0 B9R1.8 BrCCC1=CC=CC=C1 SBB059945 [0,0,0,0,0,0|1,0,0]=1 1 B9R1.8 BrCCC1=NC=CC=C1 SBB014931 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.8 CCCC1=CC=CC=C1 SBB061210 [0,0,0,0,0,0|1,0,0]=1 3 B9R1.8 CCNC1=CC=CC=C1 SBB058818 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.8 CNCC1=CC=CC=C1 SBB073015 [0,0,0,0,0,0|2,0,0]=2 5 B9R1.8 CNCC1=CC=CN=C1 SBB052430 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.8 CNCC1=CC=NC=C1 SBB047816 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.8 CNCC1=NC=CC=C1 SBB052457 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.8 CNCC1=NC=CN=C1 SBB014431 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.8 COCC1=CC=CC=C1 SBB063549 [0,0,0,0,0,0|2,0,0]=2 10 B9R1.8 ClCCC1=NC=CC=C1 SBB014886 [0,0,0,0,0,0|2,0,0]=2 11 B9R1.8 N#CCC1=CC=CC=C1 SBB058386 [0,0,0,0,0,0|1,0,1]=2 12 B9R1.8 N#CCC1=CC=CN=C1 SBB027148 [0,0,0,0,0,0|2,0,1]=3 13 B9R1.8 N#CCC1=CC=NC=C1 SBB066966 [0,0,0,0,0,0|2,0,1]=3 14 B9R1.8 N#CCC1=NC=CC=C1 SBB049639 [0,0,0,0,0,0|2,0,1]=3 15 B9R1.8 N#CSC1=CC=CC=C1 SBB060831 [0,0,0,0,0,0|2,0,1]=3 16 B9R1.8 NCCC1=CC=CC=C1 SBB058801 [0,0,0,0,0,0|1,0,0]=1 17 B9R1.8 NCCC1=CC=CN=C1 SBB028204 [0,0,0,0,0,0|2,0,0]=2 18 B9R1.8 NCCC1=CC=CN=C1 SBB052465 [0,0,0,0,0,0|2,0,0]=2 19 B9R1.8 NCCC1=CC=NC=C1 SBB014221 [0,0,0,0,0,0|2,0,0]=2 20 B9R1.8 NCCC1=NC=CC=C1 SBB028206 [0,0,0,0,0,0|2,0,0]=2 21 B9R1.8 NCCC1=NC=CN=C1 SBB010197 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.8 NNCC1=CC=CC=C1 SBB063024 [0,0,0,0,0,0|2,0,0]=2 23 B9R1.8 NOCC1=CC=CC=C1 SBB003971 [0,0,0,0,0,0|2,0,0]=2 24 B9R1.8 NOCC1=CC=CC=C1 SBB032957 [0,0,0,0,0,0|2,0,0]=2 25 B9R1.8 O=CCC1=CC=CC=C1 SBB061710 [0,0,0,0,0,0|0,1,1]=2 26 B9R1.8 O=CNC1=CC=CC=C1 SBB058769 [0,0,0,0,0,0|1,1,1]=3 27 B9R1.8 O=S=NC1=CC=CC=C1 SBB007761 [0,0,0,0,0,0|2,1,0]=3 28 B9R1.8 OCCC1=CC=CC=C1 SBB040879 [0,0,0,0,0,0|0,1,0]=1 29 B9R1.8 O\N=C\C1=CC=CN=C1 SBB004285 [0,0,0,0,0,0|2,1,1]=4 30 B9R1.8 O\N=C\C1=NC=CC=C1 SBB004284 [0,0,0,0,0,0|2,1,1]=4 31 B9R1.8 S=C=NC1=CC=CC=C1 SBB040940 [0,0,0,0,0,0|1,0,2]=3 32 B9R1.8 SCCC1=CC=NC=C1 SBB065275 [0,0,0,0,0,0|1,0,0]=1 33 B9R1.8 SCCC1=NC=CN=C1 SBB067078 [0,0,0,0,0,0|2,0,0]=2 34 B8R1.2 BrCC1=CC=NC=C1 SBB054924 [1,0,0,0,0,0|2,0,0]=3 35 B8R1.2 BrCC1=NC=CC=C1 SBB054926 [1,0,0,0,0,0|2,0,0]=3 36 B8R1.2 C#CC1=CC=CC=C1 SBB040919 [1,0,0,0,0,0|0,0,2]=3 37 B8R1.2 C#CC1=CC=CC=N1 SBB006619 [1,0,0,0,0,0|1,0,2]=4 38 B8R1.2 C#CC1=CC=CN=C1 SBB065464 [1,0,0,0,0,0|1,0,2]=4 39 B8R1.2 C#CC1=CC=NC=C1 SBB055516 [1,0,0,0,0,0|1,0,2]=4 40 B8R1.2 C#CC1=CC=NC=C1 SBB065466 [1,0,0,0,0,0|1,0,2]=4 41 B8R1.2 CCC1=CC=CC=C1 SBB040891 [1,0,0,0,0,0|0,0,0]=1 42 B8R1.2 CCC1=CC=CC=N1 SBB060373 [1,0,0,0,0,0|1,0,0]=2 43 B8R1.2 CCC1=CC=NC=C1 SBB061128 [1,0,0,0,0,0|1,0,0]=2 44 B8R1.2 CCC1=CN=CC=C1 SBB060374 [1,0,0,0,0,0|1,0,0]=2 45 B8R1.2 CNC1=CC=CC=C1 SBB008162 [1,0,0,0,0,0|1,0,0]=2 46 B8R1.2 CNC1=CC=CC=C1 SBB059778 [1,0,0,0,0,0|1,0,0]=2 47 B8R1.2 CNC1=NC=CN=C1 SBB018751 [1,0,0,0,0,0|3,0,0]=4 48 B8R1.2 ClCC1=CC=NC=C1 SBB003917 [1,0,0,0,0,0|2,0,0]=3 49 B8R1.2 ClCC1=NC=CC=C1 SBB054925 [1,0,0,0,0,0|2,0,0]=3 50 B8R1.2 N#CC1=CC=CC=C1 SBB028746 [1,0,0,0,0,0|1,0,1]=3 51 B8R1.2 N#CC1=CC=CN=C1 SBB007554 [1,0,0,0,0,0|2,0,1]=4 52 B8R1.2 N#CC1=CC=NC=C1 SBB008923 [1,0,0,0,0,0|2,0,1]=4 53 B8R1.2 N#CC1=NC=CC=C1 SBB008920 [1,0,0,0,0,0|2,0,1]=4 54 B8R1.2 NCC1=CC=CC=C1 SBB040473 [1,0,0,0,0,0|1,0,0]=2 55 B8R1.2 NCC1=CC=CN=C1 SBB004351 [1,0,0,0,0,0|2,0,0]=3 56 B8R1.2 NCC1=CC=NC=C1 SBB004350 [1,0,0,0,0,0|2,0,0]=3 57 B8R1.2 NCC1=NC=CC=C1 SBB004352 [1,0,0,0,0,0|2,0,0]=3 58 B8R1.2 NCC1=NC=CN=C1 SBB014584 [1,0,0,0,0,0|3,0,0]=4 59 B8R1.2 NCC1=NC=NC=C1 SBB086444 [1,0,0,0,0,0|3,0,0]=4 60 B8R1.2 NNC1=CC=CC=C1 SBB040886 [1,0,0,0,0,0|2,0,0]=3 61 B8R1.2 NNC1=CC=NC=C1 SBB018987 [1,0,0,0,0,0|3,0,0]=4 62 B8R1.2 O=CC1=CC=CN=C1 SBB004359 [1,0,0,0,0,0|1,1,1]=4 63 B8R1.2 O=CC1=CC=NC=C1 SBB004357 [1,0,0,0,0,0|1,1,1]=4 64 B8R1.2 O=CC1=NC=CC=C1 SBB004358 [1,0,0,0,0,0|1,1,1]=4 65 B8R1.2 OCC1=CC=CC=C1 SBB058558 [1,0,0,0,0,0|0,1,0]=2 66 B8R1.2 OCC1=CC=CN=C1 SBB004344 [1,0,0,0,0,0|1,1,0]=3 67 B8R1.2 OCC1=CC=CN=N1 SBB054829 [1,0,0,0,0,0|2,1,0]=4 68 B8R1.2 OCC1=CC=NC=C1 SBB004347 [1,0,0,0,0,0|1,1,0]=3 69 B8R1.2 OCC1=CN=CN=C1 SBB065691 [1,0,0,0,0,0|2,1,0]=4 70 B8R1.2 OCC1=NC=CC=C1 SBB004348 [1,0,0,0,0,0|1,1,0]=3 71 B8R1.2 OCC1=NC=CN=C1 SBB054824 [1,0,0,0,0,0|2,1,0]=4 72 B8R1.2 OCC1=NC=NC=C1 SBB054828 [1,0,0,0,0,0|2,1,0]=4 73 B8R1.2 ONC1=CC=CC=C1 SBB008413 [1,0,0,0,0,0|1,1,0]=3 74 B8R1.2 [NH+]1=CC=CC(CCl)=C1 SBB061738 [1,0,0,0,0,0|2,0,0]=3 75 B8R1.2 [NH3+]NC1=CC=CC=C1 SBB060000 [1,0,0,0,0,0|2,0,0]=3 76 B10R1.1 C=COC1=CC=C(N)C=C1 SBB010266 [0,1,0,0,0,0|2,0,1]=4 77 B10R1.1 CC1=CC=C(CC#N)C=C1 SBB063995 [0,1,0,0,0,0|1,0,1]=3 78 B10R1.1 CC1=CC=C(CC=O)C=C1 SBB052212 [0,1,0,0,0,0|0,1,1]=3 79 B10R1.1 CC1=CC=C(CON)C=C1 SBB021738 [0,1,0,0,0,0|2,0,0]=3 80 B10R1.1 CC1=CC=C(N=C=O)C=C1 SBB061737 [0,1,0,0,0,0|1,1,1]=4 81 B10R1.1 CC1=CC=C(N=C=S)C=C1 SBB008290 [0,1,0,0,0,0|1,0,2]=4 82 B10R1.1 CC1=CC=C(NC=O)C=C1 SBB085897 [0,1,0,0,0,0|1,1,1]=4 83 B10R1.1 CCCC1=CC=C(N)C=C1 SBB008337 [0,1,0,0,0,0|1,0,0]=2 84 B10R1.1 CCCC1=CC=C(O)C=C1 SBB055506 [0,1,0,0,0,0|1,0,0]=2 85 B10R1.1 CCCC1=CN=C(Cl)N=C1 SBB054517 [0,1,0,0,0,0|3,0,0]=4 86 B10R1.1 CCCC1=CN=C(S)N=C1 SBB066482 [0,1,0,0,0,0|3,0,0]=4 87 B10R1.1 CCOC1=CC=C(Br)C=C1 SBB059353 [0,1,0,0,0,0|2,0,0]=3 88 B10R1.1 CCOC1=CC=C(C)C=C1 SBB060988 [0,1,0,0,0,0|2,0,0]=3 89 B10R1.1 CCOC1=CC=C(Cl)C=C1 SBB040853 [0,1,0,0,0,0|2,0,0]=3 90 B10R1.1 CCOC1=CC=C(F)C=C1 SBB086157 [0,1,0,0,0,0|2,0,0]=3 91 B10R1.1 CCOC1=CC=C(N)C=C1 SBB040442 [0,1,0,0,0,0|2,0,0]=3 92 B10R1.1 CCOC1=CC=C(N)C=C1 SBB073014 [0,1,0,0,0,0|2,0,0]=3 93 B10R1.1 CCOC1=CC=C(O)C=C1 SBB043810 [0,1,0,0,0,0|2,0,0]=3 94 B10R1.1 CCOC1=NC=C(Br)C=C1 SBB054264 [0,1,0,0,0,0|3,0,0]=4 95 B10R1.1 CCSC1=CC=C(N)C=C1 SBB071614 [0,1,0,0,0,0|2,0,0]=3 96 B10R1.1 CNCC1=CC=C(C)C=C1 SBB079252 [0,1,0,0,0,0|2,0,0]=3 97 B10R1.1 CNCC1=CC=C(Cl)C=C1 SBB010371 [0,1,0,0,0,0|2,0,0]=3 98 B10R1.1 CNCC1=CC=C(F)C=C1 SBB005902 [0,1,0,0,0,0|2,0,0]=3 99 B10R1.1 CNCC1=CC=C(O)C=C1 SBB046545 [0,1,0,0,0,0|2,0,0]=3 100 B10R1.1 FC1=CC=C(CCCl)C=C1 SBB087329 [0,1,0,0,0,0|1,0,0]=2 101 B10R1.1 FC1=CC=C(C[Zn]Cl)C=C1 SBB094275 [0,1,0,0,0,0|2,0,0]=3 102 B10R1.1 FC1=CC=C(N=C=S)C=C1 SBB055076 [0,1,0,0,0,0|1,0,2]=4 103 B10R1.1 N#CCC1=CC=C(Br)C=C1 SBB055164 [0,1,0,0,0,0|1,0,1]=3 104 B10R1.1 N#CCC1=CC=C(Cl)C=C1 SBB004060 [0,1,0,0,0,0|1,0,1]=3 105 B10R1.1 N#CCC1=CC=C(F)C=C1 SBB063691 [0,1,0,0,0,0|1,0,1]=3 106 B10R1.1 N#CCC1=CC=C(N)C=C1 SBB004218 [0,1,0,0,0,0|1,0,1]=3 107 B10R1.1 N#CCC1=CC=C(O)C=C1 SBB063205 [0,1,0,0,0,0|1,0,1]=3 108 B10R1.1 NC1=CC=C(CCO)C=C1 SBB042772 [0,1,0,0,0,0|0,1,0]=2 109 B10R1.1 NCCC1=CC=C(F)C=C1 SBB003787 [0,1,0,0,0,0|1,0,0]=2 110 B10R1.1 NCCC1=CC=C(F)C=C1 SBB058811 [0,1,0,0,0,0|1,0,0]=2 111 B10R1.1 NCCC1=CC=C(O)C=C1 SBB003808 [0,1,0,0,0,0|1,0,0]=2 112 B10R1.1 O=C=NC1=CC=C(Cl)C=C1 SBB058877 [0,1,0,0,0,0|1,1,1]=4 113 B10R1.1 O=C=NC1=CC=C(F)C=C1 SBB032971 [0,1,0,0,0,0|1,1,1]=4 114 B10R1.1 O=CCC1=CC=C(Br)C=C1 SBB052205 [0,1,0,0,0,0|0,1,1]=3 115 B10R1.1 O=CCC1=CC=C(F)C=C1 SBB052206 [0,1,0,0,0,0|0,1,1]=3 116 B10R1.1 OCCC1=CC=C(Br)C=C1 SBB055082 [0,1,0,0,0,0|0,1,0]=2 117 B10R1.1 OCCC1=CC=C(F)C=C1 SBB086156 [0,1,0,0,0,0|0,1,0]=2 118 B10R1.1 OCCC1=CC=C(O)C=C1 SBB086008 [0,1,0,0,0,0|0,1,0]=2 119 B10R1.1 O\N=C\C1=CC=C(Cl)C=C1 SBB028657 [0,1,0,0,0,0|1,1,1]=4 120 B10R1.1 O\N=C\C1=CC=C(F)C=C1 SBB061927 [0,1,0,0,0,0|1,1,1]=4 121 B10R1.1 O\N=C\C1=CC=C(I)C=C1 SBB062104 [0,1,0,0,0,0|1,1,1]=4 122 B10R1.1 O\N=C\C1=CC=C(O)C=C1 SBB080079 [0,1,0,0,0,0|1,1,1]=4 123 B10R1.1 S=C=NC1=CC=C(Br)C=C1 SBB014109 [0,1,0,0,0,0|1,0,2]=4 124 B10R1.1 S=C=NC1=CC=C(Cl)C=C1 SBB040939 [0,1,0,0,0,0|1,0,2]=4 125 B10R1.1 S=C=NC1=CC=C(I)C=C1 SBB102379 [0,1,0,0,0,0|1,0,2]=4 126 B10R1.4 C(=O)NC1=CC=CC=C1Cl SBB004025 [0,1,0,0,0,0|1,1,1]=4 127 B10R1.4 C=CCC1=CC=CC=C1O SBB044905 [0,1,0,0,0,0|1,0,1]=3 128 B10R1.4 C=CCN1C=CC=CC1=O SBB007666 [0,1,0,0,0,0|2,0,1]=4 129 B10R1.4 CC1=C(N=C=S)C=CC=C1 SBB006592 [0,1,0,0,0,0|1,0,2]=4 130 B10R1.4 CC1=CC=CC=C1CC#N SBB058333 [0,1,0,0,0,0|1,0,1]=3 131 B10R1.4 CCCC1=CC=CC=C1N SBB085906 [0,1,0,0,0,0|1,0,0]=2 132 B10R1.4 