0 B11R1.279 C(=O)C1=CC=C(OC)C(O)=C1 SBB008245 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.279 COC1=C(O)C=C(CN)C=C1 SBB012609 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.279 COC1=CC(F)=C(CBr)C=C1 SBB095704 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.279 COC1=CC(F)=C(OC)C=C1 SBB087138 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.279 COC1=CC(N)=C(OC)C=C1 SBB007581 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.279 COC1=CC(S)=C(OC)C=C1 SBB058944 [0,0,0,0,0,0|2,1,0]=3 6 B11R1.279 COC1=CC=C(C#N)C(F)=C1 SBB055495 [0,0,0,0,0,0|2,0,1]=3 7 B11R1.279 COC1=CC=C(C#N)C=C1O SBB013384 [0,0,0,0,0,0|4,0,0]=4 8 B11R1.279 COC1=CC=C(C=O)C(F)=C1 SBB063771 [0,0,0,0,0,0|1,0,0]=1 9 B11R1.279 COC1=CC=C(C=O)C(O)=C1 SBB063106 [0,0,0,0,0,0|0,0,0]=0 10 B11R1.279 COC1=CC=C(CO)C(F)=C1 SBB064792 [0,0,0,0,0,0|1,0,2]=3 11 B11R1.279 COC1=CC=C(CO)C=C1O SBB064953 [0,0,0,0,0,0|4,0,0]=4 12 B11R1.279 COC1=CC=C(OC)C(Cl)=C1 SBB116863 [0,0,0,0,0,0|3,0,0]=3 13 B11R1.279 [NH3+]NC1=CC=C(OC)C=C1C SBB116868 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.3 C#CC1=CC=C(C=O)C=C1 SBB064928 [1,0,0,0,0,0|1,0,1]=3 15 B10R1.3 C#CC1=CC=C(OC)C=C1 SBB063612 [1,0,0,0,0,0|1,0,1]=3 16 B10R1.3 C(=O)C1=CC=C(C#N)C=C1 SBB008634 [1,0,0,0,0,0|2,0,0]=3 17 B10R1.3 C(=O)C1=CC=C(C=O)C=C1 SBB012343 [1,0,0,0,0,0|2,0,0]=3 18 B10R1.3 C=CC1=CC=C(C#N)C=C1 SBB017041 [1,0,0,0,0,0|3,0,0]=4 19 B10R1.3 CCC1=CC=C(C#N)C=C1 SBB059144 [1,0,0,0,0,0|2,0,1]=4 20 B10R1.3 CCC1=CC=C(C=O)C=C1 SBB040197 [1,0,0,0,0,0|1,0,0]=2 21 B10R1.3 CCC1=CC=C(CC)C=C1 SBB061169 [1,0,0,0,0,0|2,0,1]=4 22 B10R1.3 CCC1=CC=C(CN)C=C1 SBB017636 [1,0,0,0,0,0|2,0,1]=4 23 B10R1.3 CCC1=CC=C(NN)C=C1 SBB001777 [1,0,0,0,0,0|3,0,0]=4 24 B10R1.3 CCC1=CC=C(NN)C=C1 SBB064984 [1,0,0,0,0,0|3,0,0]=4 25 B10R1.3 CCC1=CC=C(OC)C=C1 SBB060457 [1,0,0,0,0,0|1,0,1]=3 26 B10R1.3 CNC1=CC=C(OC)C=C1 SBB072645 [1,0,0,0,0,0|2,0,0]=3 27 B10R1.3 CNC1=NC=C(C=O)C=N1 SBB303398 [1,0,0,0,0,0|3,0,0]=4 28 B10R1.3 COC1=CC=C(C#N)C=C1 SBB059484 [1,0,0,0,0,0|1,0,1]=3 29 B10R1.3 COC1=CC=C(C#N)C=N1 SBB055563 [1,0,0,0,0,0|2,0,1]=4 30 B10R1.3 COC1=CC=C(C=O)C=C1 SBB040224 [1,0,0,0,0,0|0,0,0]=1 31 B10R1.3 COC1=CC=C(C=O)C=N1 SBB052248 [1,0,0,0,0,0|1,0,0]=2 32 B10R1.3 COC1=CC=C(CBr)C=C1 SBB054916 [1,0,0,0,0,0|1,0,1]=3 33 B10R1.3 COC1=CC=C(CCl)C=C1 SBB040608 [1,0,0,0,0,0|1,0,1]=3 34 B10R1.3 COC1=CC=C(CN)C=C1 SBB040460 [1,0,0,0,0,0|1,0,1]=3 35 B10R1.3 COC1=CC=C(CO)C=C1 SBB063123 [1,0,0,0,0,0|0,0,2]=3 36 B10R1.3 COC1=CC=C(NN)C=C1 SBB012784 [1,0,0,0,0,0|2,0,0]=3 37 B10R1.3 COC1=CC=C(NN)C=C1 SBB063180 [1,0,0,0,0,0|2,0,0]=3 38 B10R1.3 COC1=CC=C(OC)C=C1 SBB060067 [1,0,0,0,0,0|2,0,0]=3 39 B10R1.3 COC1=NC=C(C=O)C=N1 SBB018979 [1,0,0,0,0,0|2,0,0]=3 40 B10R1.3 CSC1=CC=C(C#N)C=C1 SBB058371 [1,0,0,0,0,0|1,1,1]=4 41 B10R1.3 CSC1=CC=C(C=O)C=C1 SBB040212 [1,0,0,0,0,0|0,1,0]=2 42 B10R1.3 CSC1=CC=C(CN)C=C1 SBB017654 [1,0,0,0,0,0|1,1,1]=4 43 B10R1.3 CSC1=CC=C(CO)C=C1 SBB064786 [1,0,0,0,0,0|0,1,2]=4 44 B10R1.3 CSC1=NC=C(C=O)C=N1 SBB018978 [1,0,0,0,0,0|2,1,0]=4 45 B10R1.25 C(=O)C1=C(Cl)C=C(F)C=C1 SBB003983 [1,0,0,0,0,0|2,0,0]=3 46 B10R1.25 C(=O)C1=C(F)C=C(Cl)C=C1 SBB003985 [1,0,0,0,0,0|2,0,0]=3 47 B10R1.25 CC1=CC(C)=C(C=O)C=C1 SBB058778 [1,0,0,0,0,0|1,0,0]=2 48 B10R1.25 CC1=CC(C)=C(CCl)C=C1 SBB005790 [1,0,0,0,0,0|2,0,1]=4 49 B10R1.25 CC1=CC(C)=C(NN)C=C1 SBB017144 [1,0,0,0,0,0|3,0,0]=4 50 B10R1.25 CC1=CC(C)=C(NN)C=C1 SBB028155 [1,0,0,0,0,0|3,0,0]=4 51 B10R1.25 CC1=CC(Cl)=NC=C1C=O SBB069020 [1,0,0,0,0,0|3,0,0]=4 52 B10R1.25 CC1=CC(F)=C(CBr)C=C1 SBB093047 [1,0,0,0,0,0|2,0,1]=4 53 B10R1.25 CC1=CC(F)=C(CN)C=C1 SBB086083 [1,0,0,0,0,0|2,0,1]=4 54 B10R1.25 CC1=CC(F)=C(CO)C=C1 SBB086161 [1,0,0,0,0,0|1,0,2]=4 55 B10R1.25 CC1=CC(F)=CC=C1C=O SBB052157 [1,0,0,0,0,0|2,0,0]=3 56 B10R1.25 CC1=CC(N)=C(C#N)C=C1 SBB028138 [1,0,0,0,0,0|2,0,1]=4 57 B10R1.25 CC1=CC=C(C#N)C(C)=C1 SBB085784 [1,0,0,0,0,0|2,0,1]=4 58 B10R1.25 CC1=CC=C(C#N)C(Cl)=C1 SBB064366 [1,0,0,0,0,0|2,0,1]=4 59 B10R1.25 CC1=CC=C(C#N)C(F)=C1 SBB064084 [1,0,0,0,0,0|2,0,1]=4 60 B10R1.25 CC1=CC=C(C=O)C(Br)=C1 SBB064054 [1,0,0,0,0,0|1,0,0]=2 61 B10R1.25 CC1=CC=C(C=O)C(Cl)=C1 SBB052218 [1,0,0,0,0,0|1,0,0]=2 62 B10R1.25 CC1=CC=C(C=O)C(F)=C1 SBB063769 [1,0,0,0,0,0|1,0,0]=2 63 B10R1.25 CC1=CC=C(C=O)C(O)=C1 SBB052148 [1,0,0,0,0,0|0,0,0]=1 64 B10R1.25 CCC1=C(C)C=C(C)C=C1 SBB061315 [1,0,0,0,0,0|2,0,1]=4 65 B10R1.25 COC1=C(O)C=C(C)C=C1 SBB008267 [1,0,0,0,0,0|2,0,0]=3 66 B10R1.25 COC1=C(O)C=C(N)C=C1 SBB007884 [1,0,0,0,0,0|3,0,0]=4 67 B10R1.25 COC1=CC=C(C)C=C1C SBB061025 [1,0,0,0,0,0|3,0,0]=4 68 B10R1.25 COC1=CC=C(C)C=C1N SBB040483 [1,0,0,0,0,0|3,0,0]=4 69 B10R1.25 COC1=CC=C(Cl)C=C1O SBB055202 [1,0,0,0,0,0|3,0,0]=4 70 B10R1.25 CSC1=C(C)C=C(O)C=C1 