1,0,0,1,0,0|2,0,0]=4 194 B12R2.44 COC1=CC2=C(C=CO2)C=C1 NO16497 [1,0,0,1,0,0|1,0,1]=4 195 B12R2.44 COC1=CC2=C(C=CS2)C=C1 NO16120 [1,0,0,1,0,0|1,0,1]=4 196 B12R2.44 COC1=CC2=CON=C2C=C1 DY751801 [1,0,0,1,0,0|2,0,0]=4 197 B12R2.44 COC1=CC=C2C=CNC2=C1 DY20057 [1,0,0,1,0,0|1,0,1]=4 198 B12R2.44 COC1=CC=C2CCNC2=C1 DY20447 [1,0,0,1,0,0|1,0,1]=4 199 B12R2.44 COC1=CC=C2CNCC2=C1 NO12707 [1,0,0,1,0,0|1,0,1]=4 200 B12R2.44 COC1=CC=C2NC=CC2=N1 NO18048 [1,0,0,1,0,0|2,0,0]=4 201 B12R2.44 COC1=CN2C=CN=C2C=C1 NO16254 [1,0,0,1,0,0|2,0,0]=4 202 B12R2.315 COC1=C2C=CNC2=CC=C1 NO21717 [1,0,0,1,0,0|1,0,1]=4 203 B12R2.315 COC1=C2CCNC2=CC=C1 DY570405 [1,0,0,1,0,0|1,0,1]=4 204 B12R2.315 COC1=C2CNCC2=CC=C1 NO17395 [1,0,0,1,0,0|1,0,1]=4 205 B12R2.315 COC1=CC=CC2=C1N=CS2 DY752107 [1,0,0,1,0,0|2,0,0]=4 206 B12R2.315 COC1=CC=CC2=C1NC=N2 DY545673 [1,0,0,1,0,0|2,0,0]=4 207 B12R2.315 COC1=CC=CC2=C1OC=C2 NO21625 [1,0,0,1,0,0|1,0,0]=3 208 B12R2.82 CC1=CC=C2C=CNC2=C1C DY727339 [1,0,0,1,0,0|2,0,0]=4 209 B12R2.100 CC1=C(Br)C=C2NC=CC2=C1 NO10653 [1,0,0,1,0,0|2,0,0]=4 210 B12R2.100 CC1=C(F)C=C2NC=CC2=C1 DY528891 [1,0,0,1,0,0|2,0,0]=4 211 B12R2.100 CC1=C(O)C=C2NN=CC2=C1 DY505371 [1,0,0,1,0,0|2,0,0]=4 212 B14R2.1008 O=C(O)Cc1ccc2c(c1)OCO2 DY40183 [0,1,0,1,0,0|1,0,1]=4 213 B14R2.82 COC1=CC2=CNC=C2C=C1OC DY727783 [0,1,0,1,0,0|1,0,1]=4 214 B14R2.82 COC1=CC2=CON=C2C=C1OC DY751783 [0,1,0,1,0,0|2,0,0]=4 215 B14R2.991 CCNCC1=CC2=C(C=C1)OCO2 DY684091 [0,1,0,1,0,0|0,0,2]=4 216 B14R2.991 COCOC1=CC2=C(C=C1)OCO2 DY506885 [0,1,0,1,0,0|1,0,1]=4 217 B14R2.991 OCCNC1=CC2=C(C=C1)OCO2 DY671883 [0,1,0,1,0,0|1,0,1]=4 218 B14R2.991 OCCNC1=CC2=C(C=C1)OCO2 NO20819 [0,1,0,1,0,0|1,0,1]=4 219 B14R2.1128 COC1=C(N)C=C2N=CN=CC2=C1 DY783208 [0,1,0,1,0,0|2,0,0]=4 220 B14R2.1128 COC1=C(O)C=C2N=CC=NC2=C1 DY784300 [0,1,0,1,0,0|1,0,0]=3 221 B14R3.3046 C1=C2CNCC2=C3OCOC3=C1 DY680096 [0,0,0,2,0,0|1,0,1]=4 222 B14R3.3015 C1=CC2=C(C=C1C3CN3)OCO2 DY743989 [0,0,0,2,0,0|1,0,1]=4 223 B14R3.3022 C1=C2OCOC2=CC3=C1CNC3 DY678435 [0,0,0,2,0,0|1,0,1]=4 224 B14R3.3022 C1=NNC2=CC3=C(C=C12)OCO3 DY670480 [0,0,0,2,0,0|2,0,0]=4