CCCN1C=CC=CC1=O SBB008029 [0,1,0,0,0,0|2,0,0]=3 133 B10R1.4 CCNC1=CC=CC=C1N SBB111820 [0,1,0,0,0,0|2,0,0]=3 134 B10R1.4 CCOC1=C(F)C=CC=C1 SBB086154 [0,1,0,0,0,0|2,0,0]=3 135 B10R1.4 CCOC1=C(N)N=CC=C1 SBB014971 [0,1,0,0,0,0|3,0,0]=4 136 B10R1.4 CCOC1=CC=CC=C1C SBB060978 [0,1,0,0,0,0|2,0,0]=3 137 B10R1.4 CCOC1=CC=CC=C1Cl SBB061024 [0,1,0,0,0,0|2,0,0]=3 138 B10R1.4 CCOC1=CC=CC=C1O SBB060424 [0,1,0,0,0,0|2,0,0]=3 139 B10R1.4 CNCC1=C(Br)C=CC=C1 SBB092552 [0,1,0,0,0,0|2,0,0]=3 140 B10R1.4 CNCC1=CC=CC=C1Cl SBB010370 [0,1,0,0,0,0|2,0,0]=3 141 B10R1.4 CNCC1=CC=CC=C1F SBB086087 [0,1,0,0,0,0|2,0,0]=3 142 B10R1.4 C\C=C\C1=C(O)C=CC=C1 SBB071429 [0,1,0,0,0,0|1,0,2]=4 143 B10R1.4 FC1=C(CCBr)C=CC=C1 SBB018050 [0,1,0,0,0,0|1,0,0]=2 144 B10R1.4 FC1=C(N=C=S)C=CC=C1 SBB006546 [0,1,0,0,0,0|1,0,2]=4 145 B10R1.4 N#CCC1=CC=CC=C1Cl SBB063987 [0,1,0,0,0,0|1,0,1]=3 146 B10R1.4 N#CCC1=CC=CC=C1F SBB063693 [0,1,0,0,0,0|1,0,1]=3 147 B10R1.4 N#CCC1=CC=CC=C1N SBB064661 [0,1,0,0,0,0|1,0,1]=3 148 B10R1.4 NC1=C(OCC)C=CC=C1 SBB006726 [0,1,0,0,0,0|2,0,0]=3 149 B10R1.4 NNCC1=CC=CC=C1Cl SBB010382 [0,1,0,0,0,0|2,0,0]=3 150 B10R1.4 O=C=NC1=CC=CC=C1Br SBB046942 [0,1,0,0,0,0|1,1,1]=4 151 B10R1.4 O=C=NC1=CC=CC=C1Cl SBB061771 [0,1,0,0,0,0|1,1,1]=4 152 B10R1.4 O=C=NC1=CC=CC=C1F SBB054883 [0,1,0,0,0,0|1,1,1]=4 153 B10R1.4 OCCC1=C(F)C=CC=C1 SBB086155 [0,1,0,0,0,0|0,1,0]=2 154 B10R1.4 O\N=C\C1=C(F)C=CC=C1 SBB086056 [0,1,0,0,0,0|1,1,1]=4 155 B10R1.4 O\N=C\C1=CC=CC=C1Cl SBB061849 [0,1,0,0,0,0|1,1,1]=4 156 B10R1.4 O\N=C\C1=CC=CC=C1O SBB080181 [0,1,0,0,0,0|1,1,1]=4 157 B10R1.4 S=C=NC1=C(Cl)C=CC=C1 SBB006587 [0,1,0,0,0,0|1,0,2]=4 158 B10R1.10 CC1=CC(N=C=O)=CC=C1 SBB064239 [0,1,0,0,0,0|1,1,1]=4 159 B10R1.10 CC1=CC=CC(CC#N)=C1 SBB068545 [0,1,0,0,0,0|1,0,1]=3 160 B10R1.10 CCOC1=CC(N)=CC=C1 SBB059860 [0,1,0,0,0,0|2,0,0]=3 161 B10R1.10 CCOC1=CC=CC(C)=C1 SBB060989 [0,1,0,0,0,0|2,0,0]=3 162 B10R1.10 CCOC1=CC=CC(O)=C1 SBB005788 [0,1,0,0,0,0|2,0,0]=3 163 B10R1.10 CNCC1=CC(O)=CC=C1 SBB046532 [0,1,0,0,0,0|2,0,0]=3 164 B10R1.10 CNCC1=NC(C)=CC=C1 SBB110044 [0,1,0,0,0,0|3,0,0]=4 165 B10R1.10 FC1=CC=CC(C[Zn]Cl)=C1 SBB094274 [0,1,0,0,0,0|2,0,0]=3 166 B10R1.10 FC1=CC=CC(N=C=S)=C1 SBB006700 [0,1,0,0,0,0|1,0,2]=4 167 B10R1.10 N#CCC1=CC(Br)=CC=C1 SBB006625 [0,1,0,0,0,0|1,0,1]=3 168 B10R1.10 N#CCC1=CC(Cl)=CC=C1 SBB057203 [0,1,0,0,0,0|1,0,1]=3 169 B10R1.10 N#CCC1=CC=CC(F)=C1 SBB063692 [0,1,0,0,0,0|1,0,1]=3 170 B10R1.10 NNCC1=CC(O)=CC=C1 SBB003436 [0,1,0,0,0,0|2,0,0]=3 171 B10R1.10 O=C=NC1=CC(Br)=CC=C1 SBB046967 [0,1,0,0,0,0|1,1,1]=4 172 B10R1.10 O=C=NC1=CC(Cl)=CC=C1 SBB058900 [0,1,0,0,0,0|1,1,1]=4 173 B10R1.10 O=C=NC1=CC=CC(F)=C1 SBB048876 [0,1,0,0,0,0|1,1,1]=4 174 B10R1.10 OCCC1=CC(F)=CC=C1 SBB055447 [0,1,0,0,0,0|0,1,0]=2 175 B10R1.10 O\N=C\C1=CC(Cl)=CC=C1 SBB087091 [0,1,0,0,0,0|1,1,1]=4 176 B10R1.10 O\N=C\C1=CC(F)=CC=C1 SBB086054 [0,1,0,0,0,0|1,1,1]=4 177 B10R1.10 O\N=C\C1=CC=CC(O)=C1 SBB028669 [0,1,0,0,0,0|1,1,1]=4 178 B10R1.10 S=C=NC1=CC(Br)=CC=C1 SBB094911 [0,1,0,0,0,0|1,0,2]=4 179 B10R1.10 S=C=NC1=CC(Cl)=CC=C1 SBB006588 [0,1,0,0,0,0|1,0,2]=4 180 B10R1.15 BrCC(Br)C1=CC=CC=C1 SBB058656 [0,1,0,0,0,0|1,0,0]=2 181 B10R1.15 C#CC(=O)C1=CC=CC=C1 SBB012771 [0,1,0,0,0,0|1,0,2]=4 182 B10R1.15 C#CC(O)C1=CC=CC=C1 SBB008986 [0,1,0,0,0,0|1,0,1]=3 183 B10R1.15 C(=O)C(C)C1=CC=CC=C1 SBB007693 [0,1,0,0,0,0|0,1,1]=3 184 B10R1.15 CC(CN)C1=CC=CC=C1 SBB028247 [0,1,0,0,0,0|1,0,0]=2 185 B10R1.15 CC(CO)C1=CC=CC=C1 SBB007853 [0,1,0,0,0,0|0,1,0]=2 186 B10R1.15 CCC(=O)C1=CC=CC=C1 SBB058853 [0,1,0,0,0,0|1,0,1]=3 187 B10R1.15 CCC(=O)C1=CC=NC=C1 SBB068976 [0,1,0,0,0,0|2,0,1]=4 188 B10R1.15 CCC(Br)C1=CC=CC=C1 SBB060201 [0,1,0,0,0,0|1,0,0]=2 189 B10R1.15 CCC(C)C1=CC=CC=C1 SBB060615 [0,1,0,0,0,0|1,0,0]=2 190 B10R1.15 CCC(N)C1=CC=CC=C1 SBB029878 [0,1,0,0,0,0|1,0,0]=2 191 B10R1.15 CCC(N)C1=CC=CC=C1 SBB080382 [0,1,0,0,0,0|1,0,0]=2 192 B10R1.15 CCC(O)C1=CC=CC=C1 SBB058750 [0,1,0,0,0,0|1,0,0]=2 193 B10R1.15 CN(C=O)C1=CC=CC=C1 SBB056830 [0,1,0,0,0,0|1,1,1]=4 194 B10R1.15 CNC(=O)C1=CC=CC=C1 SBB051421 [0,1,0,0,0,0|2,0,1]=4 195 B10R1.15 COC(=N)C1=CC=CC=C1 SBB055305 [0,1,0,0,0,0|2,0,1]=4 196 B10R1.15 COC(=O)C1=CC=CC=C1 SBB058212 [0,1,0,0,0,0|2,0,1]=4 197 B10R1.15 C[C@H](CN)C1=CC=CC=C1 SBB052360 [0,1,0,0,0,0|1,0,0]=2 198 B10R1.15 C\C(=N/N)C1=CC=CC=C1 SBB069878 [0,1,0,0,0,0|2,0,1]=4 199 B10R1.15 C\C(=N\O)C1=CC=CC=C1 SBB085898 [0,1,0,0,0,0|1,1,1]=4 200 B10R1.15 ClCC(Cl)C1=CC=CC=C1 SBB007931 [0,1,0,0,0,0|1,0,0]=2 201 B10R1.15 N#CC(=O)C1=CC=CC=C1 SBB058756 [0,1,0,0,0,0|1,0,2]=4 202 B10R1.15 N#CC(Br)C1=CC=CC=C1 SBB061313 [0,1,0,0,0,0|1,0,1]=3 203 B10R1.15 N#CC(N)C1=CC=CC=C1 SBB003872 [0,1,0,0,0,0|1,0,1]=3 204 B10R1.15 NCC(=O)C1=CC=CC=C1 SBB063139 [0,1,0,0,0,0|1,0,1]=3 205 B10R1.15 NCC(=O)C1=CC=CC=C1 SBB066026 [0,1,0,0,0,0|1,0,1]=3 206 B10R1.15 NCC(O)C1=CC=CC=C1 SBB063224 [0,1,0,0,0,0|1,0,0]=2 207 B10R1.15 NNC(=O)C1=CC=CC=C1 SBB040976 [0,1,0,0,0,0|2,0,1]=4 208 B10R1.15 N[C@H](CO)C1=CC=CC=C1 SBB006667 [0,1,0,0,0,0|0,1,0]=2 209 B10R1.15 N\C(=N/O)C1=CC=CC=C1 SBB015043 [0,1,0,0,0,0|1,1,1]=4 210 B10R1.15 N\C(=N/O)C1=CC=CC=C1 SBB055109 [0,1,0,0,0,0|1,1,1]=4 211 B10R1.15 O=C(CBr)C1=CC=NC=C1 SBB051672 [0,1,0,0,0,0|2,0,1]=4 212 B10R1.15 O=C(CBr)C1=CN=CC=C1 SBB005582 [0,1,0,0,0,0|2,0,1]=4 213 B10R1.15 O=C(CBr)C1=NC=CC=C1 SBB005581 [0,1,0,0,0,0|2,0,1]=4 214 B10R1.15 O=C(CO)C1=CC=CC=C1 SBB085926 [0,1,0,0,0,0|0,1,1]=3 215 B10R1.15 O=C(NO)C1=CC=CC=C1 SBB058405 [0,1,0,0,0,0|1,1,1]=4 216 B10R1.15 O=CC(=O)C1=CC=CC=C1 SBB068905 [0,1,0,0,0,0|0,1,2]=4 217 B10R1.15 OCC(O)C1=CC=CC=C1 SBB063119 [0,1,0,0,0,0|0,1,0]=2 218 B10R1.15 O[C@@H](CCl)C1=CC=CC=C1 SBB064282 [0,1,0,0,0,0|1,0,0]=2 219 B10R1.15 [NH3+]CC(=O)C1=CC=CC=C1 SBB061439 [0,1,0,0,0,0|1,0,1]=3 220 B10R1.17 BrCCCC1=CN=CC=C1 SBB014930 [0,1,0,0,0,0|2,0,0]=3 221 B10R1.17 BrCCOC1=CC=CC=C1 SBB042586 [0,1,0,0,0,0|1,0,0]=2 222 B10R1.17 BrCCSC1=CC=CC=C1 SBB059699 [0,1,0,0,0,0|1,0,0]=2 223 B10R1.17 C#CCNC1=CC=CC=C1 SBB010262 [0,1,0,0,0,0|1,0,1]=3 224 B10R1.17 C#CCOC1=CC=CC=C1 SBB008983 [0,1,0,0,0,0|1,0,1]=3 225 B10R1.17 C(=O)CCC1=CC=CC=C1 SBB006730 [0,1,0,0,0,0|0,1,0]=2 226 B10R1.17 C(=O)NNC1=CC=CC=C1 SBB008261 [0,1,0,0,0,0|1,1,1]=4 227 B10R1.17 C=CCCC1=CC=CC=C1 SBB008476 [0,1,0,0,0,0|1,0,0]=2 228 B10R1.17 CCCNC1=CC=CC=C1 SBB059800 [0,1,0,0,0,0|1,0,0]=2 229 B10R1.17 CCCOC1=CC=CC=C1 SBB061098 [0,1,0,0,0,0|1,0,0]=2 230 B10R1.17 CCNCC1=CC=CC=C1 SBB058765 [0,1,0,0,0,0|1,0,0]=2 231 B10R1.17 CCNCC1=CC=NC=C1 SBB058813 [0,1,0,0,0,0|2,0,0]=3 232 B10R1.17 CCOCC1=CC=CC=C1 SBB061196 [0,1,0,0,0,0|1,0,0]=2 233 B10R1.17 CCSCC1=CC=CC=C1 SBB061362 [0,1,0,0,0,0|1,0,0]=2 234 B10R1.17 CNCCC1=NC=CC=C1 SBB017551 [0,1,0,0,0,0|2,0,0]=3 235 B10R1.17 CNCCC1=NC=CC=C1 SBB040053 [0,1,0,0,0,0|2,0,0]=3 236 B10R1.17 ClCCCC1=CC=CC=C1 SBB061361 [0,1,0,0,0,0|1,0,0]=2 237 B10R1.17 ClCOCC1=CC=CC=C1 SBB064207 [0,1,0,0,0,0|1,0,0]=2 238 B10R1.17 ClCSCC1=CC=CC=C1 SBB055458 [0,1,0,0,0,0|1,0,0]=2 239 B10R1.17 ClC\C=C\C1=CC=CC=C1 SBB040602 [0,1,0,0,0,0|1,0,1]=3 240 B10R1.17 N#CCCC1=NC=CC=C1 SBB018592 [0,1,0,0,0,0|2,0,0]=3 241 B10R1.17 N#CCOC1=CC=CC=C1 SBB016774 [0,1,0,0,0,0|1,0,1]=3 242 B10R1.17 N#CSCC1=CC=CC=C1 SBB056767 [0,1,0,0,0,0|1,0,1]=3 243 B10R1.17 N#C\C=C\C1=CC=CC=C1 SBB060940 [0,1,0,0,0,0|1,0,2]=4 244 B10R1.17 N(CC=C)C1=CC=CC=C1 SBB004211 [0,1,0,0,0,0|1,0,1]=3 245 B10R1.17 NCCCC1=CC=CC=C1 SBB028248 [0,1,0,0,0,0|1,0,0]=2 246 B10R1.17 NCCCC1=CC=CC=N1 SBB012768 [0,1,0,0,0,0|2,0,0]=3 247 B10R1.17 NCCNC1=CC=CC=C1 SBB004200 [0,1,0,0,0,0|1,0,0]=2 248 B10R1.17 NCCOC1=CC=CC=C1 SBB085982 [0,1,0,0,0,0|1,0,0]=2 249 B10R1.17 NCCSC1=CC=CC=C1 SBB047720 [0,1,0,0,0,0|1,0,0]=2 250 B10R1.17 NCCSC1=NC=CC=C1 SBB050976 [0,1,0,0,0,0|2,0,0]=3 251 B10R1.17 O=C=NCC1=CC=CC=C1 SBB048859 [0,1,0,0,0,0|0,1,1]=3 252 B10R1.17 O=COCC1=CC=CC=C1 SBB061238 [0,1,0,0,0,0|0,1,1]=3 253 B10R1.17 O=C\C=C\C1=CC=CC=C1 SBB028652 [0,1,0,0,0,0|0,1,2]=4 254 B10R1.17 OCC#CC1=CC=CC=C1 SBB015103 [0,1,0,0,0,0|0,1,1]=3 255 B10R1.17 OCCCC1=CC=CC=C1 SBB061127 [0,1,0,0,0,0|0,1,0]=2 256 B10R1.17 OCCCC1=CC=NC=C1 SBB072686 [0,1,0,0,0,0|1,1,0]=3 257 B10R1.17 OCCOC1=CC=CC=C1 SBB060485 [0,1,0,0,0,0|0,1,0]=2 258 B10R1.17 OC\C=C\C1=CC=CC=C1 SBB058645 [0,1,0,0,0,0|0,1,1]=3 259 B10R1.17 S=C=NCC1=CC=CC=C1 SBB002731 [0,1,0,0,0,0|0,0,2]=3 260 B10R1.17 [N-]=[N+]=NCC1=CC=CC=C1 SBB008183 [0,1,0,0,0,0|2,0,0]=3 261 B10R1.18 CC(=O)CC1=CC=NC=C1 SBB055597 [0,1,0,0,0,0|1,1,1]=4 262 B10R1.18 CC(=O)NC1=CC=CC=C1 SBB040833 [0,1,0,0,0,0|1,1,1]=4 263 B10R1.18 CC(=O)OC1=CC=CC=C1 SBB058747 [0,1,0,0,0,0|1,1,1]=4 264 B10R1.18 CC(=S)NC1=CC=CC=C1 SBB086797 [0,1,0,0,0,0|1,0,2]=4 265 B10R1.18 CC(C)NC1=CC=CC=C1 SBB007921 [0,1,0,0,0,0|2,0,0]=3 266 B10R1.18 CC(N)CC1=CC=CC=N1 SBB025629 [0,1,0,0,0,0|2,0,0]=3 267 B10R1.18 CC(N)CC1=CN=CC=N1 SBB025636 [0,1,0,0,0,0|3,0,0]=4 268 B10R1.18 CN(C)CC1=CC=CC=C1 SBB060233 [0,1,0,0,0,0|2,0,0]=3 269 B10R1.18 C\[N+]([O-])=C/C1=CC=CC=C1 SBB085895 [0,1,0,0,0,0|1,1,1]=4 270 B10R1.18 FC(F)OC1=CC=CC=C1 SBB070688 [0,1,0,0,0,0|2,0,0]=3 271 B10R1.18 N=C(N)CC1=CC=CC=N1 SBB019209 [0,1,0,0,0,0|2,0,1]=4 272 B10R1.18 N=C(N)CC1=CC=CN=C1 SBB019447 [0,1,0,0,0,0|2,0,1]=4 273 B10R1.18 NC(=O)CC1=CC=CC=C1 SBB017634 [0,1,0,0,0,0|0,1,1]=3 274 B10R1.18 NC(=O)NC1=CC=CC=C1 SBB058197 [0,1,0,0,0,0|1,1,1]=4 275 B10R1.18 NC(=S)CC1=CC=CC=C1 SBB016517 [0,1,0,0,0,0|0,0,2]=3 276 B10R1.18 NC(=S)NC1=CC=CC=C1 SBB036022 [0,1,0,0,0,0|1,0,2]=4 277 B10R1.18 NC(N)=NC1=CC=CC=C1 SBB055106 [0,1,0,0,0,0|2,0,1]=4 278 B10R1.18 O=C(Cl)CC1=CC=CC=C1 SBB040622 [0,1,0,0,0,0|0,1,1]=3 279 B10R1.18 O=C(Cl)OC1=CC=CC=C1 SBB060851 [0,1,0,0,0,0|1,1,1]=4 280 B10R1.18 O=C(O)CC1=CC=CN=C1 SBB003812 [0,1,0,0,0,0|1,1,1]=4 281 B10R1.18 O=C(O)CC1=NC=CC=C1 SBB003810 [0,1,0,0,0,0|1,1,1]=4 282 B10R1.18 OB(O)CC1=CC=CC=C1 SBB052526 [0,1,0,0,0,0|1,1,0]=3 283 B10R1.18 OC(=O)CC1=CC=NC=C1 SBB005759 [0,1,0,0,0,0|1,1,1]=4 284 B10R1.18 [NH2+](C(=O)Cl)C1=CC=CC=C1 SBB060746 [0,1,0,0,0,0|1,1,1]=4 285 B10R2.7 C1=CC2=C(C=C1)CCC2 SBB060083 [0,0,0,1,0,0|1,0,0]=2 286 B10R2.7 C1=CC2=C(C=C1)NN=N2 SBB060070 [0,0,0,1,0,0|3,0,0]=4 287 B10R2.7 C1=CC2=C(C=C1)OC=C2 SBB060607 [0,0,0,1,0,0|0,1,2]=4 288 B10R2.7 C1=CC2=C(C=C1)OCO2 SBB059641 [0,0,0,1,0,0|1,1,0]=3 289 B10R2.7 C1=CC2=C(C=C1)SC=N2 SBB058513 [0,0,0,1,0,0|1,0,1]=3 290 B10R2.7 C1=CC2=NON=C2C=C1 SBB056284 [0,0,0,1,0,0|3,0,0]=4 291 B10R2.7 C1=CC2=NSN=C2C=C1 SBB083979 [0,0,0,1,0,0|3,0,0]=4 292 B10R2.7 C1=CC=C2CC=CC2=C1 SBB040862 [0,0,0,1,0,0|1,0,1]=3 293 B10R2.7 C1=CC=C2COCC2=C1 SBB068697 [0,0,0,1,0,0|2,0,0]=3 294 B10R2.7 C1=CC=C2NC=CC2=C1 SBB055980 [0,0,0,1,0,0|1,0,2]=4 295 B10R2.7 C1=CC=C2NN=CC2=C1 SBB040063 [0,0,0,1,0,0|2,0,1]=4 296 B10R2.7 C1=CC=C2OCCC2=C1 SBB056038 [0,0,0,1,0,0|0,1,0]=2 297 B10R2.7 C1=CC=C2SC=CC2=C1 SBB055961 [0,0,0,1,0,0|0,0,2]=3 298 B10R2.7 C1=CC=C2SCNC2=C1 SBB017116 [0,0,0,1,0,0|1,0,0]=2 299 B10R2.7 C1=CC=C2[S+]=CSC2=C1 SBB099195 [0,0,0,1,0,0|1,0,1]=3 300 B10R2.7 C1=CN=C2SC=NC2=C1 SBB056308 [0,0,0,1,0,0|2,0,1]=4 301 B10R2.7 N1C=NC2=C1C=CC=C2 SBB004294 [0,0,0,1,0,0|2,0,1]=4 302 B10R2.7 N1CCC2=C1C=CC=C2 SBB004291 [0,0,0,1,0,0|1,0,0]=2 303 B8R1.8 BrCCN1C=CC=N1 SBB051197 [0,0,0,0,1,0|3,0,0]=4 304 B8R1.8 CCCC1=CC=CS1 SBB073407 [0,0,0,0,1,0|2,0,0]=3 305 B8R1.8 CCCC1=NC=CS1 SBB055797 [0,0,0,0,1,0|3,0,0]=4 306 B8R1.8 CCCN1C=CC=N1 SBB024228 [0,0,0,0,1,0|3,0,0]=4 307 B8R1.8 CCCN1C=CN=C1 SBB073424 [0,0,0,0,1,0|3,0,0]=4 308 B8R1.8 CNCC1=CC=CO1 SBB079004 [0,0,0,0,1,0|3,0,0]=4 309 B8R1.8 ClCCC1=CNN=C1 SBB073776 [0,0,0,0,1,0|3,0,0]=4 310 B8R1.8 ClCCN1C=CC=N1 SBB022467 [0,0,0,0,1,0|3,0,0]=4 311 B8R1.8 ClCCN1C=CN=C1 SBB005584 [0,0,0,0,1,0|3,0,0]=4 312 B8R1.8 N#CCC1=CC=CS1 SBB055746 [0,0,0,0,1,0|2,0,1]=4 313 B8R1.8 N#CCC1=CSC=C1 SBB058364 [0,0,0,0,1,0|2,0,1]=4 314 B8R1.8 NCCC1=CC=CO1 SBB013333 [0,0,0,0,1,0|2,0,0]=3 315 B8R1.8 NCCC1=CC=CS1 SBB013250 [0,0,0,0,1,0|2,0,0]=3 316 B8R1.8 NCCC1=CC=CS1 SBB013650 [0,0,0,0,1,0|2,0,0]=3 317 B8R1.8 NCCC1=CNC=N1 SBB003722 [0,0,0,0,1,0|3,0,0]=4 318 B8R1.8 NCCC1=CNC=N1 SBB012708 [0,0,0,0,1,0|3,0,0]=4 319 B8R1.8 NCCC1=CNN=C1 SBB018789 [0,0,0,0,1,0|3,0,0]=4 320 B8R1.8 NCCC1=CSC=C1 SBB109999 [0,0,0,0,1,0|2,0,0]=3 321 B8R1.8 NCCC1=NC=CS1 SBB046047 [0,0,0,0,1,0|3,0,0]=4 322 B8R1.8 NCCN1C=CC=N1 SBB007087 [0,0,0,0,1,0|3,0,0]=4 323 B8R1.8 NCCN1C=CN=C1 SBB026490 [0,0,0,0,1,0|3,0,0]=4 324 B8R1.8 OCCC1=CC=CS1 SBB062831 [0,0,0,0,1,0|1,1,0]=3 325 B8R1.8 OCCC1=CNN=C1 SBB020248 [0,0,0,0,1,0|2,1,0]=4 326 B8R1.8 OCCN1C=CC=N1 SBB022466 [0,0,0,0,1,0|2,1,0]=4 327 B8R1.8 OCCN1C=CN=C1 SBB059127 [0,0,0,0,1,0|2,1,0]=4 328 B7R1.3 BrC1=CC=CN=C1 SBB003998 [2,0,0,0,0,0|2,0,0]=4 329 B7R1.3 BrC1=CC=NC=C1 SBB003600 [2,0,0,0,0,0|2,0,0]=4 330 B7R1.3 BrC1=NC=CC=C1 SBB003999 [2,0,0,0,0,0|2,0,0]=4 331 B7R1.3 CC1=CN=CC=N1 SBB060830 [2,0,0,0,0,0|2,0,0]=4 332 B7R1.3 ClC1=CC=CC=C1 SBB040899 [2,0,0,0,0,0|1,0,0]=3 333 B7R1.3 ClC1=NC=CC=C1 SBB079180 [2,0,0,0,0,0|2,0,0]=4 334 B7R1.3 FC1=CC=CN=C1 SBB054315 [2,0,0,0,0,0|2,0,0]=4 335 B7R1.3 FC1=CC=NC=C1 SBB054247 [2,0,0,0,0,0|2,0,0]=4 336 B7R1.3 FC1=NC=CC=C1 SBB062911 [2,0,0,0,0,0|2,0,0]=4 337 B7R1.3 IC1=CC=CN=C1 SBB054246 [2,0,0,0,0,0|2,0,0]=4 338 B7R1.3 IC1=CC=NC=C1 SBB009104 [2,0,0,0,0,0|2,0,0]=4 339 B7R1.3 IC1=NC=CC=C1 SBB054364 [2,0,0,0,0,0|2,0,0]=4 340 B7R1.3 NC1=CC=CC=N1 SBB004394 [2,0,0,0,0,0|2,0,0]=4 341 B7R1.3 NC1=CC=NC=C1 SBB004393 [2,0,0,0,0,0|2,0,0]=4 342 B7R1.3 NC1=CN=CC=C1 SBB004395 [2,0,0,0,0,0|2,0,0]=4 343 B7R1.3 O=C1C=CNC=C1 SBB005800 [2,0,0,0,0,0|1,1,0]=4 344 B7R1.3 OC1=CC=CC=N1 SBB004392 [2,0,0,0,0,0|1,1,0]=4 345 B7R1.3 OC1=CC=NC=C1 SBB000030 [2,0,0,0,0,0|1,1,0]=4 346 B7R1.3 OC1=CN=CC=C1 SBB004391 [2,0,0,0,0,0|1,1,0]=4 347 B7R1.3 SC1=CC=CC=N1 SBB058593 [2,0,0,0,0,0|1,0,0]=3 348 B7R1.3 SC1=NC=CC=N1 SBB007595 [2,0,0,0,0,0|2,0,0]=4 349 B7R1.3 [NH+]1=CC=C(Cl)C=C1 SBB058933 [2,0,0,0,0,0|2,0,0]=4 350 B9R1.1 BrCC1=CC=C(Br)C=C1 SBB040668 [1,1,0,0,0,0|1,0,0]=3 351 B9R1.1 BrCC1=CC=C(I)C=C1 SBB054901 [1,1,0,0,0,0|1,0,0]=3 352 B9R1.1 C#CC1=CC=C(Br)C=C1 SBB064530 [1,1,0,0,0,0|0,0,2]=4 353 B9R1.1 C#CC1=CC=C(F)C=C1 SBB064531 [1,1,0,0,0,0|0,0,2]=4 354 B9R1.1 CC1=CC=C(C#N)C=C1 SBB055483 [1,1,0,0,0,0|1,0,1]=4 355 B9R1.1 CC1=CC=C(CCl)C=C1 SBB040648 [1,1,0,0,0,0|1,0,0]=3 356 B9R1.1 CC1=CC=C(CN)C=C1 SBB040468 [1,1,0,0,0,0|1,0,0]=3 357 B9R1.1 CC1=CC=C(CO)C=C1 SBB063354 [1,1,0,0,0,0|0,1,0]=3 358 B9R1.1 CC1=CC=C(CS)C=C1 SBB086032 [1,1,0,0,0,0|0,0,0]=2 359 B9R1.1 CCC1=CC=C(Br)C=C1 SBB054183 [1,1,0,0,0,0|0,0,0]=2 360 B9R1.1 CCC1=CC=C(Br)C=C1 SBB060979 [1,1,0,0,0,0|0,0,0]=2 361 B9R1.1 CCC1=CC=C(C)N=C1 SBB060375 [1,1,0,0,0,0|1,0,0]=3 362 B9R1.1 CCC1=CC=C(F)C=C1 SBB085565 [1,1,0,0,0,0|0,0,0]=2 363 B9R1.1 CCC1=CC=C(N)C=C1 SBB040445 [1,1,0,0,0,0|0,0,0]=2 364 B9R1.1 CCC1=CC=C(O)C=C1 SBB057513 [1,1,0,0,0,0|0,0,0]=2 365 B9R1.1 CNC1=CC=C(N)C=C1 SBB003597 [1,1,0,0,0,0|1,0,0]=3 366 B9R1.1 COC1=CC=C(Br)C=C1 SBB060208 [1,1,0,0,0,0|1,0,0]=3 367 B9R1.1 COC1=CC=C(Br)C=N1 SBB059393 [1,1,0,0,0,0|2,0,0]=4 368 B9R1.1 COC1=CC=C(C)C=C1 SBB060064 [1,1,0,0,0,0|1,0,0]=3 369 B9R1.1 COC1=CC=C(Cl)C=C1 SBB061022 [1,1,0,0,0,0|1,0,0]=3 370 B9R1.1 COC1=CC=C(F)C=C1 SBB085645 [1,1,0,0,0,0|1,0,0]=3 371 B9R1.1 COC1=CC=C(N)C=C1 SBB040441 [1,1,0,0,0,0|1,0,0]=3 372 B9R1.1 COC1=CC=C(O)C=C1 SBB060425 [1,1,0,0,0,0|1,0,0]=3 373 B9R1.1 COC1=NC=C(F)C=C1 SBB085672 [1,1,0,0,0,0|2,0,0]=4 374 B9R1.1 COC1=NC=C(N)C=C1 SBB016584 [1,1,0,0,0,0|2,0,0]=4 375 B9R1.1 CSC1=CC=C(F)C=C1 SBB086252 [1,1,0,0,0,0|1,0,0]=3 376 B9R1.1 CSC1=CC=C(O)C=C1 SBB071908 [1,1,0,0,0,0|1,0,0]=3 377 B9R1.1 ClCC1=CC=C(Cl)C=C1 SBB058606 [1,1,0,0,0,0|1,0,0]=3 378 B9R1.1 ClCC1=CN=C(Cl)C=C1 SBB003948 [1,1,0,0,0,0|2,0,0]=4 379 B9R1.1 FC1=CC=C(CBr)C=C1 SBB058857 [1,1,0,0,0,0|1,0,0]=3 380 B9R1.1 FC1=CC=C(CCl)C=C1 SBB040604 [1,1,0,0,0,0|1,0,0]=3 381 B9R1.1 FC1=CC=C([Zn]Br)C=C1 SBB099307 [1,1,0,0,0,0|2,0,0]=4 382 B9R1.1 N#CC1=CC=C(Br)C=C1 SBB054163 [1,1,0,0,0,0|1,0,1]=4 383 B9R1.1 N#CC1=CC=C(Cl)C=C1 SBB028659 [1,1,0,0,0,0|1,0,1]=4 384 B9R1.1 N#CC1=CC=C(F)C=C1 SBB059276 [1,1,0,0,0,0|1,0,1]=4 385 B9R1.1 N#CC1=CC=C(I)C=C1 SBB017618 [1,1,0,0,0,0|1,0,1]=4 386 B9R1.1 N#CC1=CC=C(N)C=C1 SBB008363 [1,1,0,0,0,0|1,0,1]=4 387 B9R1.1 N#CC1=CC=C(O)C=C1 SBB008054 [1,1,0,0,0,0|1,0,1]=4 388 B9R1.1 NC1=CC=C(CO)C=C1 SBB063021 [1,1,0,0,0,0|0,1,0]=3 389 B9R1.1 NC1=CC=C(CO)C=N1 SBB085554 [1,1,0,0,0,0|1,1,0]=4 390 B9R1.1 NC1=CC=C(SC)C=C1 SBB006658 [1,1,0,0,0,0|1,0,0]=3 391 B9R1.1 NCC1=CC=C(Br)C=C1 SBB090347 [1,1,0,0,0,0|1,0,0]=3 392 B9R1.1 NCC1=CC=C(Cl)C=C1 SBB004154 [1,1,0,0,0,0|1,0,0]=3 393 B9R1.1 NCC1=CC=C(Cl)N=C1 SBB049618 [1,1,0,0,0,0|2,0,0]=4 394 B9R1.1 NCC1=CC=C(F)C=C1 SBB017547 [1,1,0,0,0,0|1,0,0]=3 395 B9R1.1 NCC1=CC=C(F)C=C1 SBB028215 [1,1,0,0,0,0|1,0,0]=3 396 B9R1.1 NCC1=CC=C(I)C=C1 SBB052373 [1,1,0,0,0,0|1,0,0]=3 397 B9R1.1 NCC1=CC=C(N)C=C1 SBB002565 [1,1,0,0,0,0|1,0,0]=3 398 B9R1.1 NCC1=CC=C(N)N=C1 SBB052464 [1,1,0,0,0,0|2,0,0]=4 399 B9R1.1 NCC1=CC=C(O)C=C1 SBB046561 [1,1,0,0,0,0|1,0,0]=3 400 B9R1.1 NNC1=CC=C(Br)C=C1 SBB017153 [1,1,0,0,0,0|2,0,0]=4 401 B9R1.1 NNC1=CC=C(Cl)C=C1 SBB017155 [1,1,0,0,0,0|2,0,0]=4 402 B9R1.1 NNC1=CC=C(F)C=C1 SBB012626 [1,1,0,0,0,0|2,0,0]=4 403 B9R1.1 NNC1=CC=C(F)C=C1 SBB063152 [1,1,0,0,0,0|2,0,0]=4 404 B9R1.1 NNC1=CC=C(I)C=C1 SBB017151 [1,1,0,0,0,0|2,0,0]=4 405 B9R1.1 O=CC1=CC=C(Br)C=C1 SBB007609 [1,1,0,0,0,0|0,1,1]=4 406 B9R1.1 O=CC1=CC=C(Cl)C=C1 SBB040227 [1,1,0,0,0,0|0,1,1]=4 407 B9R1.1 O=CC1=CC=C(F)C=C1 SBB040209 [1,1,0,0,0,0|0,1,1]=4 408 B9R1.1 O=CC1=CC=C(I)C=C1 SBB062822 [1,1,0,0,0,0|0,1,1]=4 409 B9R1.1 O=CC1=CC=C(O)C=C1 SBB028743 [1,1,0,0,0,0|0,1,1]=4 410 B9R1.1 OCC1=CC=C(Br)C=C1 SBB064717 [1,1,0,0,0,0|0,1,0]=3 411 B9R1.1 OCC1=CC=C(Cl)C=C1 SBB058581 [1,1,0,0,0,0|0,1,0]=3 412 B9R1.1 OCC1=CC=C(F)C=C1 SBB058560 [1,1,0,0,0,0|0,1,0]=3 413 B9R1.1 OCC1=CC=C(F)N=C1 SBB065619 [1,1,0,0,0,0|1,1,0]=4 414 B9R1.1 OCC1=CC=C(I)C=C1 SBB063681 [1,1,0,0,0,0|0,1,0]=3 415 B9R1.1 OCC1=CC=C(O)C=C1 SBB059322 [1,1,0,0,0,0|0,1,0]=3 416 B9R1.1 OCC1=CN=C(Cl)C=C1 SBB054780 [1,1,0,0,0,0|1,1,0]=4 417 B9R1.1 OCC1=NC=C(Br)C=C1 SBB065294 [1,1,0,0,0,0|1,1,0]=4 418 B9R1.1 OCC1=NC=C(Cl)C=C1 SBB086303 [1,1,0,0,0,0|1,1,0]=4 419 B9R1.1 SCC1=CC=C(Br)C=C1 SBB067614 [1,1,0,0,0,0|0,0,0]=2 420 B9R1.1 [NH2+](C)C1=CC=C(O)C=C1 SBB060652 [1,1,0,0,0,0|1,0,0]=3 421 B9R1.1 [NH3+]NC1=CC=C(C)C=C1 SBB058586 [1,1,0,0,0,0|2,0,0]=4 422 B9R1.1 [NH3+]NC1=CC=C(Cl)C=C1 SBB058434 [1,1,0,0,0,0|2,0,0]=4 423 B9R1.2 C#CC1=CC=CC(F)=C1 SBB064527 [1,1,0,0,0,0|0,0,2]=4 424 B9R1.2 C#CC1=CC=CC(N)=C1 SBB064269 [1,1,0,0,0,0|0,0,2]=4 425 B9R1.2 C#CC1=CC=CC(O)=C1 SBB005886 [1,1,0,0,0,0|0,0,2]=4 426 B9R1.2 CC1=CC(CN)=NC=C1 SBB052434 [1,1,0,0,0,0|2,0,0]=4 427 B9R1.2 CC1=CC=CC(C#N)=C1 SBB059209 [1,1,0,0,0,0|1,0,1]=4 428 B9R1.2 CC1=CC=CC(CBr)=C1 SBB054906 [1,1,0,0,0,0|1,0,0]=3 429 B9R1.2 CC1=CC=CC(CBr)=N1 SBB070747 [1,1,0,0,0,0|2,0,0]=4 430 B9R1.2 CC1=CC=CC(CCl)=C1 SBB040670 [1,1,0,0,0,0|1,0,0]=3 431 B9R1.2 CC1=CC=CC(CN)=C1 SBB048016 [1,1,0,0,0,0|1,0,0]=3 432 B9R1.2 CC1=CC=CC(CN)=N1 SBB079460 [1,1,0,0,0,0|2,0,0]=4 433 B9R1.2 CC1=CC=CC(CO)=C1 SBB064816 [1,1,0,0,0,0|0,1,0]=3 434 B9R1.2 CC1=CC=CC(CO)=N1 SBB065460 [1,1,0,0,0,0|1,1,0]=4 435 B9R1.2 CC1=CC=CC(CS)=C1 SBB086034 [1,1,0,0,0,0|0,0,0]=2 436 B9R1.2 CCC1=CC(C)=CC=C1 SBB061286 [1,1,0,0,0,0|0,0,0]=2 437 B9R1.2 CCC1=CC(C)=CC=C1 SBB061444 [1,1,0,0,0,0|0,0,0]=2 438 B9R1.2 CCC1=CC=CC(Br)=C1 SBB090239 [1,1,0,0,0,0|0,0,0]=2 439 B9R1.2 CCC1=CC=NC(N)=C1 SBB028207 [1,1,0,0,0,0|1,0,0]=3 440 B9R1.2 CCC1=CN=CC(Br)=C1 SBB054407 [1,1,0,0,0,0|1,0,0]=3 441 B9R1.2 CCC1=NC(N)=CC=C1 SBB028205 [1,1,0,0,0,0|1,0,0]=3 442 B9R1.2 CNC1=CC(Cl)=CC=C1 SBB086218 [1,1,0,0,0,0|1,0,0]=3 443 B9R1.2 COC1=CC(Br)=CC=C1 SBB007886 [1,1,0,0,0,0|1,0,0]=3 444 B9R1.2 COC1=CC(F)=CC=C1 SBB085642 [1,1,0,0,0,0|1,0,0]=3 445 B9R1.2 COC1=CC(N)=NC=C1 SBB051898 [1,1,0,0,0,0|2,0,0]=4 446 B9R1.2 COC1=CC(O)=CC=C1 SBB060932 [1,1,0,0,0,0|1,0,0]=3 447 B9R1.2 COC1=CC=CC(Br)=N1 SBB054383 [1,1,0,0,0,0|2,0,0]=4 448 B9R1.2 COC1=CC=CC(C)=C1 SBB061028 [1,1,0,0,0,0|1,0,0]=3 449 B9R1.2 COC1=CC=CC(F)=N1 SBB085671 [1,1,0,0,0,0|2,0,0]=4 450 B9R1.2 COC1=CC=CC(I)=C1 SBB059058 [1,1,0,0,0,0|1,0,0]=3 451 B9R1.2 COC1=CC=CC(N)=C1 SBB040499 [1,1,0,0,0,0|1,0,0]=3 452 B9R1.2 COC1=CC=CC(N)=N1 SBB051862 [1,1,0,0,0,0|2,0,0]=4 453 B9R1.2 COC1=CN=CC(Br)=C1 SBB054402 [1,1,0,0,0,0|2,0,0]=4 454 B9R1.2 COC1=NC=CC(Br)=C1 SBB054328 [1,1,0,0,0,0|2,0,0]=4 455 B9R1.2 COC1=NC=CC(N)=C1 SBB051798 [1,1,0,0,0,0|2,0,0]=4 456 B9R1.2 ClCC1=CC(Br)=CN=C1 SBB054923 [1,1,0,0,0,0|2,0,0]=4 457 B9R1.2 ClCC1=CC(Cl)=CC=C1 SBB040671 [1,1,0,0,0,0|1,0,0]=3 458 B9R1.2 FC1=CC(CBr)=CC=C1 SBB090883 [1,1,0,0,0,0|1,0,0]=3 459 B9R1.2 FC1=CC=CC(CCl)=C1 SBB040605 [1,1,0,0,0,0|1,0,0]=3 460 B9R1.2 N#CC1=CC(Br)=CC=C1 SBB054164 [1,1,0,0,0,0|1,0,1]=4 461 B9R1.2 N#CC1=CC(I)=CC=C1 SBB055464 [1,1,0,0,0,0|1,0,1]=4 462 B9R1.2 N#CC1=CC=CC(Cl)=C1 SBB063150 [1,1,0,0,0,0|1,0,1]=4 463 B9R1.2 N#CC1=CC=CC(F)=C1 SBB063653 [1,1,0,0,0,0|1,0,1]=4 464 B9R1.2 N#CC1=CC=CC(N)=C1 SBB063161 [1,1,0,0,0,0|1,0,1]=4 465 B9R1.2 NC1=CC=CC(CO)=C1 SBB037932 [1,1,0,0,0,0|0,1,0]=3 466 B9R1.2 NC1=NC=CC(CO)=C1 SBB046494 [1,1,0,0,0,0|1,1,0]=4 467 B9R1.2 NCC1=CC(Br)=CN=C1 SBB090527 [1,1,0,0,0,0|2,0,0]=4 468 B9R1.2 NCC1=CC(Cl)=CC=C1 SBB004155 [1,1,0,0,0,0|1,0,0]=3 469 B9R1.2 NCC1=CC(Cl)=NC=C1 SBB052439 [1,1,0,0,0,0|2,0,0]=4 470 B9R1.2 NCC1=CC=CC(Br)=C1 SBB005796 [1,1,0,0,0,0|1,0,0]=3 471 B9R1.2 NCC1=CC=CC(F)=C1 SBB028218 [1,1,0,0,0,0|1,0,0]=3 472 B9R1.2 NNC1=CC(Cl)=CC=C1 SBB017147 [1,1,0,0,0,0|2,0,0]=4 473 B9R1.2 NNC1=CC=CC(Br)=C1 SBB064980 [1,1,0,0,0,0|2,0,0]=4 474 B9R1.2 NNC1=CC=CC(Cl)=C1 SBB063250 [1,1,0,0,0,0|2,0,0]=4 475 B9R1.2 NNC1=CC=CC(F)=C1 SBB063994 [1,1,0,0,0,0|2,0,0]=4 476 B9R1.2 O=CC1=CC=CC(Br)=C1 SBB028648 [1,1,0,0,0,0|0,1,1]=4 477 B9R1.2 O=CC1=CC=CC(Cl)=C1 SBB040204 [1,1,0,0,0,0|0,1,1]=4 478 B9R1.2 O=CC1=CC=CC(F)=C1 SBB040273 [1,1,0,0,0,0|0,1,1]=4 479 B9R1.2 O=CC1=CC=CC(I)=C1 SBB064701 [1,1,0,0,0,0|0,1,1]=4 480 B9R1.2 O=CC1=CC=CC(O)=C1 SBB040208 [1,1,0,0,0,0|0,1,1]=4 481 B9R1.2 OCC1=CC(Br)=CN=C1 SBB065467 [1,1,0,0,0,0|1,1,0]=4 482 B9R1.2 OCC1=CC(Br)=NC=C1 SBB054782 [1,1,0,0,0,0|1,1,0]=4 483 B9R1.2 OCC1=CC(Cl)=CC=N1 SBB065656 [1,1,0,0,0,0|1,1,0]=4 484 B9R1.2 OCC1=CC(Cl)=NC=C1 SBB054800 [1,1,0,0,0,0|1,1,0]=4 485 B9R1.2 OCC1=CC(F)=CC=C1 SBB064188 [1,1,0,0,0,0|0,1,0]=3 486 B9R1.2 OCC1=CC(I)=CC=C1 SBB068728 [1,1,0,0,0,0|0,1,0]=3 487 B9R1.2 OCC1=CC(S)=CC=C1 SBB054760 [1,1,0,0,0,0|0,1,0]=3 488 B9R1.2 OCC1=CC=CC(Br)=C1 SBB063014 [1,1,0,0,0,0|0,1,0]=3 489 B9R1.2 OCC1=CC=CC(Cl)=C1 SBB064716 [1,1,0,0,0,0|0,1,0]=3 490 B9R1.2 OCC1=CC=CC(O)=C1 SBB068731 [1,1,0,0,0,0|0,1,0]=3 491 B9R1.2 OCC1=NC(Cl)=CC=C1 SBB054794 [1,1,0,0,0,0|1,1,0]=4 492 B9R1.2 [NH3+]CC1=CC(I)=CC=C1 SBB058984 [1,1,0,0,0,0|1,0,0]=3 493 B9R1.6 C=C(C)C1=CC=CC=C1 SBB060154 [1,1,0,0,0,0|0,0,1]=3 494 B9R1.6 CC(=O)C1=CC=CC=C1 SBB040241 [1,1,0,0,0,0|0,0,1]=3 495 B9R1.6 CC(=O)C1=CC=NC=C1 SBB040256 [1,1,0,0,0,0|1,0,1]=4 496 B9R1.6 CC(=O)C1=CN=CC=C1 SBB040255 [1,1,0,0,0,0|1,0,1]=4 497 B9R1.6 CC(=O)C1=NC=CC=C1 SBB058824 [1,1,0,0,0,0|1,0,1]=4 498 B9R1.6 CC(Br)C1=CC=CC=C1 SBB040667 [1,1,0,0,0,0|0,0,0]=2 499 B9R1.6 CC(C)C1=CC=CC=C1 SBB040817 [1,1,0,0,0,0|0,0,0]=2 500 B9R1.6 CC(Cl)C1=CC=CC=C1 SBB007671 [1,1,0,0,0,0|0,0,0]=2 501 B9R1.6 CC(N)C1=CC=CC=C1 SBB040514 [1,1,0,0,0,0|0,0,0]=2 502 B9R1.6 CC(N)C1=CC=NC=C1 SBB007016 [1,1,0,0,0,0|1,0,0]=3 503 B9R1.6 CC(N)C1=CN=CC=C1 SBB027288 [1,1,0,0,0,0|1,0,0]=3 504 B9R1.6 CC(N)C1=NC=CC=C1 SBB018707 [1,1,0,0,0,0|1,0,0]=3 505 B9R1.6 CC(O)C1=CC=CC=C1 SBB058702 [1,1,0,0,0,0|0,0,0]=2 506 B9R1.6 CN(C)C1=CC=CC=C1 SBB040814 [1,1,0,0,0,0|1,0,0]=3 507 B9R1.6 CN(C)C1=CC=NC=C1 SBB008765 [1,1,0,0,0,0|2,0,0]=4 508 B9R1.6 CN(N)C1=CC=CC=C1 SBB060814 [1,1,0,0,0,0|1,0,0]=3 509 B9R1.6 C[C@@H](O)C1=CC=NC=C1 SBB065458 [1,1,0,0,0,0|1,0,0]=3 510 B9R1.6 C[C@H](N)C1=CC=CC=C1 SBB051709 [1,1,0,0,0,0|0,0,0]=2 511 B9R1.6 N=C(N)C1=CC=CC=C1 SBB055093 [1,1,0,0,0,0|1,0,1]=4 512 B9R1.6 NC(=O)C1=CC=CC=C1 SBB058198 [1,1,0,0,0,0|0,1,1]=4 513 B9R1.6 NC(=S)C1=CC=CC=C1 SBB041177 [1,1,0,0,0,0|0,0,2]=4 514 B9R1.6 O=C(Cl)C1=CC=CC=C1 SBB059783 [1,1,0,0,0,0|0,1,1]=4 515 B9R1.6 O=C(F)C1=CC=CC=C1 SBB085547 [1,1,0,0,0,0|0,1,1]=4 516 B9R1.6 O=C(O)C1=CC=CC=C1 SBB040515 [1,1,0,0,0,0|0,1,1]=4 517 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 SBB040911 [1,1,0,0,0,0|1,1,0]=4 518 B9R1.15 BrCC1=CC=CN=C1Br SBB070876 [1,1,0,0,0,0|2,0,0]=4 519 B9R1.15 CC1=C(C#N)C=CC=C1 SBB058479 [1,1,0,0,0,0|1,0,1]=4 520 B9R1.15 CC1=C(CBr)N=CC=C1 SBB021212 [1,1,0,0,0,0|2,0,0]=4 521 B9R1.15 CC1=C(CCl)C=CC=C1 SBB040606 [1,1,0,0,0,0|1,0,0]=3 522 B9R1.15 CC1=C(CN)C=CC=C1 SBB042694 [1,1,0,0,0,0|1,0,0]=3 