SBB071462 [1,0,0,0,0,0|3,0,0]=4 71 B10R1.25 N#CC1=C(F)C=C(O)C=C1 SBB059247 [1,0,0,0,0,0|2,0,1]=4 72 B10R1.25 N#CC1=CC=C(O)C=C1Cl SBB055431 [1,0,0,0,0,0|2,0,1]=4 73 B10R1.25 O=CC1=C(Cl)C=C(O)C=C1 SBB004014 [1,0,0,0,0,0|1,0,0]=2 74 B10R1.25 O=CC1=CC=C(Br)C=C1F SBB063396 [1,0,0,0,0,0|2,0,0]=3 75 B10R1.25 O=CC1=CC=C(Br)C=C1O SBB052189 [1,0,0,0,0,0|1,0,0]=2 76 B10R1.25 O=CC1=CC=C(Cl)C=C1Cl SBB040230 [1,0,0,0,0,0|2,0,0]=3 77 B10R1.25 O=CC1=CC=C(Cl)C=C1O SBB052140 [1,0,0,0,0,0|1,0,0]=2 78 B10R1.25 O=CC1=CC=C(Cl)N=C1Cl SBB062767 [1,0,0,0,0,0|3,0,0]=4 79 B10R1.25 O=CC1=CC=C(F)C=C1Br SBB062999 [1,0,0,0,0,0|2,0,0]=3 80 B10R1.25 O=CC1=CC=C(F)C=C1F SBB063157 [1,0,0,0,0,0|2,0,0]=3 81 B10R1.25 O=CC1=CC=C(F)C=C1O SBB052162 [1,0,0,0,0,0|1,0,0]=2 82 B10R1.25 O=CC1=CC=C(O)C=C1F SBB065071 [1,0,0,0,0,0|1,0,0]=2 83 B10R1.25 O=CC1=CC=C(O)C=C1O SBB040226 [1,0,0,0,0,0|0,0,0]=1 84 B10R1.176 CCC1=CC(C)=C(C)C=C1 SBB061288 [1,0,0,0,0,0|2,0,1]=4 85 B10R1.176 CCC1=CC=C(O)C(N)=C1 SBB000071 [1,0,0,0,0,0|2,0,1]=4 86 B10R1.176 CNC1=CC(Cl)=C(Cl)C=C1 SBB051773 [1,0,0,0,0,0|3,0,0]=4 87 B10R1.176 COC1=CC(C)=C(F)C=C1 SBB086166 [1,0,0,0,0,0|2,0,0]=3 88 B10R1.176 COC1=CC(Cl)=C(F)C=C1 SBB087476 [1,0,0,0,0,0|2,0,0]=3 89 B10R1.176 COC1=CC(F)=C(Br)C=C1 SBB055267 [1,0,0,0,0,0|2,0,0]=3 90 B10R1.176 COC1=CC(F)=C(Cl)C=C1 SBB087475 [1,0,0,0,0,0|2,0,0]=3 91 B10R1.176 COC1=CC(F)=C(F)C=C1 SBB086325 [1,0,0,0,0,0|2,0,0]=3 92 B10R1.176 COC1=CC(N)=C(C)C=C1 SBB058810 [1,0,0,0,0,0|1,0,1]=3 93 B10R1.176 COC1=CC(N)=C(N)C=N1 SBB062788 [1,0,0,0,0,0|3,0,0]=4 94 B10R1.176 COC1=CC(N)=C(O)C=C1 SBB009779 [1,0,0,0,0,0|1,0,1]=3 95 B10R1.176 COC1=CC=C(Br)C(C)=C1 SBB054214 [1,0,0,0,0,0|2,0,0]=3 96 B10R1.176 COC1=CC=C(Br)C(N)=C1 SBB051753 [1,0,0,0,0,0|2,0,0]=3 97 B10R1.176 COC1=CC=C(C)C(F)=C1 SBB086170 [1,0,0,0,0,0|1,0,1]=3 98 B10R1.176 COC1=CC=C(Cl)C(C)=C1 SBB061027 [1,0,0,0,0,0|2,0,0]=3 99 B10R1.176 COC1=CC=C(Cl)C(N)=C1 SBB008038 [1,0,0,0,0,0|2,0,0]=3 100 B10R1.176 COC1=CC=C(N)C(Br)=N1 SBB070409 [1,0,0,0,0,0|3,0,0]=4 101 B10R1.176 COC1=CC=C(N)C(C)=C1 SBB080570 [1,0,0,0,0,0|2,0,0]=3 102 B10R1.176 COC1=CC=C(N)C(F)=C1 SBB071687 [1,0,0,0,0,0|2,0,0]=3 103 B10R1.176 COC1=CC=C(N)C(N)=C1 SBB048084 [1,0,0,0,0,0|2,0,0]=3 104 B10R1.176 COC1=NC=C(F)C(O)=N1 SBB086323 [1,0,0,0,0,0|3,0,0]=4 105 B10R1.176 N#CC1=CC=C(O)C(O)=C1 SBB008582 [1,0,0,0,0,0|2,0,1]=4 106 B10R1.176 O=CC1=CC=C(O)C(O)=C1 SBB040269 [1,0,0,0,0,0|2,0,1]=4 107 B12R1.48 C(=O)C1=C(C)C=C(N(C)C)C=C1 SBB008015 [0,1,0,0,0,0|2,0,0]=3 108 B12R1.48 CN(C)C1=CC=C(C=O)C(Cl)=C1 SBB052150 [0,1,0,0,0,0|2,0,0]=3 109 B12R1.48 CN(C)C1=CC=C(N=O)C(O)=C1 SBB071662 [0,1,0,0,0,0|2,0,0]=3 110 B12R1.48 O=CC1=CC=C(B(O)O)C=C1F SBB063970 [0,1,0,0,0,0|3,0,0]=4 111 B12R1.78 CCC1=C(OC)C=CC(OC)=C1 SBB014717 [0,1,0,0,0,0|3,0,0]=4 112 B12R1.78 COC1=CC(C#N)=C(OC)C=C1 SBB058340 [0,1,0,0,0,0|3,0,0]=4 113 B12R1.78 COC1=CC(CN)=C(OC)C=C1 SBB047767 [0,1,0,0,0,0|3,0,0]=4 114 B12R1.78 COC1=CC(OC)=C(CN)C=C1 SBB000428 [0,1,0,0,0,0|1,0,1]=3 115 B12R1.78 COC1=CC(OC)=C(CN)C=C1 SBB047769 [0,1,0,0,0,0|1,0,1]=3 116 B12R1.78 COC1=CC=C(C#N)C(OC)=C1 SBB063099 [0,1,0,0,0,0|1,0,1]=3 117 B12R1.78 COC1=CC=C(C=O)C(OC)=C1 SBB040221 [0,1,0,0,0,0|0,0,0]=1 118 B12R1.78 COC1=CC=C(C=O)C(OC)=N1 SBB065549 [0,1,0,0,0,0|1,0,0]=2 119 B12R1.78 COC1=CC=C(CO)C(OC)=C1 SBB063101 [0,1,0,0,0,0|0,0,2]=3 120 B12R1.78 COC1=CC=C(OC)C(C=O)=C1 SBB040207 [0,1,0,0,0,0|2,0,1]=4 121 B12R1.78 COC1=CC=C(OC)C(CCl)=C1 SBB090509 [0,1,0,0,0,0|3,0,0]=4 122 B12R1.78 COC1=NC(OC)=C(C=O)C=N1 SBB049503 [0,1,0,0,0,0|2,0,0]=3 123 B12R1.114 COC1=CC(F)=C(CC#N)C=C1 SBB087895 [0,1,0,0,0,0|2,0,1]=4 124 B12R1.301 C(=O)C1=C(F)C=C(OC)C=C1F SBB088585 [0,1,0,0,0,0|1,0,0]=2 125 B12R1.301 COC1=CC(F)=C(C#N)C(F)=C1 SBB064301 [0,1,0,0,0,0|2,0,1]=4 126 B12R1.301 COC1=CC(F)=C(CBr)C(F)=C1 SBB098710 [0,1,0,0,0,0|2,0,1]=4 127 B12R1.301 COC1=CC(F)=C(CN)C(F)=C1 SBB088748 [0,1,0,0,0,0|2,0,1]=4 128 B12R1.450 COC1=C(F)C=C(C#N)C(F)=C1 SBB088232 [0,1,0,0,0,0|2,0,1]=4 129 B12R1.450 COC1=C(O)C=C(C=O)C(Br)=C1 SBB063307 [0,1,0,0,0,0|1,0,0]=2 130 B12R1.450 COC1=CC(F)=C(C=O)C=C1F SBB088593 [0,1,0,0,0,0|1,0,0]=2 131 B12R1.450 COC1=CC(F)=C(OC)C=C1F SBB088866 [0,1,0,0,0,0|3,0,0]=4 132 B12R1.450 COC1=CC(N)=C(OC)C=C1Cl SBB003681 [0,1,0,0,0,0|3,0,0]=4 133 B12R1.452 COC1=CC(F)=C(C(=O)Cl)C=C1 SBB090844 [0,1,0,0,0,0|1,0,0]=2 134 B12R1.452 COC1=CC(F)=C(C(C)=O)C=C1 SBB064080 [0,1,0,0,0,0|1,0,0]=2 135 B12R1.452 COC1=CC(F)=C(C(N)=O)C=C1 SBB088263 [0,1,0,0,0,0|1,0,0]=2 136 B12R1.452 COC1=CC=C(B(O)O)C(Cl)=C1 SBB071194 [0,1,0,0,0,0|2,0,1]=4 137 B12R1.452 COC1=CC=C(B(O)O)C(F)=C1 SBB052527 [0,1,0,0,0,0|2,0,1]=4 138 B12R1.452 COC1=CC=C(C(=O)O)C(C)=C1 SBB052683 [0,1,0,0,0,0|1,0,0]=2 139 B12R1.452 COC1=CC=C(C(=O)O)C(F)=C1 