523 B9R1.15 CC1=C(NN)C=CC=C1 SBB017148 [1,1,0,0,0,0|2,0,0]=4 524 B9R1.15 CC1=C(NN)C=CC=C1 SBB064148 [1,1,0,0,0,0|2,0,0]=4 525 B9R1.15 CC1=CC=CC=C1CO SBB065157 [1,1,0,0,0,0|0,1,0]=3 526 B9R1.15 CC1=CC=CC=C1CS SBB086035 [1,1,0,0,0,0|0,0,0]=2 527 B9R1.15 CC1=CC=CN=C1CN SBB052454 [1,1,0,0,0,0|2,0,0]=4 528 B9R1.15 CCC1=C(N)C=CC=C1 SBB040452 [1,1,0,0,0,0|0,0,0]=2 529 B9R1.15 CCC1=CC=CC=C1C SBB061450 [1,1,0,0,0,0|0,0,0]=2 530 B9R1.15 CNC1=CC=CC=C1Cl SBB086216 [1,1,0,0,0,0|1,0,0]=3 531 B9R1.15 CNC1=CC=CC=C1F SBB051706 [1,1,0,0,0,0|1,0,0]=3 532 B9R1.15 CNC1=CC=CC=C1N SBB071575 [1,1,0,0,0,0|1,0,0]=3 533 B9R1.15 COC1=C(I)N=CC=C1 SBB098345 [1,1,0,0,0,0|2,0,0]=4 534 B9R1.15 COC1=C(N)C=CC=C1 SBB028142 [1,1,0,0,0,0|1,0,0]=3 535 B9R1.15 COC1=C(O)C=CC=C1 SBB058681 [1,1,0,0,0,0|1,0,0]=3 536 B9R1.15 COC1=CC=CC=C1Cl SBB060957 [1,1,0,0,0,0|1,0,0]=3 537 B9R1.15 COC1=CC=CC=C1F SBB040818 [1,1,0,0,0,0|1,0,0]=3 538 B9R1.15 COC1=CC=CN=C1Br SBB005633 [1,1,0,0,0,0|2,0,0]=4 539 B9R1.15 COC1=CC=CN=C1N SBB051907 [1,1,0,0,0,0|2,0,0]=4 540 B9R1.15 COC1=CC=CN=C1O SBB046500 [1,1,0,0,0,0|2,0,0]=4 541 B9R1.15 CSC1=C(Br)C=CC=C1 SBB006566 [1,1,0,0,0,0|1,0,0]=3 542 B9R1.15 CSC1=C(Cl)C=CC=C1 SBB058978 [1,1,0,0,0,0|1,0,0]=3 543 B9R1.15 CSC1=NC=CC=C1N SBB072554 [1,1,0,0,0,0|2,0,0]=4 544 B9R1.15 ClCC1=C(Cl)C=CC=C1 SBB040669 [1,1,0,0,0,0|1,0,0]=3 545 B9R1.15 FC1=C(CBr)C=CC=C1 SBB058868 [1,1,0,0,0,0|1,0,0]=3 546 B9R1.15 FC1=C(CCl)C=CC=C1 SBB040603 [1,1,0,0,0,0|1,0,0]=3 547 B9R1.15 N#CC1=C(Br)C=CC=C1 SBB008569 [1,1,0,0,0,0|1,0,1]=4 548 B9R1.15 N#CC1=C(Cl)C=CC=C1 SBB058443 [1,1,0,0,0,0|1,0,1]=4 549 B9R1.15 N#CC1=C(I)C=CC=C1 SBB059075 [1,1,0,0,0,0|1,0,1]=4 550 B9R1.15 N#CC1=C(N)C=CC=C1 SBB059814 [1,1,0,0,0,0|1,0,1]=4 551 B9R1.15 N#CC1=C(O)C=CC=C1 SBB007959 [1,1,0,0,0,0|1,0,1]=4 552 B9R1.15 N#CC1=CC=CC=C1F SBB063132 [1,1,0,0,0,0|1,0,1]=4 553 B9R1.15 NC1=C(CO)C=CC=C1 SBB058759 [1,1,0,0,0,0|0,1,0]=3 554 B9R1.15 NC1=CC=CC=C1C=O SBB061591 [1,1,0,0,0,0|0,1,1]=4 555 B9R1.15 NC1=CC=NC=C1CO SBB054791 [1,1,0,0,0,0|1,1,0]=4 556 B9R1.15 NC1=CN=CC=C1CO SBB054795 [1,1,0,0,0,0|1,1,0]=4 557 B9R1.15 NC1=NC=CC=C1CO SBB054786 [1,1,0,0,0,0|1,1,0]=4 558 B9R1.15 NCC1=C(Cl)C=CC=C1 SBB004151 [1,1,0,0,0,0|1,0,0]=3 559 B9R1.15 NCC1=C(F)C=CC=C1 SBB028214 [1,1,0,0,0,0|1,0,0]=3 560 B9R1.15 NCC1=CC=CC=C1Br SBB052369 [1,1,0,0,0,0|1,0,0]=3 561 B9R1.15 NCC1=CC=CC=C1Br SBB052411 [1,1,0,0,0,0|1,0,0]=3 562 B9R1.15 NNC1=C(Cl)C=CC=C1 SBB017145 [1,1,0,0,0,0|2,0,0]=4 563 B9R1.15 NNC1=CC=CC=C1Br SBB017150 [1,1,0,0,0,0|2,0,0]=4 564 B9R1.15 NNC1=CC=CC=C1Br SBB063185 [1,1,0,0,0,0|2,0,0]=4 565 B9R1.15 NNC1=CC=CC=C1F SBB012668 [1,1,0,0,0,0|2,0,0]=4 566 B9R1.15 NNC1=CC=CC=C1F SBB063993 [1,1,0,0,0,0|2,0,0]=4 567 B9R1.15 NNC1=CC=CC=C1I SBB001769 [1,1,0,0,0,0|2,0,0]=4 568 B9R1.15 O=CC1=CC=CC=C1Br SBB040217 [1,1,0,0,0,0|0,1,1]=4 569 B9R1.15 O=CC1=CC=CC=C1Cl SBB040228 [1,1,0,0,0,0|0,1,1]=4 570 B9R1.15 O=CC1=CC=CC=C1F SBB040198 [1,1,0,0,0,0|0,1,1]=4 571 B9R1.15 O=CC1=CC=CC=C1I SBB017119 [1,1,0,0,0,0|0,1,1]=4 572 B9R1.15 O=CC1=CC=CC=C1O SBB040225 [1,1,0,0,0,0|0,1,1]=4 573 B9R1.15 OCC1=C(F)C=CC=C1 SBB064085 [1,1,0,0,0,0|0,1,0]=3 574 B9R1.15 OCC1=C(O)C=CC=N1 SBB085588 [1,1,0,0,0,0|1,1,0]=4 575 B9R1.15 OCC1=CC=CC=C1Br SBB063922 [1,1,0,0,0,0|0,1,0]=3 576 B9R1.15 OCC1=CC=CC=C1Cl SBB058557 [1,1,0,0,0,0|0,1,0]=3 577 B9R1.15 OCC1=CC=CC=C1O SBB065036 [1,1,0,0,0,0|0,1,0]=3 578 B9R1.15 OCC1=CC=CN=C1Cl SBB054785 [1,1,0,0,0,0|1,1,0]=4 579 B9R1.15 SCC1=CC=CC=C1Br SBB066540 [1,1,0,0,0,0|0,0,0]=2 580 B9R1.15 [NH3+]NC1=CC=CC=C1Cl SBB058433 [1,1,0,0,0,0|2,0,0]=4 581 B9R1.7 CC1=CC=C(CCN)S1 SBB027633 [0,1,0,0,1,0|2,0,0]=4 582 B9R1.11 CCC(N)C1=CC=CS1 SBB018551 [0,1,0,0,1,0|2,0,0]=4 583 B9R1.12 CCNCC1=CC=CO1 SBB047492 [0,1,0,0,1,0|2,0,0]=4 584 B9R1.12 CSSCC1=CC=CO1 SBB057326 [0,1,0,0,1,0|2,0,0]=4 585 B9R1.12 NCCCC1=CC=CO1 SBB047796 [0,1,0,0,1,0|2,0,0]=4 586 B9R1.13 CC(N)CC1=CC=CO1 SBB010238 [0,1,0,0,1,0|2,0,0]=4 587 B9R1.13 CC(N)CC1=CC=CS1 SBB010287 [0,1,0,0,1,0|2,0,0]=4 588 B11R1.1 BrCCOC1=CC=C(Br)C=C1 SBB042543 [0,2,0,0,0,0|1,0,0]=3 589 B11R1.1 C#CCNC1=CC=C(C)C=C1 SBB010306 [0,2,0,0,0,0|1,0,1]=4 590 B11R1.1 C=CCCC1=CC=C(F)C=C1 SBB008824 [0,2,0,0,0,0|1,0,0]=3 591 B11R1.1 C=CCOC1=CC=C(N)C=C1 SBB079900 [0,2,0,0,0,0|1,0,1]=4 592 B11R1.1 CC1=CC=C(NCCO)C=C1 SBB010327 [0,2,0,0,0,0|0,1,0]=3 593 B11R1.1 CC1=CC=C(OCC#N)C=C1 SBB086536 [0,2,0,0,0,0|1,0,1]=4 594 B11R1.1 CC1=CC=C(OCCBr)C=C1 SBB018129 [0,2,0,0,0,0|1,0,0]=3 595 B11R1.1 CC1=CC=C(OCCN)C=C1 SBB016458 [0,2,0,0,0,0|1,0,0]=3 596 B11R1.1 CC1=CC=C(SCCN)C=C1 SBB076443 [0,2,0,0,0,0|1,0,0]=3 597 B11R1.1 CCCCC1=CC=C(Cl)C=C1 SBB116909 [0,2,0,0,0,0|1,0,0]=3 598 B11R1.1 CCCCC1=CC=C(N)C=C1 SBB008298 [0,2,0,0,0,0|1,0,0]=3 599 B11R1.1 CCCCC1=CC=C(O)C=C1 SBB059153 [0,2,0,0,0,0|1,0,0]=3 600 B11R1.1 CCCOC1=CC=C(Br)C=C1 SBB059354 [0,2,0,0,0,0|1,0,0]=3 601 B11R1.1 CCCOC1=CC=C(N)C=C1 SBB008316 [0,2,0,0,0,0|1,0,0]=3 602 B11R1.1 CCCOC1=CC=C(O)C=C1 SBB059151 [0,2,0,0,0,0|1,0,0]=3 603 B11R1.1 CCNCC1=CC=C(Cl)C=C1 SBB080066 [0,2,0,0,0,0|1,0,0]=3 604 B11R1.1 ClC1=CC=C(OCCBr)C=C1 SBB040699 [0,2,0,0,0,0|1,0,0]=3 605 B11R1.1 FC1=CC=C(CN=C=S)C=C1 SBB066522 [0,2,0,0,0,0|0,0,2]=4 606 B11R1.1 FC1=CC=C(OCCBr)C=C1 SBB071709 [0,2,0,0,0,0|1,0,0]=3 607 B11R1.1 N#CCCC1=CC=C(O)C=C1 SBB055251 [0,2,0,0,0,0|1,0,0]=3 608 B11R1.1 N#CCCN1C=CC(=O)C=C1 SBB072987 [0,2,0,0,0,0|2,0,0]=4 609 B11R1.1 N#CCOC1=CC=C(Cl)C=C1 SBB088115 [0,2,0,0,0,0|1,0,1]=4 610 B11R1.1 N#CCOC1=CC=C(F)C=C1 SBB072988 [0,2,0,0,0,0|1,0,1]=4 611 B11R1.1 N#CCSC1=CC=C(Cl)C=C1 SBB062069 [0,2,0,0,0,0|1,0,1]=4 612 B11R1.1 N#CCSC1=CC=C(F)C=C1 SBB088094 [0,2,0,0,0,0|1,0,1]=4 613 B11R1.1 NC1=CC=C(NCCO)C=C1 SBB006780 [0,2,0,0,0,0|0,1,0]=3 614 B11R1.1 NC1=CC=C(OCCO)C=C1 SBB024256 [0,2,0,0,0,0|0,1,0]=3 615 B11R1.1 NCCCC1=CC=C(Cl)C=C1 SBB010509 [0,2,0,0,0,0|1,0,0]=3 616 B11R1.1 NCCOC1=CC=C(Br)C=C1 SBB050336 [0,2,0,0,0,0|1,0,0]=3 617 B11R1.1 NCCOC1=CC=C(Cl)C=C1 SBB010531 [0,2,0,0,0,0|1,0,0]=3 618 B11R1.1 NCCOC1=CC=C(F)C=C1 SBB010365 [0,2,0,0,0,0|1,0,0]=3 619 B11R1.1 NCCOC1=CC=C(N)C=C1 SBB050309 [0,2,0,0,0,0|1,0,0]=3 620 B11R1.1 NCCSC1=CC=C(F)C=C1 SBB073189 [0,2,0,0,0,0|1,0,0]=3 621 B11R1.1 OC1=CC=C(OCCBr)C=C1 SBB051429 [0,2,0,0,0,0|1,0,0]=3 622 B11R1.1 OCCCC1=CC=C(Cl)C=C1 SBB055172 [0,2,0,0,0,0|0,1,0]=3 623 B11R1.1 OCCSC1=CC=C(Cl)C=C1 SBB090866 [0,2,0,0,0,0|0,1,0]=3 624 B11R1.1 OCCSC1=CC=C(Cl)C=N1 SBB054333 [0,2,0,0,0,0|1,1,0]=4 625 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 SBB058424 [0,2,0,0,0,0|0,1,1]=4 626 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 SBB086853 [0,2,0,0,0,0|0,1,1]=4 627 B11R1.20 CC(C)OC1=CC=C(Br)C=C1 SBB047818 [0,2,0,0,0,0|2,0,0]=4 628 B11R1.20 CC(C)OC1=CC=C(N)C=C1 SBB010330 [0,2,0,0,0,0|2,0,0]=4 629 B11R1.20 CC(N)CC1=CC=C(Cl)C=C1 SBB000454 [0,2,0,0,0,0|1,0,0]=3 630 B11R1.20 CC(N)CC1=CC=C(F)C=C1 SBB052387 [0,2,0,0,0,0|1,0,0]=3 631 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 SBB063734 [0,2,0,0,0,0|0,1,1]=4 632 B11R1.20 CC1=CC=C(CC(N)=S)C=C1 SBB087944 [0,2,0,0,0,0|0,0,2]=4 633 B11R1.20 CC1=CC=C(OC(F)F)C=C1 SBB087277 [0,2,0,0,0,0|2,0,0]=4 634 B11R1.20 CN(C)CC1=CC=C(Br)C=C1 SBB109890 [0,2,0,0,0,0|2,0,0]=4 635 B11R1.20 FC(F)OC1=CC=C(Br)C=C1 SBB096413 [0,2,0,0,0,0|2,0,0]=4 636 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 SBB028300 [0,2,0,0,0,0|0,1,1]=4 637 B11R1.20 NC(=S)CC1=CC=C(Br)C=C1 SBB055187 [0,2,0,0,0,0|0,0,2]=4 638 B11R1.20 NC(=S)CC1=CC=C(Cl)C=C1 SBB055366 [0,2,0,0,0,0|0,0,2]=4 639 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 SBB028301 [0,2,0,0,0,0|0,1,1]=4 640 B11R1.20 NC1=CC=C(OC(F)F)C=C1 SBB003981 [0,2,0,0,0,0|2,0,0]=4 641 B11R1.20 NC1=CC=C(SC(F)F)C=C1 SBB073004 [0,2,0,0,0,0|2,0,0]=4 642 B11R1.20 O=C(Cl)CC1=CC=C(Cl)C=C1 SBB005859 [0,2,0,0,0,0|0,1,1]=4 643 B11R1.20 O=C(Cl)CC1=CC=C(F)C=C1 SBB067909 [0,2,0,0,0,0|0,1,1]=4 644 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 SBB042842 [0,2,0,0,0,0|0,1,1]=4 645 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 SBB008374 [0,2,0,0,0,0|0,1,1]=4 646 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 SBB052671 [0,2,0,0,0,0|0,1,1]=4 647 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 SBB052672 [0,2,0,0,0,0|0,1,1]=4 648 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 SBB059600 [0,2,0,0,0,0|0,1,1]=4 649 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 SBB038706 [0,2,0,0,0,0|1,0,1]=4 650 B11R1.22 CC1=CC=C(C(O)C#N)C=C1 SBB086534 [0,2,0,0,0,0|1,0,1]=4 651 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 SBB058414 [0,2,0,0,0,0|1,0,1]=4 652 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 SBB056753 [0,2,0,0,0,0|1,0,1]=4 653 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 SBB035779 [0,2,0,0,0,0|1,0,1]=4 654 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 SBB058461 [0,2,0,0,0,0|1,0,1]=4 655 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 SBB040250 [0,2,0,0,0,0|1,0,1]=4 656 B11R1.22 CCC(N)C1=CC=C(C)C=C1 SBB017924 [0,2,0,0,0,0|1,0,0]=3 657 B11R1.22 CCC(N)C1=CC=C(Cl)C=C1 SBB046785 [0,2,0,0,0,0|1,0,0]=3 658 B11R1.22 CCC(N)C1=CC=C(F)C=C1 SBB010339 [0,2,0,0,0,0|1,0,0]=3 659 B11R1.22 CCC(N)C1=CC=C(O)C=C1 SBB080407 [0,2,0,0,0,0|1,0,0]=3 660 B11R1.22 CCC(O)C1=CC=C(F)C=C1 SBB087018 [0,2,0,0,0,0|1,0,0]=3 661 B11R1.22 N#C[C@H](O)C1=CC=C(Cl)C=C1 SBB088117 [0,2,0,0,0,0|1,0,1]=4 662 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 SBB100801 [0,2,0,0,0,0|1,0,1]=4 663 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 SBB017900 [0,2,0,0,0,0|1,0,1]=4 664 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 SBB093579 [0,2,0,0,0,0|1,0,1]=4 665 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 SBB038654 [0,2,0,0,0,0|1,0,1]=4 666 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 SBB006561 [0,2,0,0,0,0|1,0,1]=4 667 B11R1.81 CC1=C(CC#N)C=CC(F)=C1 SBB086636 [0,2,0,0,0,0|1,0,1]=4 668 B11R1.81 CC1=CC=C(CC#N)C(F)=C1 SBB064682 [0,2,0,0,0,0|1,0,1]=4 669 B11R1.81 CCOC1=C(Cl)C=C(F)C=C1 SBB088977 [0,2,0,0,0,0|2,0,0]=4 670 B11R1.81 CCOC1=C(F)C=C(Cl)C=C1 SBB088962 [0,2,0,0,0,0|2,0,0]=4 671 B11R1.81 CCOC1=CC=C(Br)C=C1N SBB072961 [0,2,0,0,0,0|2,0,0]=4 672 B11R1.81 CCOC1=CC=C(C)C=C1C SBB061026 [0,2,0,0,0,0|2,0,0]=4 673 B11R1.81 CCOC1=CC=C(Cl)C=C1Cl SBB061031 [0,2,0,0,0,0|2,0,0]=4 674 B11R1.81 CCOC1=CC=C(F)C=C1N SBB073487 [0,2,0,0,0,0|2,0,0]=4 675 B11R1.81 CCSC1=C(N)C=C(Cl)C=C1 SBB013592 [0,2,0,0,0,0|2,0,0]=4 676 B11R1.81 CNCC1=CC=C(Cl)C=C1Cl SBB091049 [0,2,0,0,0,0|2,0,0]=4 677 B11R1.81 FC1=CC(F)=C(C[Mg]Br)C=C1 SBB097796 [0,2,0,0,0,0|2,0,0]=4 678 B11R1.81 N#CCC1=CC=C(Br)C=C1F SBB055287 [0,2,0,0,0,0|1,0,1]=4 679 B11R1.81 N#CCC1=CC=C(Cl)C=C1Cl SBB064695 [0,2,0,0,0,0|1,0,1]=4 680 B11R1.81 N#CCC1=CC=C(Cl)C=C1F SBB064486 [0,2,0,0,0,0|1,0,1]=4 681 B11R1.81 N#CCC1=CC=C(F)C=C1Cl SBB005761 [0,2,0,0,0,0|1,0,1]=4 682 B11R1.81 N#CCC1=CC=C(F)C=C1F SBB063247 [0,2,0,0,0,0|1,0,1]=4 683 B11R1.83 CCC1=CC=C(CC#N)C=C1 SBB065173 [0,2,0,0,0,0|1,0,1]=4 684 B11R1.83 CCC1=CN=C(CCO)C=C1 SBB055692 [0,2,0,0,0,0|1,1,0]=4 685 B11R1.83 CCCC1=CC=C(C#N)C=C1 SBB059145 [0,2,0,0,0,0|1,0,0]=3 686 B11R1.83 CCCC1=CC=C(C=O)C=C1 SBB059136 [0,2,0,0,0,0|1,0,0]=3 687 B11R1.83 CCCC1=CC=C(CN)C=C1 SBB059679 [0,2,0,0,0,0|1,0,0]=3 688 B11R1.83 CCCC1=CC=C(OC)C=C1 SBB007737 [0,2,0,0,0,0|1,0,0]=3 689 B11R1.83 CCNC1=CC=C(CC)C=C1 SBB072094 [0,2,0,0,0,0|2,0,0]=4 690 B11R1.83 CCOC1=CC=C(C#N)C=C1 SBB055390 [0,2,0,0,0,0|2,0,0]=4 691 B11R1.83 CCOC1=CC=C(C=O)C=C1 SBB016657 [0,2,0,0,0,0|2,0,0]=4 692 B11R1.83 CCOC1=CC=C(CBr)C=C1 SBB081616 [0,2,0,0,0,0|2,0,0]=4 693 B11R1.83 CCOC1=CC=C(CN)C=C1 SBB017652 [0,2,0,0,0,0|2,0,0]=4 694 B11R1.83 CCSC1=CC=C(C=O)C=C1 SBB079149 [0,2,0,0,0,0|2,0,0]=4 695 B11R1.83 CNCC1=CC=C(OC)C=C1 SBB086791 [0,2,0,0,0,0|2,0,0]=4 696 B11R1.83 COC1=CC=C(CC#N)C=C1 SBB055070 [0,2,0,0,0,0|1,0,1]=4 697 B11R1.83 COC1=CC=C(CC=O)C=C1 SBB052209 [0,2,0,0,0,0|0,1,1]=4 698 B11R1.83 COC1=CC=C(CCN)C=C1 SBB058795 [0,2,0,0,0,0|1,0,0]=3 699 B11R1.83 COC1=CC=C(CON)C=C1 SBB091016 [0,2,0,0,0,0|2,0,0]=4 700 B11R1.83 N#CC1=CC=C(CCO)C=C1 SBB086537 [0,2,0,0,0,0|0,1,0]=3 701 B11R1.83 N#CCC1=CC=C(NN)C=C1 SBB055136 [0,2,0,0,0,0|1,0,1]=4 702 B11R1.192 CCOC1=CC(Cl)=C(F)C=C1 SBB088965 [0,2,0,0,0,0|2,0,0]=4 703 B11R1.192 CCOC1=CC(F)=C(Cl)C=C1 SBB088963 [0,2,0,0,0,0|2,0,0]=4 704 B11R1.192 CCOC1=CC(F)=C(F)C=C1 SBB087276 [0,2,0,0,0,0|2,0,0]=4 705 B11R1.192 CCOC1=CC=C(N)C(F)=C1 SBB071686 [0,2,0,0,0,0|2,0,0]=4 706 B11R1.192 FC1=C(F)C=C(C[Mg]Br)C=C1 SBB097795 [0,2,0,0,0,0|2,0,0]=4 707 B11R1.192 N#CCC1=CC(Br)=C(N)C=C1 SBB055330 [0,2,0,0,0,0|1,0,1]=4 708 B11R1.192 N#CCC1=CC=C(Cl)C(Cl)=C1 SBB063342 [0,2,0,0,0,0|1,0,1]=4 709 B11R1.192 N#CCC1=CC=C(F)C(Cl)=C1 SBB064902 [0,2,0,0,0,0|1,0,1]=4 710 B11R1.192 N#CCC1=CC=C(F)C(F)=C1 SBB006630 [0,2,0,0,0,0|1,0,1]=4 711 B11R1.192 NCCC1=CC(O)=C(O)C=C1 SBB003668 [0,2,0,0,0,0|1,0,0]=3 712 B11R1.192 NCCC1=CC=C(F)C(F)=C1 SBB084443 [0,2,0,0,0,0|1,0,0]=3 713 B11R1.192 OC1=C(O)C=C(CCN)C=C1 SBB004044 [0,2,0,0,0,0|1,0,0]=3 714 B11R1.192 OCCC1=CC=C(F)C(Cl)=C1 SBB088968 [0,2,0,0,0,0|0,1,0]=3 715 B11R1.192 OCCC1=CC=C(F)C(F)=C1 SBB087275 [0,2,0,0,0,0|0,1,0]=3 716 B11R1.13 CC1=C(F)C=CC=C1CC#N SBB086641 [0,2,0,0,0,0|1,0,1]=4 717 B11R1.13 N#CCC1=C(F)C(Br)=CC=C1 SBB094884 [0,2,0,0,0,0|1,0,1]=4 718 B11R1.13 N#CCC1=CC=CC(Cl)=C1F SBB064385 [0,2,0,0,0,0|1,0,1]=4 719 B11R1.13 N#CCC1=CC=CC(F)=C1F SBB063630 [0,2,0,0,0,0|1,0,1]=4 720 B11R1.13 OCCC1=CC=CC(Cl)=C1F SBB088973 [0,2,0,0,0,0|0,1,0]=3 721 B11R1.13 OCCC1=CC=CC(F)=C1F SBB087274 [0,2,0,0,0,0|0,1,0]=3 722 B11R1.17 C=CCOC1=C(C)C=CC=C1 SBB008365 [0,2,0,0,0,0|1,0,1]=4 723 B11R1.17 C=CCOC1=C(N)C=CC=C1 SBB010317 [0,2,0,0,0,0|1,0,1]=4 724 B11R1.17 C=CCOC1=C(N)C=CC=C1 SBB080031 [0,2,0,0,0,0|1,0,1]=4 725 B11R1.17 CC1=C(OCCN)C=CC=C1 SBB014044 [0,2,0,0,0,0|1,0,0]=3 726 B11R1.17 CC1=CC=CC=C1NCCO SBB007819 [0,2,0,0,0,0|0,1,0]=3 727 B11R1.17 CC1=CC=CC=C1OCC#N SBB016775 [0,2,0,0,0,0|1,0,1]=4 728 B11R1.17 CC1=CC=CC=C1OCCCl SBB300045 [0,2,0,0,0,0|1,0,0]=3 729 B11R1.17 CCCOC1=CC=CC=C1C SBB060850 [0,2,0,0,0,0|1,0,0]=3 730 B11R1.17 CCCOC1=CC=CC=C1N SBB027936 [0,2,0,0,0,0|1,0,0]=3 731 B11R1.17 FC1=CC=CC=C1OCCBr SBB011402 [0,2,0,0,0,0|1,0,0]=3 732 B11R1.17 N#CCCN1C=CC=CC1=O SBB072331 [0,2,0,0,0,0|2,0,0]=4 733 B11R1.17 N#CCOC1=C(Cl)C=CC=C1 SBB088116 [0,2,0,0,0,0|1,0,1]=4 734 B11R1.17 N#CCOC1=CC=CC=C1Br SBB005817 [0,2,0,0,0,0|1,0,1]=4 735 B11R1.17 NC1=CC=CC=C1OCCO SBB024257 [0,2,0,0,0,0|0,1,0]=3 736 B11R1.17 NCCCC1=CC=CC=C1Cl SBB010508 [0,2,0,0,0,0|1,0,0]=3 737 B11R1.17 NCCCN1C=CC=CC1=O SBB072557 [0,2,0,0,0,0|2,0,0]=4 738 B11R1.17 NCCOC1=CC=CC=C1Cl SBB017899 [0,2,0,0,0,0|1,0,0]=3 739 B11R1.17 NCCOC1=CC=CC=C1F SBB039943 [0,2,0,0,0,0|1,0,0]=3 740 B11R1.17 OCCOC1=C(O)C=CC=C1 SBB008523 [0,2,0,0,0,0|0,1,0]=3 741 B11R1.41 CCNC1=C(OC)C=CC=C1 SBB080368 [0,2,0,0,0,0|2,0,0]=4 742 B11R1.41 CCOC1=CC=CC=C1C#N SBB063688 [0,2,0,0,0,0|2,0,0]=4 743 B11R1.41 CCOC1=CC=CC=C1C=O SBB040196 [0,2,0,0,0,0|2,0,0]=4 744 B11R1.41 CCOC1=CC=CC=C1CN SBB070035 [0,2,0,0,0,0|2,0,0]=4 745 B11R1.41 CCOC1=CC=CC=C1NN SBB001773 [0,2,0,0,0,0|2,0,0]=4 746 B11R1.41 COC1=CC=CC=C1CC#N SBB065125 [0,2,0,0,0,0|1,0,1]=4 747 B11R1.41 COC1=CC=CC=C1CC=O SBB052207 [0,2,0,0,0,0|0,1,1]=4 748 B11R1.41 COC1=CC=CC=C1CCBr SBB027259 [0,2,0,0,0,0|1,0,0]=3 749 B11R1.41 COCC1=C(CN)C=CC=C1 SBB085424 [0,2,0,0,0,0|2,0,0]=4 750 B11R1.86 CC(=O)CC1=CC=CC=C1Cl SBB054187 [0,2,0,0,0,0|0,1,1]=4 751 B11R1.86 CC(=O)CC1=CC=CC=C1F SBB086844 [0,2,0,0,0,0|0,1,1]=4 752 B11R1.86 CC(C)OC1=CC=CC=C1N SBB010329 [0,2,0,0,0,0|2,0,0]=4 753 B11R1.86 CC1=CC=CC=C1CC(=O)O SBB063148 [0,2,0,0,0,0|0,1,1]=4 754 B11R1.86 CC1=CC=CC=C1OC(C)C SBB079028 [0,2,0,0,0,0|2,0,0]=4 755 B11R1.86 CN(C)CC1=C(Br)C=CC=C1 SBB109891 [0,2,0,0,0,0|2,0,0]=4 756 B11R1.86 CN(C)CC1=C(O)C=CC=C1 SBB080144 [0,2,0,0,0,0|2,0,0]=4 757 B11R1.86 CN(C)CC1=C(O)C=CC=C1 SBB111386 [0,2,0,0,0,0|2,0,0]=4 758 B11R1.86 FC(F)OC1=C(Br)C=CC=C1 SBB096418 [0,2,0,0,0,0|2,0,0]=4 759 B11R1.86 NC(=O)CC1=CC=CC=C1O SBB072925 [0,2,0,0,0,0|0,1,1]=4 760 B11R1.86 NC1=CC=CC=C1OC(F)F SBB003980 [0,2,0,0,0,0|2,0,0]=4 761 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 SBB006626 [0,2,0,0,0,0|0,1,1]=4 762 B11R1.86 O=C(O)CC1=C(Cl)C=CC=C1 SBB057750 [0,2,0,0,0,0|0,1,1]=4 763 B11R1.86 O=C(O)CC1=C(F)C=CC=C1 SBB057963 [0,2,0,0,0,0|0,1,1]=4 764 B11R1.86 O=C(O)CC1=C(O)C=CC=C1 SBB057742 [0,2,0,0,0,0|0,1,1]=4 765 B11R1.86 O=C(O)CC1=CC=CC=C1I