SBB052739 [0,1,0,0,0,0|1,0,0]=2 140 B12R1.452 COC1=CC=C(C(=O)O)C(N)=C1 SBB016770 [0,1,0,0,0,0|1,0,0]=2 141 B12R1.452 COC1=CC=C(C(=O)O)C(O)=C1 SBB063950 [0,1,0,0,0,0|0,0,0]=1 142 B12R1.452 COC1=CC=C(C(C)=O)C(O)=C1 SBB066134 [0,1,0,0,0,0|0,0,0]=1 143 B12R1.452 COC1=CC=C([N+](=O)[O-])C(C)=C1 SBB055094 [0,1,0,0,0,0|2,0,0]=3 144 B12R1.452 COC1=CC=C([N+](=O)[O-])C(Cl)=N1 SBB054235 [0,1,0,0,0,0|3,0,0]=4 145 B12R1.452 COC1=CC=C([N+](=O)[O-])C(N)=C1 SBB051714 [0,1,0,0,0,0|2,0,0]=3 146 B12R1.452 COC1=CC=C([N+](=O)[O-])C(O)=C1 SBB008609 [0,1,0,0,0,0|1,0,0]=2 147 B12R1.452 COC1=NC(N)=C([N+](=O)[O-])C=C1 SBB012817 [0,1,0,0,0,0|3,0,0]=4 148 B12R1.452 N#CC1=CC(F)=C(C(=O)O)C=C1 SBB028478 [0,1,0,0,0,0|3,0,0]=4 149 B12R1.452 O=CC1=CC(O)=C([N+](=O)[O-])C=C1 SBB063279 [0,1,0,0,0,0|3,0,0]=4 150 B12R1.653 C(=O)C1=C(Cl)C(O)=C(OC)C=C1 SBB003704 [0,1,0,0,0,0|1,0,0]=2 151 B12R1.653 C(=O)C1=CC=C(OC)C(F)=C1F SBB088580 [0,1,0,0,0,0|1,0,0]=2 152 B12R1.653 COC1=C(O)C(Br)=C(C=O)C=C1 SBB016534 [0,1,0,0,0,0|1,0,0]=2 153 B12R1.653 COC1=C(O)C(I)=C(C=O)C=C1 SBB035943 [0,1,0,0,0,0|1,0,0]=2 154 B12R1.653 COC1=CC=C(C#N)C(F)=C1F SBB063642 [0,1,0,0,0,0|2,0,1]=4 155 B12R1.653 COC1=CC=C(C=O)C(C)=C1C SBB064669 [0,1,0,0,0,0|1,0,0]=2 156 B12R1.653 COC1=CC=C(CBr)C(F)=C1F SBB098719 [0,1,0,0,0,0|2,0,1]=4 157 B12R1.653 COC1=CC=C(CN)C(F)=C1F SBB088739 [0,1,0,0,0,0|2,0,1]=4 158 B12R2.44 COC1=CC2=NON=C2C=C1 SBB086688 [0,0,0,1,0,0|2,0,1]=4 159 B12R2.44 COC1=CC2=NSN=C2C=C1 SBB088014 [0,0,0,1,0,0|2,1,0]=4 160 B12R2.44 COC1=CC=C2C=CNC2=C1 SBB055970 [0,0,0,1,0,0|2,0,0]=3 161 B12R2.44 COC1=CC=C2NC=NC2=C1 SBB086586 [0,0,0,1,0,0|3,0,0]=4 162 B12R2.44 N1C=CC2=C1C=CC(OC)=C2 SBB004094 [0,0,0,1,0,0|3,0,0]=4 163 B9R1.1 C(=O)C1=CC=C(Cl)N=C1 SBB004157 [2,0,0,0,0,0|2,0,0]=4 164 B9R1.1 CC1=CC=C(C#N)C=C1 SBB055483 [2,0,0,0,0,0|1,0,1]=4 165 B9R1.1 CC1=CC=C(CCl)C=C1 SBB040648 [2,0,0,0,0,0|1,0,1]=4 166 B9R1.1 CC1=CC=C(CN)C=C1 SBB040468 [2,0,0,0,0,0|1,0,1]=4 167 B9R1.1 CC1=CC=C(CO)C=C1 SBB063354 [2,0,0,0,0,0|0,0,2]=4 168 B9R1.1 CC1=CC=C(CS)C=C1 SBB086032 [2,0,0,0,0,0|0,1,1]=4 169 B9R1.1 CC1=CN=C(C=O)C=C1 SBB065436 [2,0,0,0,0,0|1,0,0]=3 170 B9R1.1 CC1=NC=C(C=O)C=C1 SBB065430 [2,0,0,0,0,0|1,0,0]=3 171 B9R1.1 CC1=NC=C(C=O)C=N1 SBB010235 [2,0,0,0,0,0|2,0,0]=4 172 B9R1.1 CCC1=CC=C(Br)C=C1 SBB054183 [2,0,0,0,0,0|2,0,0]=4 173 B9R1.1 CCC1=CC=C(Br)C=C1 SBB060979 [2,0,0,0,0,0|2,0,0]=4 174 B9R1.1 CCC1=CC=C(F)C=C1 SBB085565 [2,0,0,0,0,0|2,0,0]=4 175 B9R1.1 CCC1=CC=C(N)C=C1 SBB040445 [2,0,0,0,0,0|2,0,0]=4 176 B9R1.1 CCC1=CC=C(O)C=C1 SBB057513 [2,0,0,0,0,0|1,0,1]=4 177 B9R1.1 CNC1=CC=C(N)C=C1 SBB003597 [2,0,0,0,0,0|2,0,0]=4 178 B9R1.1 COC1=CC=C(Br)C=C1 SBB060208 [2,0,0,0,0,0|1,0,0]=3 179 B9R1.1 COC1=CC=C(Br)C=N1 SBB059393 [2,0,0,0,0,0|2,0,0]=4 180 B9R1.1 COC1=CC=C(C)C=C1 SBB060064 [2,0,0,0,0,0|0,0,1]=3 181 B9R1.1 COC1=CC=C(Cl)C=C1 SBB061022 [2,0,0,0,0,0|1,0,0]=3 182 B9R1.1 COC1=CC=C(F)C=C1 SBB085645 [2,0,0,0,0,0|1,0,0]=3 183 B9R1.1 COC1=CC=C(N)C=C1 SBB040441 [2,0,0,0,0,0|1,0,0]=3 184 B9R1.1 COC1=CC=C(O)C=C1 SBB060425 [2,0,0,0,0,0|0,0,1]=3 185 B9R1.1 COC1=NC=C(F)C=C1 SBB085672 [2,0,0,0,0,0|2,0,0]=4 186 B9R1.1 COC1=NC=C(N)C=C1 SBB016584 [2,0,0,0,0,0|2,0,0]=4 187 B9R1.1 CSC1=CC=C(F)C=C1 SBB086252 [2,0,0,0,0,0|1,1,0]=4 188 B9R1.1 CSC1=CC=C(O)C=C1 SBB071908 [2,0,0,0,0,0|0,1,1]=4 189 B9R1.1 N#CC1=CC=C(O)C=C1 SBB008054 [2,0,0,0,0,0|1,0,1]=4 190 B9R1.1 NC1=CC=C(SC)C=C1 SBB006658 [2,0,0,0,0,0|1,1,0]=4 191 B9R1.1 NCC1=CC=C(O)C=C1 SBB046561 [2,0,0,0,0,0|1,0,1]=4 192 B9R1.1 O=CC1=CC=C(Br)C=C1 SBB007609 [2,0,0,0,0,0|1,0,0]=3 193 B9R1.1 O=CC1=CC=C(Cl)C=C1 SBB040227 [2,0,0,0,0,0|1,0,0]=3 194 B9R1.1 O=CC1=CC=C(F)C=C1 SBB040209 [2,0,0,0,0,0|1,0,0]=3 195 B9R1.1 O=CC1=CC=C(F)N=C1 SBB052255 [2,0,0,0,0,0|2,0,0]=4 196 B9R1.1 O=CC1=CC=C(I)C=C1 SBB062822 [2,0,0,0,0,0|1,0,0]=3 197 B9R1.1 O=CC1=CC=C(O)C=C1 SBB028743 [2,0,0,0,0,0|0,0,0]=2 198 B9R1.1 O=CC1=CC=C(O)N=C1 SBB052249 [2,0,0,0,0,0|1,0,0]=3 199 B9R1.1 O=CC1=CN=C(Br)C=C1 SBB052244 [2,0,0,0,0,0|2,0,0]=4 200 B9R1.1 O=CC1=NC=C(Br)C=C1 SBB052231 [2,0,0,0,0,0|2,0,0]=4 201 B9R1.1 O=CC1=NC=C(Cl)C=C1 SBB086215 [2,0,0,0,0,0|2,0,0]=4 202 B9R1.1 O=CC1=NC=C(F)C=C1 SBB065526 [2,0,0,0,0,0|2,0,0]=4 203 B9R1.1 OCC1=CC=C(O)C=C1 SBB059322 [2,0,0,0,0,0|0,0,2]=4 204 B9R1.1 [NH2+](C)C1=CC=C(O)C=C1 SBB060652 [2,0,0,0,0,0|1,0,1]=4 205 B9R1.1 [NH3+]NC1=CC=C(C)C=C1 SBB058586 [2,0,0,0,0,0|2,0,0]=4 206 B9R1.15 C(=O)C1=CC=CN=C1Cl SBB004156 [2,0,0,0,0,0|2,0,0]=4 207 B9R1.15 CC1=C(C=O)C=CN=C1 SBB065410 [2,0,0,0,0,0|2,0,0]=4 208 B9R1.15 CC1=C(C=O)C=NC=C1 SBB052236 [2,0,0,0,0,0|2,0,0]=4 209 B9R1.15 CC1=CC=CN=C1C=O SBB052241 [2,0,0,0,0,0|2,0,0]=4 210 B9R1.15 COC1=C(O)C=CC=C1 SBB058681 [2,0,0,0,0,0|2,0,0]=4 211 B9R1.15 N#CC1=C(O)C=CC=C1 SBB007959 [2,0,0,0,0,0|1,0,1]=4 212 B9R1.15 NC1=C(C=O)C=NC=C1 SBB014341 [2,0,0,0,0,0|2,0,0]=4 213 B9R1.15 NC1=CC=CC=C1C=O SBB061591 [2,0,0,0,0,0|1,0,0]=3 214 B9R1.15 NC1=CN=CC=C1C=O SBB052230 [2,0,0,0,0,0|2,0,0]=4 215 B9R1.15 NC1=NC=CC=C1C=O SBB012985 [2,0,0,0,0,0|2,0,0]=4 216 B9R1.15 O=CC1=C(F)C=NC=C1 SBB065535 [2,0,0,0,0,0|2,0,0]=4 217 B9R1.15 O=CC1=CC=CC=C1Br SBB040217 [2,0,0,0,0,0|1,0,0]=3 218 B9R1.15 O=CC1=CC=CC=C1Cl SBB040228 [2,0,0,0,0,0|1,0,0]=3 219 B9R1.15 O=CC1=CC=CC=C1F SBB040198 [2,0,0,0,0,0|1,0,0]=3 220 B9R1.15 O=CC1=CC=CC=C1I SBB017119 [2,0,0,0,0,0|1,0,0]=3 221 B9R1.15 O=CC1=CC=CC=C1O SBB040225 [2,0,0,0,0,0|0,0,0]=2 222 B9R1.15 O=CC1=CC=CN=C1Br SBB052224 [2,0,0,0,0,0|2,0,0]=4 223 B9R1.15 O=CC1=CC=CN=C1F SBB065263 [2,0,0,0,0,0|2,0,0]=4 224 B9R1.15 O=CC1=CC=NC=C1Br SBB052233 [2,0,0,0,0,0|2,0,0]=4 225 B9R1.15 O=CC1=CN=CC=C1Cl SBB065433 [2,0,0,0,0,0|2,0,0]=4 226 B9R1.15 O=CC1=NC=CC=C1F SBB065527 [2,0,0,0,0,0|2,0,0]=4 227 B9R1.15 OCC1=CC=CC=C1O SBB065036 [2,0,0,0,0,0|0,0,2]=4 228 B9R1.69 CC1=C(F)C=CC(O)=C1 SBB085652 [2,0,0,0,0,0|2,0,0]=4 229 B9R1.69 CC1=C(N)C=CC(O)=C1 SBB058775 [2,0,0,0,0,0|2,0,0]=4 230 B9R1.69 CC1=C(O)C=C(F)C=C1 SBB085644 [2,0,0,0,0,0|1,0,1]=4 231 B9R1.69 CC1=C(O)C=CC(O)=C1 SBB058737 [2,0,0,0,0,0|1,0,1]=4 232 B9R1.69 CC1=CC(Br)=C(F)C=C1 SBB090881 [2,0,0,0,0,0|2,0,0]=4 233 B9R1.69 CC1=CC(C)=C(C)C=C1 SBB060396 [2,0,0,0,0,0|1,0,1]=4 234 B9R1.69 CC1=CC(C)=C(F)C=C1 SBB085564 [2,0,0,0,0,0|2,0,0]=4 235 B9R1.69 CC1=CC(C)=C(O)C=C1 SBB060657 [2,0,0,0,0,0|1,0,1]=4 236 B9R1.69 CC1=CC(Cl)=C(Cl)C=C1 SBB061466 [2,0,0,0,0,0|2,0,0]=4 237 B9R1.69 CC1=CC(Cl)=C(F)C=C1 SBB086372 [2,0,0,0,0,0|2,0,0]=4 238 B9R1.69 CC1=CC(F)=C(Br)C=C1 SBB090876 [2,0,0,0,0,0|2,0,0]=4 239 B9R1.69 CC1=CC(F)=C(C)C=C1 SBB085563 [2,0,0,0,0,0|1,0,1]=4 240 B9R1.69 CC1=CC(F)=C(Cl)C=C1 SBB086381 [2,0,0,0,0,0|2,0,0]=4 241 B9R1.69 CC1=CC(F)=C(F)C=C1 SBB085714 [2,0,0,0,0,0|2,0,0]=4 242 B9R1.69 CC1=CC(F)=C(I)C=C1 SBB098504 [2,0,0,0,0,0|2,0,0]=4 243 B9R1.69 CC1=CC(F)=C(O)C=C1 SBB085649 [2,0,0,0,0,0|1,0,1]=4 244 B9R1.69 CC1=CC(N)=C(N)C=C1 SBB007557 [2,0,0,0,0,0|2,0,0]=4 245 B9R1.69 CC1=CC(O)=C(C)C=C1 SBB060426 [2,0,0,0,0,0|0,0,1]=3 246 B9R1.69 CC1=CC(O)=C(F)C=C1 SBB085653 [2,0,0,0,0,0|1,0,0]=3 247 B9R1.69 CC1=CC(O)=C(O)C=C1 SBB061372 [2,0,0,0,0,0|0,0,1]=3 248 B9R1.69 CC1=CC(O)=CC=C1Br SBB043774 [2,0,0,0,0,0|2,0,0]=4 249 B9R1.69 CC1=CC(O)=CC=C1Cl SBB060654 [2,0,0,0,0,0|2,0,0]=4 250 B9R1.69 CC1=CC=C(C)C(N)=C1 SBB040497 [2,0,0,0,0,0|1,0,1]=4 251 B9R1.69 CC1=CC=C(Cl)C(N)=C1 SBB069932 [2,0,0,0,0,0|2,0,0]=4 252 B9R1.69 CC1=CC=C(F)C(N)=C1 SBB028213 [2,0,0,0,0,0|2,0,0]=4 253 B9R1.69 CC1=CC=C(N)C(Br)=C1 SBB040485 [2,0,0,0,0,0|2,0,0]=4 254 B9R1.69 CC1=CC=C(N)C(C)=C1 SBB040487 [2,0,0,0,0,0|2,0,0]=4 255 B9R1.69 CC1=CC=C(O)C(Br)=C1 SBB079996 [2,0,0,0,0,0|1,0,1]=4 256 B9R1.69 CC1=CC=C(O)C(N)=C1 SBB051703 [2,0,0,0,0,0|1,0,1]=4 257 B9R1.69 CC1=CC=C(O)C=C1C SBB060427 [2,0,0,0,0,0|1,0,1]=4 258 B9R1.69 CC1=CC=C(O)C=C1F SBB085647 [2,0,0,0,0,0|1,0,1]=4 259 B9R1.69 NC1=C(Cl)C=C(O)C=C1 SBB003750 [2,0,0,0,0,0|2,0,0]=4 260 B9R1.69 NC1=CC=C(Br)C=C1O SBB051770 [2,0,0,0,0,0|2,0,0]=4 261 B9R1.69 NC1=CC=C(C)C=C1F SBB006650 [2,0,0,0,0,0|2,0,0]=4 262 B9R1.69 NC1=CC=C(F)C=C1O SBB055384 [2,0,0,0,0,0|2,0,0]=4 263 B9R1.69 NC1=CC=C(O)C=C1F SBB028225 [2,0,0,0,0,0|2,0,0]=4 264 B9R1.69 O=C1NC=C(Cl)C=C1O SBB004115 [2,0,0,0,0,0|2,0,0]=4 265 B9R1.69 OC1=C(Br)C=CC(F)=C1 SBB091224 [2,0,0,0,0,0|2,0,0]=4 266 B9R1.69 OC1=C(Cl)C=CC(Cl)=C1 SBB061453 [2,0,0,0,0,0|2,0,0]=4 267 B9R1.69 OC1=C(Cl)C=CC(F)=C1 SBB086520 [2,0,0,0,0,0|2,0,0]=4 268 B9R1.69 OC1=C(F)C=CC(F)=C1 SBB085755 [2,0,0,0,0,0|2,0,0]=4 269 B9R1.69 OC1=CC(Br)=CC=C1Cl SBB093919 [2,0,0,0,0,0|2,0,0]=4 270 B9R1.69 OC1=CC(F)=C(Br)C=C1 SBB091225 [2,0,0,0,0,0|2,0,0]=4 271 B9R1.69 OC1=CC(F)=C(F)C=C1 SBB085753 [2,0,0,0,0,0|2,0,0]=4 272 B9R1.69 OC1=CC=C(Br)C(O)=C1 SBB059604 [2,0,0,0,0,0|1,0,0]=3 273 B9R1.69 OC1=CC=C(Cl)C(Cl)=C1 SBB058866 [2,0,0,0,0,0|2,0,0]=4 274 B9R1.69 OC1=CC=C(Cl)C(F)=C1 SBB086512 [2,0,0,0,0,0|2,0,0]=4 275 B9R1.69 OC1=CC=C(Cl)C(O)=C1 SBB061264 [2,0,0,0,0,0|1,0,0]=3 276 B9R1.69 OC1=CC=C(F)C(Cl)=C1 SBB086516 [2,0,0,0,0,0|2,0,0]=4 277 B9R1.69 OC1=CC=C(F)C(O)=C1 SBB085710 [2,0,0,0,0,0|1,0,0]=3 278 B9R1.2 C#CC1=CC=CC(O)=C1 SBB005886 [2,0,0,0,0,0|1,0,1]=4 279 B9R1.2 CCC1=CC(C)=CC=C1 SBB061286 [2,0,0,0,0,0|2,0,0]=4 280 B9R1.2 CCC1=CC(C)=CC=C1 SBB061444 [2,0,0,0,0,0|2,0,0]=4 281 B9R1.2 CCC1=CC=CC(Br)=C1 SBB090239 [2,0,0,0,0,0|2,0,0]=4 282 B9R1.2 CNC1=CC(Cl)=CC=C1 SBB086218 [2,0,0,0,0,0|2,0,0]=4 283 B9R1.2 COC1=CC(Br)=CC=C1 SBB007886 [2,0,0,0,0,0|1,0,0]=3 284 B9R1.2 COC1=CC(F)=CC=C1 SBB085642 [2,0,0,0,0,0|1,0,0]=3 285 B9R1.2 COC1=CC(N)=NC=C1 SBB051898 [2,0,0,0,0,0|2,0,0]=4 286 B9R1.2 COC1=CC(O)=CC=C1 SBB060932 [2,0,0,0,0,0|0,0,0]=2 287 B9R1.2 COC1=CC=CC(Br)=N1 SBB054383 [2,0,0,0,0,0|2,0,0]=4 288 B9R1.2 COC1=CC=CC(C)=C1 SBB061028 [2,0,0,0,0,0|1,0,0]=3 289 B9R1.2 COC1=CC=CC(F)=N1 SBB085671 [2,0,0,0,0,0|2,0,0]=4 290 B9R1.2 COC1=CC=CC(I)=C1 SBB059058 [2,0,0,0,0,0|1,0,0]=3 291 B9R1.2 COC1=CC=CC(N)=C1 SBB040499 [2,0,0,0,0,0|1,0,0]=3 292 B9R1.2 COC1=CC=CC(N)=N1 SBB051862 [2,0,0,0,0,0|2,0,0]=4 293 B9R1.2 COC1=CN=CC(Br)=C1 SBB054402 [2,0,0,0,0,0|2,0,0]=4 294 B9R1.2 COC1=NC=CC(Br)=C1 SBB054328 [2,0,0,0,0,0|2,0,0]=4 295 B9R1.2 COC1=NC=CC(N)=C1 SBB051798 [2,0,0,0,0,0|2,0,0]=4 296 B9R1.2 O=CC1=CC=CC(O)=C1 SBB040208 [2,0,0,0,0,0|2,0,0]=4 297 B9R1.2 OCC1=CC=CC(O)=C1 SBB068731 [2,0,0,0,0,0|2,0,0]=4 298 B11R1.3 C(=O)C1=CC=C(B(O)O)C=C1 SBB004077 [1,1,0,0,0,0|2,0,0]=4 299 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 SBB055505 [1,1,0,0,0,0|1,0,0]=3 300 B11R1.3 CC(=O)C1=CC=C(C#N)C=C1 SBB063042 [1,1,0,0,0,0|2,0,0]=4 301 B11R1.3 CC(C)C1=CC=C(C=O)C=C1 SBB040237 [1,1,0,0,0,0|1,0,0]=3 302 B11R1.3 CCC1=CC=C(C(=N)N)C=C1 SBB073190 [1,1,0,0,0,0|2,0,0]=4 303 B11R1.3 CCC1=CC=C(C(=O)Cl)C=C1 SBB006540 [1,1,0,0,0,0|1,0,0]=3 304 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 SBB037877 [1,1,0,0,0,0|1,0,0]=3 305 B11R1.3 CCC1=CC=C(C(C)=O)C=C1 SBB040909 [1,1,0,0,0,0|1,0,0]=3 306 B11R1.3 CCC1=CC=C(C(N)=O)C=C1 SBB116864 [1,1,0,0,0,0|1,0,0]=3 307 B11R1.3 CCC1=CC=C(C(N)=S)C=C1 SBB016505 [1,1,0,0,0,0|1,1,0]=4 308 B11R1.3 CCC1=CC=C([N+](=O)[O-])C=C1 SBB060635 [1,1,0,0,0,0|2,0,0]=4 309 B11R1.3 CN(C)C1=CC=C(C=O)C=C1 SBB008757 [1,1,0,0,0,0|1,0,0]=3 310 B11R1.3 CN(C)C1=CC=C(C=O)C=N1 SBB086715 [1,1,0,0,0,0|2,0,0]=4 311 B11R1.3 CN(C)C1=CC=C(N=O)C=C1 SBB058598 [1,1,0,0,0,0|2,0,0]=4 312 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 SBB058256 [1,1,0,0,0,0|1,0,0]=3 313 B11R1.3 COC1=CC=C(B(O)O)C=C1 SBB004055 [1,1,0,0,0,0|1,0,1]=4 314 B11R1.3 COC1=CC=C(C(=N)N)C=C1 SBB048505 [1,1,0,0,0,0|1,0,0]=3 315 B11R1.3 COC1=CC=C(C(=O)Cl)C=C1 SBB040620 [1,1,0,0,0,0|0,0,0]=2 316 B11R1.3 COC1=CC=C(C(=O)O)C=C1 SBB037872 [1,1,0,0,0,0|0,0,0]=2 317 B11R1.3 COC1=CC=C(C(=O)O)N=N1 SBB053240 [1,1,0,0,0,0|2,0,0]=4 318 B11R1.3 COC1=CC=C(C(C)=O)C=C1 SBB040242 [1,1,0,0,0,0|0,0,0]=2 319 B11R1.3 COC1=CC=C(C(C)N)C=C1 SBB007015 [1,1,0,0,0,0|1,0,1]=4 320 B11R1.3 COC1=CC=C(C(N)=S)C=C1 SBB016507 [1,1,0,0,0,0|0,1,0]=3 321 B11R1.3 COC1=CC=C([N+](=O)[O-])C=C1 SBB058741 [1,1,0,0,0,0|1,0,0]=3 322 B11R1.3 COC1=NC=C(C(=O)O)C=C1 SBB012818 [1,1,0,0,0,0|1,0,0]=3 323 B11R1.3 CSC1=CC=C(C(=N)N)C=C1 SBB077444 [1,1,0,0,0,0|1,1,0]=4 324 B11R1.3 CSC1=CC=C(C(=O)O)C=C1 SBB063176 [1,1,0,0,0,0|0,1,0]=3 325 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 SBB088031 [1,1,0,0,0,0|0,1,0]=3 326 B11R1.3 CSC1=CC=C([N+](=O)[O-])C=C1 SBB068783 [1,1,0,0,0,0|1,1,0]=4 327 B11R1.3 N#CC1=CC=C(C(=O)Cl)C=C1 SBB059843 [1,1,0,0,0,0|2,0,0]=4 328 B11R1.3 N#CC1=CC=C(C(=O)O)C=C1 SBB008570 [1,1,0,0,0,0|2,0,0]=4 329 B11R1.3 N#CC1=CC=C(C(N)=O)C=C1 SBB065159 [1,1,0,0,0,0|2,0,0]=4 330 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 SBB006704 [1,1,0,0,0,0|2,0,0]=4 331 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 SBB046616 [1,1,0,0,0,0|2,0,0]=4 332 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 SBB017160 [1,1,0,0,0,0|2,0,0]=4 333 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 SBB042644 [1,1,0,0,0,0|2,0,0]=4 334 B11R1.3 O=C(O)C1=CC=C(CCl)C=C1 SBB040672 [1,1,0,0,0,0|2,0,0]=4 335 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 SBB052730 [1,1,0,0,0,0|2,0,0]=4 336 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 SBB040263 [1,1,0,0,0,0|2,0,0]=4 337 B11R1.3 O=CC1=CC=C([N+](=O)[O-])C=C1 SBB040235 [1,1,0,0,0,0|2,0,0]=4 338 B11R1.3 OC(=O)C1=CC=C(C=C)C=C1 SBB006579 [1,1,0,0,0,0|1,0,1]=4 339 B11R1.83 CCC1=CC=C(N=C=O)C=C1 SBB046954 [1,1,0,0,0,0|1,0,1]=4 340 B11R1.83 CCCC1=CC=C(C=O)C=C1 SBB059136 [1,1,0,0,0,0|1,0,0]=3 341 B11R1.83 CCCC1=CC=C(OC)C=C1 SBB007737 [1,1,0,0,0,0|1,0,1]=4 342 B11R1.83 CCOC1=CC=C(C#N)C=C1 SBB055390 [1,1,0,0,0,0|1,0,1]=4 343 B11R1.83 CCOC1=CC=C(C=O)C=C1 SBB016657 [1,1,0,0,0,0|0,0,0]=2 344 B11R1.83 CCOC1=CC=C(CBr)C=C1 SBB081616 [1,1,0,0,0,0|1,0,1]=4 345 B11R1.83 CCOC1=CC=C(CN)C=C1 SBB017652 [1,1,0,0,0,0|1,0,1]=4 346 B11R1.83 CCSC1=CC=C(C=O)C=C1 SBB079149 [1,1,0,0,0,0|0,1,0]=3 347 B11R1.83 CNCC1=CC=C(OC)C=C1 SBB086791 [1,1,0,0,0,0|1,0,1]=4 348 B11R1.83 COC1=CC=C(CC#N)C=C1 SBB055070 [1,1,0,0,0,0|1,0,1]=4 349 B11R1.83 COC1=CC=C(CC=O)C=C1 SBB052209 [1,1,0,0,0,0|0,0,0]=2 350 B11R1.83 COC1=CC=C(CCN)C=C1 SBB058795 [1,1,0,0,0,0|1,0,1]=4 351 B11R1.83 COC1=CC=C(CON)C=C1 SBB091016 [1,1,0,0,0,0|0,0,2]=4 352 B11R1.83 COC1=CC=C(N=C=O)C=C1 SBB048851 [1,1,0,0,0,0|0,0,1]=3 