SBB063206 [0,2,0,0,0,0|0,1,1]=4 766 B11R1.182 CC1=CC(CCO)=C(C)C=C1 SBB005840 [0,2,0,0,0,0|0,1,0]=3 767 B11R1.182 CC1=CC=C(C)C(CC#N)=C1 SBB064819 [0,2,0,0,0,0|1,0,1]=4 768 B11R1.182 CCOC1=C(Cl)C=CC(F)=C1 SBB088978 [0,2,0,0,0,0|2,0,0]=4 769 B11R1.182 CCOC1=C(O)C=CC(C)=C1 SBB007984 [0,2,0,0,0,0|2,0,0]=4 770 B11R1.182 N#CCC1=C(Br)C=CC(F)=C1 SBB094882 [0,2,0,0,0,0|1,0,1]=4 771 B11R1.182 N#CCC1=C(F)C=CC(F)=C1 SBB064050 [0,2,0,0,0,0|1,0,1]=4 772 B11R1.182 N#CCC1=CC(Cl)=CC=C1F SBB064487 [0,2,0,0,0,0|1,0,1]=4 773 B11R1.182 OCCC1=C(F)C=CC(F)=C1 SBB087273 [0,2,0,0,0,0|0,1,0]=3 774 B11R1.222 CCC(=O)C1=C(F)C=CC=C1 SBB086854 [0,2,0,0,0,0|1,0,1]=4 775 B11R1.222 CCC(=O)C1=CC=CC=C1O SBB063301 [0,2,0,0,0,0|1,0,1]=4 776 B11R1.222 CCC(C)C1=CC=CC=C1N SBB061726 [0,2,0,0,0,0|1,0,0]=3 777 B11R1.222 CCC(C)C1=CC=CC=C1O SBB061123 [0,2,0,0,0,0|1,0,0]=3 778 B11R1.222 O=C(CBr)C1=CC=CC=C1F SBB051669 [0,2,0,0,0,0|1,0,1]=4 779 B11R1.605 CCCC1=C(O)C=CC=C1O SBB055239 [0,2,0,0,0,0|1,0,0]=3 780 B11R1.605 FC1=CC=CC(Cl)=C1C[Zn]Cl SBB099906 [0,2,0,0,0,0|2,0,0]=4 781 B11R1.605 N#CCC1=C(Cl)C=CC=C1Cl SBB063690 [0,2,0,0,0,0|1,0,1]=4 782 B11R1.605 N#CCC1=C(F)C=CC=C1Cl SBB058430 [0,2,0,0,0,0|1,0,1]=4 783 B11R1.605 N#CCC1=C(F)C=CC=C1F SBB006682 [0,2,0,0,0,0|1,0,1]=4 784 B11R1.605 NC1=C(CCO)C(Cl)=CC=C1 SBB005689 [0,2,0,0,0,0|0,1,0]=3 785 B11R1.605 NNCC1=C(Cl)C=CC=C1F SBB010572 [0,2,0,0,0,0|2,0,0]=4 786 B11R1.23 CCC(=O)C1=CC(Br)=CC=C1 SBB012414 [0,2,0,0,0,0|1,0,1]=4 787 B11R1.23 CCC(=O)C1=CC=CC(Cl)=C1 SBB058431 [0,2,0,0,0,0|1,0,1]=4 788 B11R1.23 CCC(=O)C1=CC=CC(F)=C1 SBB086852 [0,2,0,0,0,0|1,0,1]=4 789 B11R1.23 CCC(N)C1=CC(Cl)=CC=C1 SBB046784 [0,2,0,0,0,0|1,0,0]=3 790 B11R1.23 CCC(O)C1=CC(F)=CC=C1 SBB087015 [0,2,0,0,0,0|1,0,0]=3 791 B11R1.23 NCC(O)C1=CC(O)=CC=C1 SBB000279 [0,2,0,0,0,0|1,0,0]=3 792 B11R1.23 OC1=CC=CC(C(CN)O)=C1 SBB004042 [0,2,0,0,0,0|1,0,0]=3 793 B11R1.24 CC1=CC(OCCBr)=CC=C1 SBB018128 [0,2,0,0,0,0|1,0,0]=3 794 B11R1.24 CC1=CC=CC(CCCO)=N1 SBB047991 [0,2,0,0,0,0|1,1,0]=4 795 B11R1.24 CC1=CC=CC(OCCN)=C1 SBB014043 [0,2,0,0,0,0|1,0,0]=3 796 B11R1.24 CCCNC1=CC(C)=CC=C1 SBB048620 [0,2,0,0,0,0|1,0,0]=3 797 B11R1.24 CCCOC1=CC(N)=CC=C1 SBB080014 [0,2,0,0,0,0|1,0,0]=3 798 B11R1.24 N#CCCC1=CC(Br)=CC=C1 SBB058929 [0,2,0,0,0,0|1,0,0]=3 799 B11R1.24 NC1=CC(OCCO)=CC=C1 SBB085153 [0,2,0,0,0,0|0,1,0]=3 800 B11R1.24 NCCOC1=CC(Br)=CC=C1 SBB072545 [0,2,0,0,0,0|1,0,0]=3 801 B11R1.24 NCCOC1=CC(Cl)=CC=C1 SBB050335 [0,2,0,0,0,0|1,0,0]=3 802 B11R1.24 NCCOC1=CC=CC(F)=C1 SBB027281 [0,2,0,0,0,0|1,0,0]=3 803 B11R1.34 CC1=CC(C)=CC(CC#N)=C1 SBB064821 [0,2,0,0,0,0|1,0,1]=4 804 B11R1.34 CC1=CC(F)=CC(CC#N)=C1 SBB086637 [0,2,0,0,0,0|1,0,1]=4 805 B11R1.34 CCOC1=CC(Cl)=CC(F)=C1 SBB088964 [0,2,0,0,0,0|2,0,0]=4 806 B11R1.34 CNCC1=CC(F)=CC(F)=C1 SBB052361 [0,2,0,0,0,0|2,0,0]=4 807 B11R1.34 N#CCC1=CC(F)=CC(Cl)=C1 SBB064438 [0,2,0,0,0,0|1,0,1]=4 808 B11R1.34 N#CCC1=CC(F)=CC(F)=C1 SBB064299 [0,2,0,0,0,0|1,0,1]=4 809 B11R1.157 C(F)(F)OC1=CC=CC(N)=C1 SBB073340 [0,2,0,0,0,0|2,0,0]=4 810 B11R1.157 CC(=O)CC1=CC=CC(F)=C1 SBB086850 [0,2,0,0,0,0|0,1,1]=4 811 B11R1.157 CC(C)OC1=CC=CC(N)=C1 SBB010221 [0,2,0,0,0,0|2,0,0]=4 812 B11R1.157 CC1=CC=CC(CC(=O)O)=C1 SBB068547 [0,2,0,0,0,0|0,1,1]=4 813 B11R1.157 CC1=NC(CC(C)O)=CC=C1 SBB025634 [0,2,0,0,0,0|1,1,0]=4 814 B11R1.157 CN(C)CC1=CC(Br)=CC=C1 SBB109591 [0,2,0,0,0,0|2,0,0]=4 815 B11R1.157 FC(F)OC1=CC(Br)=CC=C1 SBB096417 [0,2,0,0,0,0|2,0,0]=4 816 B11R1.157 NC1=CC(CC(=O)O)=CC=C1 SBB068772 [0,2,0,0,0,0|0,1,1]=4 817 B11R1.157 O=C(Cl)CC1=CC(F)=CC=C1 SBB088714 [0,2,0,0,0,0|0,1,1]=4 818 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 SBB037935 [0,2,0,0,0,0|0,1,1]=4 819 B11R1.157 O=C(O)CC1=CC=CC(Cl)=C1 SBB063159 [0,2,0,0,0,0|0,1,1]=4 820 B11R1.157 O=C(O)CC1=CC=CC(F)=C1 SBB063367 [0,2,0,0,0,0|0,1,1]=4 821 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 SBB064349 [0,2,0,0,0,0|0,1,1]=4 822 B11R1.157 O=C(O)CC1=CC=CC(O)=C1 SBB063147 [0,2,0,0,0,0|0,1,1]=4 823 B11R1.189 C(=O)C1=CC(OCC)=CC=C1 SBB004072 [0,2,0,0,0,0|2,0,0]=4 824 B11R1.189 CCCC1=NC=CC(C#N)=C1 SBB071707 [0,2,0,0,0,0|2,0,0]=4 825 B11R1.189 COC1=CC(CCBr)=CC=C1 SBB027258 [0,2,0,0,0,0|1,0,0]=3 826 B11R1.189 COC1=CC=CC(CC#N)=C1 SBB055078 [0,2,0,0,0,0|1,0,1]=4 827 B11R1.189 COC1=CC=CC(CC=O)=C1 SBB052208 [0,2,0,0,0,0|0,1,1]=4 828 B11R1.7 C#CC(C)(O)C1=CC=CC=C1 SBB008971 [0,2,0,0,0,0|1,0,1]=4 829 B11R1.7 CC(C)(CN)C1=CC=CC=C1 SBB052397 [0,2,0,0,0,0|1,0,0]=3 830 B11R1.7 CCC(C)(C)C1=CC=CC=C1 SBB060977 [0,2,0,0,0,0|1,0,0]=3 831 B11R1.12 CCC(C#N)C1=CC=CC=C1 SBB068828 [0,2,0,0,0,0|1,0,0]=3 832 B11R1.12 CCC(CC)C1=CC=CC=C1 SBB060456 [0,2,0,0,0,0|1,0,0]=3 833 B11R1.12 CCC(CN)C1=CC=CC=C1 SBB073168 [0,2,0,0,0,0|1,0,0]=3 834 B11R1.12 CCN(CC)C1=CC=CC=C1 SBB060520 [0,2,0,0,0,0|2,0,0]=4 835 B11R1.12 CC\C(=N/O)C1=CC=CC=C1 SBB080355 [0,2,0,0,0,0|1,0,1]=4 836 B11R1.12 N#CC(CO)C1=CC=CC=C1 SBB059710 [0,2,0,0,0,0|0,1,0]=3 837 B11R1.12 O\N=C(/CBr)C1=CC=CC=C1 SBB085154 [0,2,0,0,0,0|1,0,1]=4 838 B11R1.16 CC(CCN)C1=CC=CC=C1 SBB085501 [0,2,0,0,0,0|1,0,0]=3 839 B11R1.16 CC(N=C=O)C1=CC=CC=C1 SBB023344 [0,2,0,0,0,0|0,1,1]=4 840 B11R1.16 CC(N=C=S)C1=CC=CC=C1 SBB029868 [0,2,0,0,0,0|0,0,2]=4 841 B11R1.16 CC(NC=O)C1=CC=CC=C1 SBB068791 [0,2,0,0,0,0|0,1,1]=4 842 B11R1.16 CCCC(=O)C1=CC=CC=C1 SBB058761 [0,2,0,0,0,0|1,0,0]=3 843 B11R1.16 CCC[C@@H](N)C1=CC=CC=C1 SBB070021 [0,2,0,0,0,0|1,0,0]=3 844 B11R1.16 CCNC(=O)C1=CC=CC=C1 SBB058216 [0,2,0,0,0,0|1,0,1]=4 845 B11R1.16 CCOC(=O)C1=CC=CC=C1 SBB058595 [0,2,0,0,0,0|1,0,1]=4 846 B11R1.16 CN(CCN)C1=CC=CC=C1 SBB085429 [0,2,0,0,0,0|1,0,0]=3 847 B11R1.16 CN(CCO)C1=CC=CC=C1 SBB007818 [0,2,0,0,0,0|0,1,0]=3 848 B11R1.16 CN(CCO)C1=NC=CC=C1 SBB017928 [0,2,0,0,0,0|1,1,0]=4 849 B11R1.16 CNCC(C)C1=CC=CC=C1 SBB028094 [0,2,0,0,0,0|1,0,0]=3 850 B11R1.16 N#CCC(=O)C1=CC=CC=C1 SBB004121 [0,2,0,0,0,0|1,0,1]=4 851 B11R1.16 O=C(CCCl)C1=CC=CC=C1 SBB063710 [0,2,0,0,0,0|1,0,0]=3 852 B11R1.16 O=C(CCF)C1=CC=CC=C1 SBB063711 [0,2,0,0,0,0|1,0,0]=3 853 B11R1.16 O=C(SCO)C1=CC=CC=C1 SBB088192 [0,2,0,0,0,0|0,1,1]=4 854 B11R1.16 OC(C#CBr)C1=CC=CC=C1 SBB013371 [0,2,0,0,0,0|1,0,1]=4 855 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 SBB055478 [0,2,0,0,0,0|0,1,1]=4 856 B11R1.36 CC(Br)C(=O)C1=CC=CC=C1 SBB058576 [0,2,0,0,0,0|1,0,1]=4 857 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 SBB007855 [0,2,0,0,0,0|0,1,1]=4 858 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 SBB017231 [0,2,0,0,0,0|0,1,1]=4 859 B11R1.36 NC(=O)C(O)C1=CC=CC=C1 SBB028298 [0,2,0,0,0,0|0,1,1]=4 860 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 SBB056598 [0,2,0,0,0,0|0,1,1]=4 861 B11R1.36 O=C(C1=CC=CC=C1)C(F)F SBB087123 [0,2,0,0,0,0|1,0,1]=4 862 B11R1.36 O=C(Cl)C(Cl)C1=CC=CC=C1 SBB007783 [0,2,0,0,0,0|0,1,1]=4 863 B11R1.36 O=C(O)C(Br)C1=CC=CC=C1 SBB007654 [0,2,0,0,0,0|0,1,1]=4 864 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 SBB086979 [0,2,0,0,0,0|0,1,1]=4 865 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 SBB007730 [0,2,0,0,0,0|0,1,1]=4 866 B11R1.36 O=C(O)C(S)C1=CC=CC=C1 SBB017395 [0,2,0,0,0,0|0,1,1]=4 867 B11R1.28 C#CCNCC1=CC=CC=C1 SBB300092 [0,2,0,0,0,0|1,0,0]=3 868 B11R1.28 CC#CCNC1=CC=CC=C1 SBB010305 [0,2,0,0,0,0|1,0,1]=4 869 B11R1.28 CCCCCC1=CC=CC=C1 SBB057141 [0,2,0,0,0,0|1,0,0]=3 870 B11R1.28 CCCCNC1=CC=CC=C1 SBB058812 [0,2,0,0,0,0|1,0,0]=3 871 B11R1.28 CCCCOC1=CC=CC=C1 SBB060061 [0,2,0,0,0,0|1,0,0]=3 872 B11R1.28 CCCNCC1=CC=CC=C1 SBB080024 [0,2,0,0,0,0|1,0,0]=3 873 B11R1.28 CCCOCC1=CC=CC=C1 SBB061197 [0,2,0,0,0,0|1,0,0]=3 874 B11R1.28 CCC\C=N\C1=CC=CC=C1 SBB055434 [0,2,0,0,0,0|1,0,0]=3 875 B11R1.28 CCO\C=N\C1=CC=CC=C1 SBB059636 [0,2,0,0,0,0|1,0,1]=4 876 B11R1.28 CNCCOC1=CC=CC=C1 SBB027283 [0,2,0,0,0,0|1,0,0]=3 877 B11R1.28 COCCSC1=CC=CC=C1 SBB116878 [0,2,0,0,0,0|0,1,0]=3 878 B11R1.28 ClCCCOC1=CC=CC=C1 SBB300461 [0,2,0,0,0,0|1,0,0]=3 879 B11R1.28 ClCCNCC1=CC=CC=C1 SBB052393 [0,2,0,0,0,0|1,0,0]=3 880 B11R1.28 N#CCCCC1=NC=CC=C1 SBB018559 [0,2,0,0,0,0|2,0,0]=4 881 B11R1.28 N#CCCNC1=CC=CC=C1 SBB004106 [0,2,0,0,0,0|1,0,0]=3 882 B11R1.28 NCCCCC1=NC=CC=C1 SBB018864 [0,2,0,0,0,0|2,0,0]=4 883 B11R1.28 NCCCOC1=CC=CC=C1 SBB043657 [0,2,0,0,0,0|1,0,0]=3 884 B11R1.28 