353 B11R1.83 COC1=CC=C(N=C=S)C=C1 SBB006547 [1,1,0,0,0,0|0,1,1]=4 354 B11R1.83 COC1=CC=C(\C=N/O)C=C1 SBB086769 [1,1,0,0,0,0|0,0,1]=3 355 B11R1.83 CSC1=CC=C(N=C=O)C=C1 SBB048889 [1,1,0,0,0,0|0,1,1]=4 356 B11R1.37 C(=O)C1=C(OC)C=C(O)C=C1 SBB008607 [1,1,0,0,0,0|0,0,0]=2 357 B11R1.37 COC1=C(OC)C=C(O)C=C1 SBB055250 [1,1,0,0,0,0|2,0,0]=4 358 B11R1.37 COC1=CC(C)=CC=C1C=O SBB010322 [1,1,0,0,0,0|0,0,0]=2 359 B11R1.37 COC1=CC(F)=CC=C1C=O SBB064433 [1,1,0,0,0,0|1,0,0]=3 360 B11R1.37 N#CC1=CC(F)=CC=C1C=O SBB052141 [1,1,0,0,0,0|2,0,0]=4 361 B11R1.81 CC1=CC=C(N=C=O)C(C)=C1 SBB048857 [1,1,0,0,0,0|1,0,1]=4 362 B11R1.166 CC(=O)C1=C(C)C=C(F)C=C1 SBB086841 [1,1,0,0,0,0|2,0,0]=4 363 B11R1.166 CC(=O)C1=C(F)C=C(C)C=C1 SBB086842 [1,1,0,0,0,0|1,0,0]=3 364 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 SBB071469 [1,1,0,0,0,0|1,0,0]=3 365 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 SBB040836 [1,1,0,0,0,0|0,0,0]=2 366 B11R1.166 CC(=O)C1=CC=C(C)C=C1C SBB058451 [1,1,0,0,0,0|1,0,0]=3 367 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1Cl SBB063949 [1,1,0,0,0,0|2,0,0]=4 368 B11R1.166 CC(=O)C1=CC=C(F)C=C1Br SBB064291 [1,1,0,0,0,0|2,0,0]=4 369 B11R1.166 CC(=O)C1=CC=C(F)C=C1Cl SBB064482 [1,1,0,0,0,0|2,0,0]=4 370 B11R1.166 CC(=O)C1=CC=C(F)C=C1F SBB063127 [1,1,0,0,0,0|2,0,0]=4 371 B11R1.166 CC(=O)C1=CC=C(F)C=C1O SBB063885 [1,1,0,0,0,0|1,0,0]=3 372 B11R1.166 CC(=O)C1=CC=C(O)C=C1C SBB063800 [1,1,0,0,0,0|1,0,0]=3 373 B11R1.166 CC1=C(C(=O)Cl)C=CC(F)=C1 SBB088703 [1,1,0,0,0,0|2,0,0]=4 374 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 SBB017616 [1,1,0,0,0,0|1,0,0]=3 375 B11R1.166 CC1=CC(Br)=CC=C1C(=O)O SBB064476 [1,1,0,0,0,0|2,0,0]=4 376 B11R1.166 CC1=CC(C)=C([N+](=O)[O-])C=C1 SBB061630 [1,1,0,0,0,0|2,0,0]=4 377 B11R1.166 CC1=CC(Cl)=CC=C1C(=O)O SBB052764 [1,1,0,0,0,0|2,0,0]=4 378 B11R1.166 CC1=CC(F)=C(C(=O)Cl)C=C1 SBB088707 [1,1,0,0,0,0|1,0,0]=3 379 B11R1.166 CC1=CC(F)=CC=C1C(=O)O SBB062990 [1,1,0,0,0,0|2,0,0]=4 380 B11R1.166 CC1=CC(N)=C([N+](=O)[O-])C=C1 SBB058806 [1,1,0,0,0,0|2,0,0]=4 381 B11R1.166 CC1=CC(N)=CC=C1C(=O)O SBB063412 [1,1,0,0,0,0|2,0,0]=4 382 B11R1.166 CC1=CC(O)=C(C(=O)O)C=C1 SBB058803 [1,1,0,0,0,0|0,0,0]=2 383 B11R1.166 CC1=CC(O)=C(C(C)C)C=C1 SBB060429 [1,1,0,0,0,0|1,0,1]=4 384 B11R1.166 CC1=CC(O)=C([N+](=O)[O-])C=C1 SBB058773 [1,1,0,0,0,0|1,0,0]=3 385 B11R1.166 CC1=CC(O)=CC=C1C(=O)O SBB064774 [1,1,0,0,0,0|1,0,0]=3 386 B11R1.166 CC1=CC(O)=CC=C1[N+](=O)[O-] SBB058858 [1,1,0,0,0,0|2,0,0]=4 387 B11R1.166 CC1=CC=C(C(=O)Cl)C(C)=C1 SBB088219 [1,1,0,0,0,0|1,0,0]=3 388 B11R1.166 CC1=CC=C(C(=O)O)C(=O)N1 SBB004049 [1,1,0,0,0,0|1,0,1]=4 389 B11R1.166 CC1=CC=C(C(=O)O)C(C)=C1 SBB052762 [1,1,0,0,0,0|1,0,0]=3 390 B11R1.166 CC1=CC=C(C(=O)O)C(C)=N1 SBB053040 [1,1,0,0,0,0|2,0,0]=4 391 B11R1.166 CC1=CC=C(C(=O)O)C(Cl)=N1 SBB003843 [1,1,0,0,0,0|2,0,0]=4 392 B11R1.166 CC1=CC=C(C(=O)O)C(F)=C1 SBB063274 [1,1,0,0,0,0|1,0,0]=3 393 B11R1.166 CC1=CC=C(C(=O)O)C(N)=C1 SBB052651 [1,1,0,0,0,0|1,0,0]=3 394 B11R1.166 CC1=CC=C([N+](=O)[O-])C(Cl)=C1 SBB064201 [1,1,0,0,0,0|2,0,0]=4 395 B11R1.166 CC1=CC=C([N+](=O)[O-])C(F)=C1 SBB063399 [1,1,0,0,0,0|2,0,0]=4 396 B11R1.166 CC1=NC(O)=C(C(=O)O)C=C1 SBB028469 [1,1,0,0,0,0|1,0,0]=3 397 B11R1.166 CC1=NC(O)=C(C(=O)O)C=N1 SBB302965 [1,1,0,0,0,0|2,0,0]=4 398 B11R1.166 NC(=O)C1=C(Cl)C=C(Cl)C=C1 SBB061882 [1,1,0,0,0,0|2,0,0]=4 399 B11R1.166 NC(=O)C1=C(Cl)C=C(F)C=C1 SBB088808 [1,1,0,0,0,0|2,0,0]=4 400 B11R1.166 NC(=O)C1=C(F)C=C(Br)C=C1 SBB095502 [1,1,0,0,0,0|2,0,0]=4 401 B11R1.166 NC(=O)C1=C(F)C=C(F)C=C1 SBB087198 [1,1,0,0,0,0|2,0,0]=4 402 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=C1 SBB028134 [1,1,0,0,0,0|2,0,0]=4 403 B11R1.166 NC1=C(C(=O)O)C=CC(F)=C1 SBB006590 [1,1,0,0,0,0|2,0,0]=4 404 B11R1.166 NC1=CC(Br)=CC=C1C(=O)O SBB052622 [1,1,0,0,0,0|2,0,0]=4 405 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=C1 SBB008581 [1,1,0,0,0,0|2,0,0]=4 406 B11R1.166 NC1=CC(F)=C(C(=O)O)C=C1 SBB028315 [1,1,0,0,0,0|2,0,0]=4 407 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 SBB056794 [1,1,0,0,0,0|1,0,0]=3 408 B11R1.166 O=C(Cl)C1=C(Cl)C=C(Cl)C=C1 SBB058752 [1,1,0,0,0,0|2,0,0]=4 409 B11R1.166 O=C(Cl)C1=C(F)C=C(Br)C=C1 SBB098837 [1,1,0,0,0,0|2,0,0]=4 410 B11R1.166 O=C(Cl)C1=C(F)C=C(Cl)C=C1 SBB067912 [1,1,0,0,0,0|2,0,0]=4 411 B11R1.166 O=C(Cl)C1=CC=C(F)C=C1Cl SBB067906 [1,1,0,0,0,0|2,0,0]=4 412 B11R1.166 O=C(Cl)C1=CC=C(F)C=C1F SBB006623 [1,1,0,0,0,0|2,0,0]=4 413 B11R1.166 O=C(O)C1=C(Cl)C=C(F)C=C1 SBB003795 [1,1,0,0,0,0|2,0,0]=4 414 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 SBB003833 [1,1,0,0,0,0|1,0,0]=3 415 B11R1.166 O=C(O)C1=C(F)C=C(Cl)C=C1 SBB003797 [1,1,0,0,0,0|2,0,0]=4 416 B11R1.166 O=C(O)C1=C(F)C=C(O)C=C1 SBB051451 [1,1,0,0,0,0|1,0,0]=3 417 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=C1 SBB058792 [1,1,0,0,0,0|1,0,0]=3 418 B11R1.166 O=C(O)C1=C(O)C=C(O)C=C1 SBB058728 [1,1,0,0,0,0|0,0,0]=2 419 B11R1.166 O=C(O)C1=C(O)C=C(O)N=C1 SBB052975 [1,1,0,0,0,0|1,0,0]=3 420 B11R1.166 O=C(O)C1=CC=C(Br)C=C1Br SBB052783 [1,1,0,0,0,0|2,0,0]=4 421 B11R1.166 O=C(O)C1=CC=C(Br)C=C1Cl SBB052614 [1,1,0,0,0,0|2,0,0]=4 422 B11R1.166 O=C(O)C1=CC=C(Br)C=C1F SBB063037 [1,1,0,0,0,0|2,0,0]=4 423 B11R1.166 O=C(O)C1=CC=C(Cl)C=C1Br SBB063375 [1,1,0,0,0,0|2,0,0]=4 424 B11R1.166 O=C(O)C1=CC=C(Cl)C=C1Cl SBB040532 [1,1,0,0,0,0|2,0,0]=4 425 B11R1.166 O=C(O)C1=CC=C(F)C=C1Br SBB063576 [1,1,0,0,0,0|2,0,0]=4 426 B11R1.166 O=C(O)C1=CC=C(F)C=C1F SBB063446 [1,1,0,0,0,0|2,0,0]=4 427 B11R1.166 O=C(O)C1=CC=C(F)C=C1O SBB052701 [1,1,0,0,0,0|1,0,0]=3 428 B11R1.166 O=C(O)C1=CN=C(O)N=C1O SBB059503 [1,1,0,0,0,0|2,0,0]=4 429 B11R1.166 O=[N+]([O-])C1=CC=C(F)C=C1O SBB063136 [1,1,0,0,0,0|2,0,0]=4 430 B11R1.166 O=[N+]([O-])C1=CC=C(O)C=C1F SBB063706 [1,1,0,0,0,0|2,0,0]=4 431 B11R1.166 OC(=O)C1=C(O)N=C(O)N=C1 SBB005851 [1,1,0,0,0,0|2,0,0]=4 432 B11R1.277 O=CC1=C(O)C=C(F)C(F)=C1 SBB087258 [1,1,0,0,0,0|1,0,0]=3 433 B11R1.277 O=CC1=CC(F)=C(Cl)C=C1Cl SBB064714 [1,1,0,0,0,0|2,0,0]=4 434 B11R1.277 O=CC1=CC(F)=C(F)C=C1F SBB047989 [1,1,0,0,0,0|2,0,0]=4 435 B11R1.278 C(=O)C1=C(O)C(O)=C(O)C=C1 SBB058739 [1,1,0,0,0,0|0,0,0]=2 436 B11R1.278 C(=O)C1=CC=C(F)C(F)=C1F SBB003969 [1,1,0,0,0,0|2,0,0]=4 437 B11R1.278 CC1=CC=C(C=O)C(F)=C1F SBB064653 [1,1,0,0,0,0|1,0,0]=3 438 B11R1.278 O=CC1=C(Cl)C(O)=C(O)C=C1 SBB035926 [1,1,0,0,0,0|1,0,0]=3 439 B11R1.278 O=CC1=CC=C(F)C(Cl)=C1F SBB064619 [1,1,0,0,0,0|2,0,0]=4 440 B11R1.278 O=CC1=CC=C(O)C(F)=C1F SBB052177 [1,1,0,0,0,0|1,0,0]=3 441 B11R1.464 C(=O)C1=C(C)C=C(O)C=C1C SBB008519 [1,1,0,0,0,0|1,0,0]=3 442 B11R1.464 C(=O)C1=C(O)C=C(Cl)C=C1Cl SBB017729 [1,1,0,0,0,0|1,0,0]=3 443 B11R1.464 CC1=CC(C)=C(C=O)C(C)=C1 SBB058390 [1,1,0,0,0,0|1,0,0]=3 444 B11R1.464 O=CC1=C(F)C=C(Br)C=C1F SBB064458 [1,1,0,0,0,0|2,0,0]=4 445 B11R1.464 O=CC1=C(F)C=C(Cl)C=C1F SBB089208 [1,1,0,0,0,0|2,0,0]=4 446 B11R1.464 O=CC1=C(F)C=C(F)C=C1F SBB064040 [1,1,0,0,0,0|2,0,0]=4 447 B11R1.464 O=CC1=C(F)C=C(O)C=C1F SBB087261 [1,1,0,0,0,0|1,0,0]=3 448 B11R1.14 COC1=CC(Br)=C(N)C(Br)=C1 SBB007585 [1,1,0,0,0,0|2,0,0]=4 449 B11R1.14 COC1=CC(F)=C(Br)C(F)=C1 SBB096411 [1,1,0,0,0,0|2,0,0]=4 450 B11R1.14 COC1=CC(F)=C(F)C(F)=C1 SBB087566 [1,1,0,0,0,0|2,0,0]=4 451 B11R1.14 COC1=CC(F)=C(N)C(F)=C1 SBB087343 [1,1,0,0,0,0|2,0,0]=4 452 B11R1.14 COC1=CC(F)=C(O)C(F)=C1 SBB087410 [1,1,0,0,0,0|1,0,1]=4 453 B11R1.21 CC(=O)C1=CC=C(O)C(O)=C1 SBB061719 [1,1,0,0,0,0|1,0,1]=4 454 B11R1.21 CC1=C(O)C=C(C(C)C)C=C1 SBB060790 [1,1,0,0,0,0|1,0,1]=4 455 B11R1.192 CCOC1=CC(Cl)=C(F)C=C1 SBB088965 [1,1,0,0,0,0|2,0,0]=4 456 B11R1.192 CCOC1=CC(F)=C(Cl)C=C1 SBB088963 [1,1,0,0,0,0|2,0,0]=4 457 B11R1.192 CCOC1=CC(F)=C(F)C=C1 SBB087276 [1,1,0,0,0,0|2,0,0]=4 458 B11R1.192 CCOC1=CC=C(N)C(F)=C1 SBB071686 [1,1,0,0,0,0|2,0,0]=4 459 B11R1.192 NCCC1=CC(O)=C(O)C=C1 SBB003668 [1,1,0,0,0,0|1,0,1]=4 460 B11R1.192 OC1=C(O)C=C(CCN)C=C1 SBB004044 [1,1,0,0,0,0|1,0,1]=4 461 B11R1.280 CCC1=CC(OC)=C(O)C=C1 SBB008068 [1,1,0,0,0,0|1,0,1]=4 462 B11R1.280 COC1=CC(CO)=C(Cl)C=C1 SBB068708 [1,1,0,0,0,0|1,0,0]=3 463 B11R1.280 COC1=CC=C(Br)C(C#N)=C1 SBB028776 [1,1,0,0,0,0|2,0,0]=4 464 B11R1.280 COC1=CC=C(Br)C(C=O)=C1 SBB063083 [1,1,0,0,0,0|1,0,1]=4 465 B11R1.280 COC1=CC=C(F)C(C#N)=C1 SBB055306 [1,1,0,0,0,0|2,0,0]=4 466 B11R1.280 COC1=CC=C(F)C(C=O)=C1 SBB063820 [1,1,0,0,0,0|1,0,1]=4 467 B11R1.280 COC1=CC=C(N)C(OC)=C1 SBB040471 [1,1,0,0,0,0|1,0,0]=3 468 B11R1.280 COC1=CC=C(N)C(OC)=N1 SBB000290 [1,1,0,0,0,0|2,0,0]=4 469 B11R1.280 COC1=CC=C(O)C(C=O)=C1 SBB063767 [1,1,0,0,0,0|0,0,2]=4 470 B13R1.120 O=C(O)C1=CC=C(C(=O)O)C(O)=C1 SBB052673 [0,2,0,0,0,0|2,0,0]=4 471 B13R1.120 O=C(O)C1=CC=C([N+](=O)[O-])C=C1O SBB063388 [0,2,0,0,0,0|2,0,0]=4 472 B13R1.652 COC1=CC(O)=C(C(C)=O)C=C1Cl SBB027139 [0,2,0,0,0,0|0,0,0]=2 473 B13R1.3088 COC(=O)C1=CC=C(OC)C(O)=C1 SBB064951 [0,2,0,0,0,0|2,0,0]=4 474 B13R1.3096 COC1=C(O)C(O)=C(C(C)=O)C=C1 SBB071454 [0,2,0,0,0,0|0,0,0]=2 475 B13R1.3096 COC1=CC=C(C(=O)O)C(F)=C1F SBB064407 [0,2,0,0,0,0|1,0,0]=3 476 B13R1.3096 COC1=CC=C([N+](=O)[O-])C(C)=C1C SBB064489 [0,2,0,0,0,0|2,0,0]=4 477 B13R1.99 COC1=CC(OC)=C(B(O)O)C=C1 SBB089843 [0,2,0,0,0,0|1,0,1]=4 478 B13R1.99 COC1=CC=C(C(=O)O)C(OC)=C1 SBB063086 [0,2,0,0,0,0|0,0,0]=2 479 B13R1.99 COC1=CC=C(C(=O)O)C(OC)=N1 SBB048106 [0,2,0,0,0,0|1,0,0]=3 480 B13R1.99 COC1=CC=C(C(C)=O)C(OC)=C1 SBB063154 [0,2,0,0,0,0|0,0,0]=2 481 B13R1.99 COC1=CC=C([N+](=O)[O-])C(OC)=C1 SBB064929 [0,2,0,0,0,0|1,0,0]=3 482 B13R1.434 COC1=CC(C)=C(C=O)C(OC)=C1 