NCCCSC1=CC=CC=C1 SBB071863 [0,2,0,0,0,0|1,0,0]=3 885 B11R1.28 NCCNCC1=CC=CC=C1 SBB028295 [0,2,0,0,0,0|1,0,0]=3 886 B11R1.28 NCCOCC1=CC=CC=C1 SBB050278 [0,2,0,0,0,0|1,0,0]=3 887 B11R1.28 NCCOCC1=CC=CC=C1 SBB055150 [0,2,0,0,0,0|1,0,0]=3 888 B11R1.28 NCCSCC1=CC=CC=C1 SBB003512 [0,2,0,0,0,0|1,0,0]=3 889 B11R1.28 O=C=NCCC1=CC=CC=C1 SBB048864 [0,2,0,0,0,0|0,1,0]=3 890 B11R1.28 OCCNCC1=CC=CC=C1 SBB004062 [0,2,0,0,0,0|0,1,0]=3 891 B11R1.28 OCCNCC1=CC=CN=C1 SBB010335 [0,2,0,0,0,0|1,1,0]=4 892 B11R1.28 OCCNCC1=NC=CC=C1 SBB110041 [0,2,0,0,0,0|1,1,0]=4 893 B11R1.28 OCCOCC1=CC=CC=C1 SBB063066 [0,2,0,0,0,0|0,1,0]=3 894 B11R1.28 OCCSCC1=CC=CC=C1 SBB058901 [0,2,0,0,0,0|0,1,0]=3 895 B11R1.28 S=C=NCCC1=CC=CC=C1 SBB002732 [0,2,0,0,0,0|0,0,1]=3 896 B11R1.40 CC(CN)OC1=CC=CC=C1 SBB028307 [0,2,0,0,0,0|1,0,0]=3 897 B11R1.40 CCC(=O)CC1=CC=CC=C1 SBB060892 [0,2,0,0,0,0|1,0,0]=3 898 B11R1.40 CNC(C)CC1=CC=CC=N1 SBB025630 [0,2,0,0,0,0|2,0,0]=4 899 B11R1.40 NCC(=O)NC1=CC=CC=C1 SBB004992 [0,2,0,0,0,0|1,0,1]=4 900 B11R1.40 NNC(=O)CC1=CC=CC=C1 SBB046750 [0,2,0,0,0,0|0,1,1]=4 901 B11R1.40 N\C(CC1=CC=CC=C1)=N/O SBB055188 [0,2,0,0,0,0|0,1,1]=4 902 B11R1.40 O=C(CBr)NC1=CC=CC=C1 SBB051003 [0,2,0,0,0,0|1,0,1]=4 903 B11R1.40 O=C(CC1=CC=CC=C1)NO SBB086771 [0,2,0,0,0,0|0,1,1]=4 904 B11R1.40 O=C(CCl)NC1=CC=CC=C1 SBB030441 [0,2,0,0,0,0|1,0,1]=4 905 B11R1.40 O=C(CCl)OC1=CC=CC=C1 SBB060340 [0,2,0,0,0,0|1,0,1]=4 906 B11R1.40 O=C(CS)NC1=CC=CC=C1 SBB008339 [0,2,0,0,0,0|0,0,1]=3 907 B11R1.91 CC(=O)CCC1=CC=CC=C1 SBB058827 [0,2,0,0,0,0|0,1,0]=3 908 B11R1.91 CC(=O)OCC1=CC=CC=C1 SBB058375 [0,2,0,0,0,0|0,1,1]=4 909 B11R1.91 CC(C)=CCC1=CC=CC=C1 SBB007979 [0,2,0,0,0,0|1,0,1]=4 910 B11R1.91 CC(C)NCC1=CC=CC=C1 SBB048017 [0,2,0,0,0,0|1,0,0]=3 911 B11R1.91 CC(N)CCC1=CC=CC=C1 SBB059846 [0,2,0,0,0,0|1,0,0]=3 912 B11R1.91 CC(N)COC1=CC=CC=C1 SBB084093 [0,2,0,0,0,0|1,0,0]=3 913 B11R1.91 CC(O)C#CC1=CC=CC=C1 SBB015100 [0,2,0,0,0,0|0,1,1]=4 914 B11R1.91 CN(C)CCC1=NC=CC=C1 SBB086734 [0,2,0,0,0,0|2,0,0]=4 915 B11R1.91 N=C(N)CSC1=CC=CC=C1 SBB055427 [0,2,0,0,0,0|1,0,1]=4 916 B11R1.91 NC(=O)CCC1=CC=CC=C1 SBB058119 [0,2,0,0,0,0|0,1,0]=3 917 B11R1.91 NC(=O)COC1=CC=CC=C1 SBB028296 [0,2,0,0,0,0|0,1,1]=4 918 B11R1.91 NC(=O)NCC1=CC=CC=C1 SBB058548 [0,2,0,0,0,0|0,1,1]=4 919 B11R1.91 NC(=O)OCC1=CC=CC=C1 SBB058407 [0,2,0,0,0,0|0,1,1]=4 920 B11R1.91 NC(=S)CCC1=NC=CC=C1 SBB019122 [0,2,0,0,0,0|1,0,1]=4 921 B11R1.91 NC(=S)COC1=CC=CC=C1 SBB016514 [0,2,0,0,0,0|0,0,2]=4 922 B11R1.91 NC(=S)NCC1=CC=CC=C1 SBB088032 [0,2,0,0,0,0|0,0,2]=4 923 B11R1.91 NC(N)=NCC1=CC=CC=C1 SBB055108 [0,2,0,0,0,0|1,0,1]=4 924 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 SBB058859 [0,2,0,0,0,0|0,1,0]=3 925 B11R1.91 O=C(Cl)COC1=CC=CC=C1 SBB040630 [0,2,0,0,0,0|0,1,1]=4 926 B11R1.91 O=C(Cl)OCC1=CC=CC=C1 SBB063193 [0,2,0,0,0,0|0,1,1]=4 927 B11R1.91 O=C(O)CCC1=CC=CC=C1 SBB056662 [0,2,0,0,0,0|0,1,0]=3 928 B11R1.91 O=C(O)CCC1=CC=CC=N1 SBB018634 [0,2,0,0,0,0|1,1,0]=4 929 B11R1.91 O=C(O)CCC1=CC=NC=C1 SBB012865 [0,2,0,0,0,0|1,1,0]=4 930 B11R1.91 O=C(O)CCC1=CN=CC=C1 SBB028468 [0,2,0,0,0,0|1,1,0]=4 931 B11R1.91 O=C(O)CNC1=CC=CC=C1 SBB028637 [0,2,0,0,0,0|0,1,1]=4 932 B11R1.91 O=C(O)COC1=CC=CC=C1 SBB040522 [0,2,0,0,0,0|0,1,1]=4 933 B11R1.91 O=C(O)CSC1=CC=CC=C1 SBB001712 [0,2,0,0,0,0|0,1,1]=4 934 B11R1.91 OB(O)CCC1=CC=CC=C1 SBB071100 [0,2,0,0,0,0|0,1,0]=3 935 B11R1.509 CC(C)(O)CC1=CC=CC=C1 SBB071444 [0,2,0,0,0,0|0,1,0]=3 936 B11R1.509 CS(=O)(=O)CC1=CC=CC=C1 SBB059072 [0,2,0,0,0,0|1,1,0]=4 937 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 SBB055074 [0,2,0,0,0,0|2,0,0]=4 938 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 SBB059062 [0,2,0,0,0,0|2,0,0]=4 939 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 SBB060274 [0,2,0,0,0,0|2,0,0]=4 940 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 SBB060930 [0,2,0,0,0,0|2,0,0]=4 941 B11R1.509 FC(F)(F)OC1=CC=CC=C1 SBB087565 [0,2,0,0,0,0|2,0,0]=4 942 B11R1.509 O=P(O)(O)CC1=CC=CC=C1 SBB057481 [0,2,0,0,0,0|1,1,0]=4 943 B11R1.509 O=S(=O)(Cl)CC1=CC=CC=C1 SBB016732 [0,2,0,0,0,0|1,1,0]=4 944 B11R1.509 O=S(=O)(F)CC1=CC=CC=C1 SBB088900 [0,2,0,0,0,0|1,1,0]=4 945 B11R2.34 FC1=CC=C([C@@H]2CO2)C=C1 SBB064278 [0,1,0,1,0,0|0,1,0]=3 946 B11R2.36 BrC1=CC2=C(C=C1)OCC2 SBB092410 [0,1,0,1,0,0|0,1,0]=3 947 B11R2.36 BrC1=CC=C2N=CSC2=C1 SBB054570 [0,1,0,1,0,0|1,0,1]=4 948 B11R2.36 BrC1=CC=C2OCOC2=C1 SBB006662 [0,1,0,1,0,0|1,1,0]=4 949 B11R2.36 BrC1=CC=C2SC=CC2=C1 SBB054552 [0,1,0,1,0,0|0,0,2]=4 950 B11R2.36 CC1=CC=C2SC=CC2=C1 SBB055960 [0,1,0,1,0,0|0,0,2]=4 951 B11R2.36 ClC1=CC2=C(C=C1)NCC2 SBB010106 [0,1,0,1,0,0|1,0,0]=3 952 B11R2.36 ClC1=CC=C2OCOC2=C1 SBB059574 [0,1,0,1,0,0|1,1,0]=4 953 B11R2.36 FC1=CC=C2NCCC2=C1 SBB085967 [0,1,0,1,0,0|1,0,0]=3 954 B11R2.36 IC1=CC=C2OCCC2=C1 SBB100062 [0,1,0,1,0,0|0,1,0]=3 955 B11R2.36 NC1=CC2=C(C=C1)CCC2 SBB028245 [0,1,0,1,0,0|1,0,0]=3 956 B11R2.36 NC1=CC2=C(C=C1)N=CS2 SBB028294 [0,1,0,1,0,0|1,0,1]=4 957 B11R2.36 NC1=CC=C2OCOC2=C1 SBB028254 [0,1,0,1,0,0|1,1,0]=4 958 B11R2.36 NC1=CC=C2SC=NC2=C1 SBB027653 [0,1,0,1,0,0|1,0,1]=4 959 B11R2.36 OC1=CC2=C(C=C1)OCO2 SBB085996 [0,1,0,1,0,0|1,1,0]=4 960 B11R2.10 BrC1=NC2=CC=CC=C2S1 SBB054571 [0,1,0,1,0,0|1,0,1]=4 961 B11R2.10 CC1=NC2=C(C=CC=C2)S1 SBB059092 [0,1,0,1,0,0|1,0,1]=4 962 B11R2.10 CC1CC2=C(C=CC=C2)N1 SBB058847 [0,1,0,1,0,0|1,0,0]=3 963 B11R2.10 ClC1=NC2=C(C=CC=C2)S1 SBB059270 [0,1,0,1,0,0|1,0,1]=4 964 B11R2.10 FC1=NC2=C(C=CC=C2)S1 SBB086921 [0,1,0,1,0,0|1,0,1]=4 965 B11R2.10 NC1=NC2=C(C=CC=C2)S1 SBB004071 [0,1,0,1,0,0|1,0,1]=4 966 B11R2.10 NC1CC2=C(C=CC=C2)C1 SBB003858 [0,1,0,1,0,0|1,0,0]=3 967 B11R2.10 NC1CC2=CC=CC=C2C1 SBB052059 [0,1,0,1,0,0|1,0,0]=3 968 B11R2.10 O=C1CC2=CC=CC=C2N1 SBB004215 [0,1,0,1,0,0|0,1,1]=4 969 B11R2.10 O=C1NC2=C(C=CC=C2)S1 SBB037873 [0,1,0,1,0,0|1,0,1]=4 970 B11R2.10 OC1=NC2=C(C=CC=C2)S1 SBB005792 [0,1,0,1,0,0|1,0,1]=4 971 B11R2.10 OC1CC2=C(C=CC=C2)C1 SBB061554 [0,1,0,1,0,0|0,1,0]=3 972 B11R2.10 S=C1NC2=CC=CC=C2S1 SBB037840 [0,1,0,1,0,0|1,0,1]=4 973 B11R2.10 SC1=NC2=C(C=CC=C2)N1 SBB004069 [0,1,0,1,0,0|1,0,1]=4 974 B11R2.10 SC1=NC2=CC=CC=C2O1 SBB055994 [0,1,0,1,0,0|1,0,1]=4 975 B11R2.20 C1=CC2=C(C=C1)CCCC2 SBB060619 [0,1,0,1,0,0|1,0,0]=3 976 B11R2.20 C1=CC2=C(C=C1)CNCC2 SBB027303 [0,1,0,1,0,0|1,0,0]=3 977 B11R2.20 C1=CC2=C(C=C1)SCCN2 SBB010332 [0,1,0,1,0,0|0,0,0]=2 978 B11R2.20 C1=CC=C2NCCCC2=C1 SBB040463 [0,1,0,1,0,0|1,0,0]=3 979 B11R2.20 C1=CC=C2OCCNC2=C1 SBB039942 [0,1,0,1,0,0|0,1,0]=3 980 B11R2.55 NC1=C(C2CC2)C=CC=C1 SBB010265 [0,1,0,1,0,0|1,0,0]=3 981 B11R2.106 NC1=C2OCOC2=CC=C1 SBB069894 [0,1,0,1,0,0|1,1,0]=4 982 B11R2.988 N#CC1CC2=CC=CC=C21 SBB056297 [0,1,0,1,0,0|1,0,0]=3 983 B11R2.35 BrC1=CC(C2CC2)=CC=C1 SBB054182 [0,1,0,1,0,0|1,0,0]=3 984 B11R2.1 BrC1=CSC2=C1C=CC=C2 SBB003415 [0,1,0,1,0,0|0,0,2]=4 985 B11R2.1 CC1=CSC2=CC=CC=C12 SBB086600 [0,1,0,1,0,0|0,0,2]=4 986 B11R2.1 ClC1=NSC2=C1C=CC=C2 SBB088345 [0,1,0,1,0,0|1,0,1]=4 987 B11R2.1 NC1=NCC2=C1C=CC=C2 SBB003870 [0,1,0,1,0,0|1,0,1]=4 988 B11R2.1 NC1=NCC2=C1C=CC=C2 SBB003871 [0,1,0,1,0,0|1,0,1]=4 989 B11R2.1 NC1CCC2=C1C=CC=C2 SBB004212 [0,1,0,1,0,0|1,0,0]=3 990 B11R2.1 O=C1CCC2=C1C=CC=N2 SBB056372 [0,1,0,1,0,0|1,1,0]=4 991 B11R2.1 O=C1CCC2=CC=CC=C12 SBB056339 [0,1,0,1,0,0|0,1,0]=3 992 B11R2.1 O=C1COC2=CC=CC=C12 SBB056285 [0,1,0,1,0,0|0,1,1]=4 993 B11R2.1 O=C1OCC2=C1C=CC=C2 SBB056840 [0,1,0,1,0,0|0,1,1]=4 994 B11R2.1 OC1CCC2=C1C=CC=N2 SBB056373 [0,1,0,1,0,0|1,1,0]=4 995 B11R2.40 NC1(C2=CC=CC=C2)CC1 SBB052390 [0,1,0,1,0,0|1,0,0]=3 996 B7R1.1 BrCC1=CSC=C1 SBB070721 [1,0,0,0,1,0|2,0,0]=4 997 B7R1.1 CCN1C=CC=N1 SBB020346 [1,0,0,0,1,0|2,0,0]=4 998 B7R1.1 CCN1C=CN=C1 SBB045396 [1,0,0,0,1,0|2,0,0]=4 999 B7R1.1 CSC1=CC=CS1 SBB085766 [1,0,0,0,1,0|2,0,0]=4 1000 B7R1.1 CSC1=CSC=C1 SBB055747 [1,0,0,0,1,0|2,0,0]=4 1001 B7R1.1 NCC1=CC=CO1 SBB004376 [1,0,0,0,1,0|2,0,0]=4 1002 B7R1.1 NCC1=CC=CS1 SBB004315 [1,0,0,0,1,0|2,0,0]=4 1003 B7R1.1 NCC1=CSC=C1 SBB079179 [1,0,0,0,1,0|2,0,0]=4 1004 B7R1.1 OCC1=CC=CO1 SBB004373 [1,0,0,0,1,0|1,1,0]=4 1005 B7R1.1 OCC1=CC=CS1 SBB058563 [1,0,0,0,1,0|1,1,0]=4 1006 B7R1.1 OCC1=CSC=C1 SBB004309 [1,0,0,0,1,0|1,1,0]=4 1007 B7R1.1 SCC1=CC=CO1 SBB004308 [1,0,0,0,1,0|1,0,0]=3