SBB052179 [0,2,0,0,0,0|0,0,0]=2 483 B13R1.434 COC1=CC(OC)=C(C=O)C(O)=C1 SBB057381 [0,2,0,0,0,0|0,0,0]=2 484 B13R1.1249 COC1=CC(OC)=C(N=C=S)C=C1 SBB030515 [0,2,0,0,0,0|0,1,1]=4 485 B13R1.1249 COC1=CC=C(N=C=O)C(OC)=C1 SBB048861 [0,2,0,0,0,0|0,0,1]=3 486 B13R1.2200 C(=O)C1=CC(Br)=C(OC)C=C1OC SBB000845 [0,2,0,0,0,0|0,0,0]=2 487 B13R1.2200 C(=O)C1=CC(OC)=C(OC)C=C1Br SBB003186 [0,2,0,0,0,0|1,0,0]=3 488 B13R1.2200 COC1=C(OC)C=C(C=O)C(C)=C1 SBB089663 [0,2,0,0,0,0|1,0,0]=3 489 B13R1.2200 COC1=C(OC)C=C(C=O)C(Cl)=C1 SBB035870 [0,2,0,0,0,0|1,0,0]=3 490 B13R1.2200 COC1=CC(F)=C(C=O)C=C1OC SBB064703 [0,2,0,0,0,0|1,0,0]=3 491 B13R1.2422 C(=O)C1=CC=C(OC)C(OC)=C1Cl SBB003539 [0,2,0,0,0,0|1,0,0]=3 492 B13R1.2422 COC1=C(OC)C(O)=C(C=O)C=C1 SBB079106 [0,2,0,0,0,0|0,0,0]=2 493 B13R1.2430 COC1=CC(B(O)O)=C(C=O)C=C1 SBB089593 [0,2,0,0,0,0|0,0,0]=2 494 B13R1.2430 COC1=CC(B(O)O)=C(OC)C=C1 SBB089842 [0,2,0,0,0,0|2,0,0]=4 495 B13R1.2430 COC1=CC=C(C=O)C([N+](=O)[O-])=C1 SBB052192 [0,2,0,0,0,0|0,0,1]=3 496 B13R1.2430 COC1=CC=C(OC)C(C(=O)O)=C1 SBB063982 [0,2,0,0,0,0|2,0,0]=4 497 B13R1.95 CCC(=O)C1=C(O)C=C(OC)C=C1 SBB027179 [0,2,0,0,0,0|0,0,0]=2 498 B13R1.95 COC(=O)C1=CC=C(OC)C=C1O SBB064005 [0,2,0,0,0,0|0,0,0]=2 499 B13R1.653 COC1=CC=C(CC(=O)O)C(Br)=C1 SBB065954 [0,2,0,0,0,0|1,0,0]=3 500 B13R1.653 COC1=CC=C(CC(=O)O)C(F)=C1 SBB064503 [0,2,0,0,0,0|1,0,0]=3 501 B13R1.653 COC1=CC=C(NC(C)=O)C(N)=C1 SBB055485 [0,2,0,0,0,0|1,0,0]=3 502 B13R1.1254 C(=O)C1=CC=C(OCC)C(F)=C1F SBB090373 [0,2,0,0,0,0|1,0,0]=3 503 B13R1.4031 C(=O)C1=C(F)C=C(OCC)C=C1F SBB090372 [0,2,0,0,0,0|1,0,0]=3 504 B13R1.426 COC1=C(C)C=C(C=O)C(C)=C1C SBB071610 [0,2,0,0,0,0|1,0,0]=3 505 B13R1.426 COC1=CC(C)=C(C=O)C(C)=C1C SBB010628 [0,2,0,0,0,0|1,0,0]=3 506 B13R1.428 COC1=CC(F)=C(C(=O)Cl)C(F)=C1 SBB093739 [0,2,0,0,0,0|1,0,0]=3 507 B13R1.428 COC1=CC(F)=C(C(=O)O)C(F)=C1 SBB090702 [0,2,0,0,0,0|1,0,0]=3 508 B13R1.428 COC1=CC(F)=C(C(N)=O)C(F)=C1 SBB090540 [0,2,0,0,0,0|1,0,0]=3 509 B13R1.428 COC1=CC(O)=C(C(C)=O)C(O)=C1 SBB089881 [0,2,0,0,0,0|0,0,0]=2 510 B11R1.189 COC1=CC=CC(CC=O)=C1 SBB052208 [0,0,1,1,0,0|1,0,1]=4 511 B11R1.265 COC1=C(C=O)C(O)=CC=C1 SBB042847 [0,0,1,1,0,0|0,0,2]=4 512 B11R1.265 COC1=CC=CC(F)=C1C=O SBB086986 [0,0,1,1,0,0|1,0,1]=4 513 B11R1.265 COC1=CC=CC(F)=C1CO SBB087141 [0,0,1,1,0,0|1,0,1]=4 514 B11R1.44 COC(=O)C1=CC(C=O)=CS1 SBB051469 [0,0,1,1,0,0|1,1,0]=4 515 B11R2.36 CC1=CC2=C(C=CN2)C=C1 SBB047999 [1,0,0,1,0,0|2,0,0]=4 516 B11R2.36 OC1=CC2=C(C=C1)C=NO2 SBB074225 [1,0,0,1,0,0|1,0,0]=3 517 B11R2.36 OC1=CC2=C(C=C1)OCO2 SBB085996 [1,0,0,1,0,0|2,0,0]=4 518 B11R2.36 OC1=CC=C2C=CNC2=C1 SBB085833 [1,0,0,1,0,0|2,0,0]=4 519 B13R2.57 COC1=CC2=C(C=C1)N=CC=C2 SBB008352 [0,1,0,1,0,0|2,0,0]=4 520 B13R2.57 COC1=CC=C2C=CC=CC2=C1 SBB060603 [0,1,0,1,0,0|2,0,0]=4 521 B13R2.2130 COC1=CC2=C(C=C1)C(=O)CC2 SBB066990 [0,1,0,1,0,0|1,0,0]=3 522 B13R2.2130 COC1=CC=C2C(=O)COC2=C1 SBB038186 [0,1,0,1,0,0|0,0,0]=2 523 B13R2.2121 COC1=CC2=C(C=C1)NC(=O)N2 SBB059283 [0,1,0,1,0,0|1,0,0]=3 524 B13R2.2121 COC1=CC2=C(C=C1)NC(C)=C2 SBB048388 [0,1,0,1,0,0|2,0,0]=4 525 B13R2.2121 COC1=CC2=C(C=C1)NC(S)=N2 SBB000219 [0,1,0,1,0,0|1,1,0]=4 526 B13R2.2121 COC1=CC2=C(C=C1)SC(C)=N2 SBB059122 [0,1,0,1,0,0|2,0,0]=4 527 B13R2.2121 COC1=CC2=C(C=C1)[Se]C(C)=N2 SBB057619 [0,1,0,1,0,0|2,0,0]=4 528 B13R2.2121 COC1=CC=C2NC(C)=NC2=C1 SBB056010 [0,1,0,1,0,0|2,0,0]=4 529 B13R2.2121 COC1=CC=C2NC(N)=NC2=C1 SBB051993 [0,1,0,1,0,0|2,0,0]=4 530 B13R2.2121 COC1=CC=C2OC(S)=NC2=C1 SBB046565 [0,1,0,1,0,0|1,1,0]=4 531 B13R2.2121 COC1=CC=C2SC(N)=NC2=C1 SBB051982 [0,1,0,1,0,0|2,0,0]=4 532 B13R2.2121 NC1=NC2=C(C=C(OC)C=C2)S1 SBB003746 [0,1,0,1,0,0|1,1,0]=4 533 B13R2.599 CC1=C(C=O)C=C2OCOC2=C1 SBB300950 [0,1,0,1,0,0|1,0,0]=3 534 B13R2.599 COC1=CC2=C(C=C1N)OCO2 SBB014408 [0,1,0,1,0,0|2,0,0]=4 535 B13R2.599 O=CC1=CC2=C(C=C1Br)OCO2 SBB001594 [0,1,0,1,0,0|1,0,0]=3 536 B13R2.599 O=CC1=CC2=C(C=C1Cl)OCO2 SBB027268 [0,1,0,1,0,0|1,0,0]=3 537 B9R1.21 CCC1=CC=C(C=O)O1 SBB010056 [1,0,0,0,1,0|2,0,0]=4 538 B9R1.21 CCC1=CC=C(C=O)S1 SBB028644 [1,0,0,0,1,0|2,0,0]=4 539 B9R1.21 CSC1=CC=C(C=O)S1 SBB087319 [1,0,0,0,1,0|1,1,0]=4 540 B9R1.22 CC1=CC(C)=C(C=O)N1 SBB066755 [1,0,0,0,1,0|2,0,0]=4 541 B9R1.22 CC1=CC(C=O)=C(C)S1 SBB009464 [1,0,0,0,1,0|2,0,0]=4 542 B11R1.9 COC1=CC(O)=CC(OC)=C1 SBB071724 [0,0,0,0,1,1|2,0,0]=4 543 B11R1.267 COC1=C(F)C(C=O)=CC=C1 SBB068762 [0,0,0,0,1,1|1,0,0]=3 544 B11R1.267 COC1=CC=CC(C#N)=C1O SBB055374 [0,0,0,0,1,1|1,0,1]=4 545 B11R1.267 COC1=CC=CC(C=O)=C1O SBB000109 [0,0,0,0,1,1|0,0,0]=2 546 B11R1.267 COC1=CC=CC(CN)=C1O SBB080389 [0,0,0,0,1,1|1,0,1]=4 547 B11R1.267 COC1=CC=CC(CO)=C1O SBB064806 [0,0,0,0,1,1|0,0,2]=4 548 B11R1.267 COC1=CC=CC(OC)=C1O SBB056797 [0,0,0,0,1,1|2,0,0]=4