0 B9R1.1 BrCC1=CC=C(Br)C=C1 SBB040668 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.1 BrCC1=CC=C(I)C=C1 SBB054901 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.1 C(=O)C1=CC=C(Cl)N=C1 SBB004157 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.1 CC1=CC=C(C#N)C=C1 SBB055483 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.1 CC1=CC=C(CCl)C=C1 SBB040648 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.1 CC1=CC=C(CN)C=C1 SBB040468 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.1 CC1=CC=C(CO)C=C1 SBB063354 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.1 CC1=CC=C(CS)C=C1 SBB086032 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.1 CC1=CC=C(NN)N=N1 SBB055937 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.1 CC1=CN=C(C#N)C=C1 SBB055740 [0,0,0,0,0,0|2,0,1]=3 10 B9R1.1 CC1=CN=C(C=O)C=C1 SBB065436 [0,0,0,0,0,0|2,0,1]=3 11 B9R1.1 CC1=CN=C(CN)C=N1 SBB052489 [0,0,0,0,0,0|1,0,0]=1 12 B9R1.1 CC1=NC=C(C#N)C=C1 SBB065528 [0,0,0,0,0,0|2,0,1]=3 13 B9R1.1 CC1=NC=C(C=O)C=C1 SBB065430 [0,0,0,0,0,0|2,0,1]=3 14 B9R1.1 CC1=NC=C(C=O)C=N1 SBB010235 [0,0,0,0,0,0|3,0,1]=4 15 B9R1.1 CC1=NC=C(CO)C=N1 SBB054825 [0,0,0,0,0,0|3,0,0]=3 16 B9R1.1 CCC1=CC=C(Br)C=C1 SBB054183 [0,0,0,0,0,0|3,0,0]=3 17 B9R1.1 CCC1=CC=C(Br)C=C1 SBB060979 [0,0,0,0,0,0|3,0,0]=3 18 B9R1.1 CCC1=CC=C(C)N=C1 SBB060375 [0,0,0,0,0,0|1,0,0]=1 19 B9R1.1 CCC1=CC=C(F)C=C1 SBB085565 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.1 CCC1=CC=C(N)C=C1 SBB040445 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.1 CCC1=CC=C(O)C=C1 SBB057513 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.1 CNC1=CC=C(N)C=C1 SBB003597 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.1 CNC1=NC=C(Br)C=N1 SBB090683 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.1 CNC1=NN=C(Cl)C=C1 SBB010299 [0,0,0,0,0,0|4,0,0]=4 25 B9R1.1 COC1=CC=C(Br)C=C1 SBB060208 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.1 COC1=CC=C(Br)C=N1 SBB059393 [0,0,0,0,0,0|3,0,0]=3 27 B9R1.1 COC1=CC=C(C)C=C1 SBB060064 [0,0,0,0,0,0|3,0,0]=3 28 B9R1.1 COC1=CC=C(Cl)C=C1 SBB061022 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.1 COC1=CC=C(F)C=C1 SBB085645 [0,0,0,0,0,0|4,0,0]=4 30 B9R1.1 COC1=CC=C(I)N=N1 SBB054551 [0,0,0,0,0,0|4,0,0]=4 31 B9R1.1 COC1=CC=C(N)C=C1 SBB040441 [0,0,0,0,0,0|4,0,0]=4 32 B9R1.1 COC1=CC=C(O)C=C1 SBB060425 [0,0,0,0,0,0|4,0,0]=4 33 B9R1.1 COC1=CN=C(N)C=N1 SBB069821 [0,0,0,0,0,0|2,0,0]=2 34 B9R1.1 COC1=NC=C(Br)C=N1 SBB090872 [0,0,0,0,0,0|4,0,0]=4 35 B9R1.1 COC1=NC=C(F)C=C1 SBB085672 [0,0,0,0,0,0|3,0,0]=3 36 B9R1.1 COC1=NC=C(N)C=C1 SBB016584 [0,0,0,0,0,0|3,0,0]=3 37 B9R1.1 COC1=NC=C(N)C=N1 SBB051954 [0,0,0,0,0,0|4,0,0]=4 38 B9R1.1 COC1=NN=C(Cl)C=C1 SBB004124 [0,0,0,0,0,0|4,0,0]=4 39 B9R1.1 CSC1=CC=C(F)C=C1 SBB086252 [0,0,0,0,0,0|4,0,0]=4 40 B9R1.1 CSC1=CC=C(O)C=C1 SBB071908 [0,0,0,0,0,0|4,0,0]=4 41 B9R1.1 ClCC1=CC=C(Cl)C=C1 SBB058606 [0,0,0,0,0,0|4,0,0]=4 42 B9R1.1 ClCC1=CN=C(Cl)C=C1 SBB003948 [0,0,0,0,0,0|3,0,0]=3 43 B9R1.1 FC1=CC=C(CBr)C=C1 SBB058857 [0,0,0,0,0,0|4,0,0]=4 44 B9R1.1 FC1=CC=C(CCl)C=C1 SBB040604 [0,0,0,0,0,0|4,0,0]=4 45 B9R1.1 N#CC1=CC=C(Cl)N=C1 SBB054388 [0,0,0,0,0,0|3,0,1]=4 46 B9R1.1 N#CC1=CN=C(Br)C=C1 SBB054266 [0,0,0,0,0,0|3,0,1]=4 47 B9R1.1 N#CC1=CN=C(N)C=C1 SBB004293 [0,0,0,0,0,0|3,0,1]=4 48 B9R1.1 N#CC1=NC=C(Br)C=C1 SBB055727 [0,0,0,0,0,0|3,0,1]=4 49 B9R1.1 N#CC1=NC=C(Cl)C=C1 SBB055739 [0,0,0,0,0,0|3,0,1]=4 50 B9R1.1 N#CC1=NC=C(N)C=C1 SBB055614 [0,0,0,0,0,0|3,0,1]=4 51 B9R1.1 N#CC1=NC=C(N)N=C1 SBB055885 [0,0,0,0,0,0|2,0,1]=3 52 B9R1.1 N#CC1=NC=C(O)C=C1 SBB065240 [0,0,0,0,0,0|3,0,1]=4 53 B9R1.1 NC1=CC=C(CO)C=C1 SBB063021 [0,0,0,0,0,0|4,0,0]=4 54 B9R1.1 NC1=CC=C(CO)C=N1 SBB085554 [0,0,0,0,0,0|3,0,0]=3 55 B9R1.1 NC1=CC=C(SC)C=C1 SBB006658 [0,0,0,0,0,0|4,0,0]=4 56 B9R1.1 NCC1=CC=C(Br)C=C1 SBB090347 [0,0,0,0,0,0|4,0,0]=4 57 B9R1.1 NCC1=CC=C(Cl)C=C1 SBB004154 [0,0,0,0,0,0|4,0,0]=4 58 B9R1.1 NCC1=CC=C(Cl)N=C1 SBB049618 [0,0,0,0,0,0|3,0,0]=3 59 B9R1.1 NCC1=CC=C(F)C=C1 SBB017547 [0,0,0,0,0,0|4,0,0]=4 60 B9R1.1 NCC1=CC=C(F)C=C1 SBB028215 [0,0,0,0,0,0|4,0,0]=4 61 B9R1.1 NCC1=CC=C(I)C=C1 SBB052373 [0,0,0,0,0,0|4,0,0]=4 62 B9R1.1 NCC1=CC=C(N)C=C1 SBB002565 [0,0,0,0,0,0|4,0,0]=4 63 B9R1.1 NCC1=CC=C(N)N=C1 SBB052464 [0,0,0,0,0,0|3,0,0]=3 64 B9R1.1 NCC1=CC=C(O)C=C1 SBB046561 [0,0,0,0,0,0|4,0,0]=4 65 B9R1.1 NNC1=CC=C(Br)C=N1 SBB068975 [0,0,0,0,0,0|4,0,0]=4 66 B9R1.1 O=CC1=CC=C(F)N=C1 SBB052255 [0,0,0,0,0,0|3,0,1]=4 67 B9R1.1 O=CC1=CC=C(O)N=C1 SBB052249 [0,0,0,0,0,0|3,0,1]=4 68 B9R1.1 O=CC1=CN=C(Br)C=C1 SBB052244 [0,0,0,0,0,0|3,0,1]=4 69 B9R1.1 O=CC1=NC=C(Br)C=C1 SBB052231 [0,0,0,0,0,0|3,0,1]=4 70 B9R1.1 O=CC1=NC=C(Cl)C=C1 SBB086215 [0,0,0,0,0,0|3,0,1]=4 71 B9R1.1 O=CC1=NC=C(F)C=C1 SBB065526 [0,0,0,0,0,0|3,0,1]=4 72 B9R1.1 OCC1=CC=C(Br)C=C1 SBB064717 [0,0,0,0,0,0|4,0,0]=4 73 B9R1.1 OCC1=CC=C(Cl)C=C1 SBB058581 [0,0,0,0,0,0|4,0,0]=4 74 B9R1.1 OCC1=CC=C(F)C=C1 SBB058560 [0,0,0,0,0,0|4,0,0]=4 75 B9R1.1 OCC1=CC=C(F)N=C1 SBB065619 [0,0,0,0,0,0|3,0,0]=3 76 B9R1.1 OCC1=CC=C(I)C=C1 SBB063681 [0,0,0,0,0,0|4,0,0]=4 77 B9R1.1 OCC1=CC=C(O)C=C1 SBB059322 [0,0,0,0,0,0|4,0,0]=4 78 B9R1.1 OCC1=CN=C(Cl)C=C1 SBB054780 [0,0,0,0,0,0|3,0,0]=3 79 B9R1.1 OCC1=NC=C(Br)C=C1 SBB065294 [0,0,0,0,0,0|3,0,0]=3 80 B9R1.1 OCC1=NC=C(Cl)C=C1 SBB086303 [0,0,0,0,0,0|3,0,0]=3 81 B9R1.1 SCC1=CC=C(Br)C=C1 SBB067614 [0,0,0,0,0,0|4,0,0]=4 82 B9R1.1 [NH2+](C)C1=CC=C(O)C=C1 SBB060652 [0,0,0,0,0,0|4,0,0]=4 83 B9R1.1 [NH3+]NC1=CC=C(C)C=C1 SBB058586 [0,0,0,0,0,0|4,0,0]=4 84 B8R1.2 BrCC1=NC=CC=C1 SBB054926 [1,0,0,0,0,0|2,0,0]=3 85 B8R1.2 C#CC1=CC=CC=N1 SBB006619 [1,0,0,0,0,0|1,0,2]=4 86 B8R1.2 C#CC1=CC=CN=C1 SBB065464 [1,0,0,0,0,0|1,0,2]=4 87 B8R1.2 C=CC1=NC=CN=C1 SBB055880 [1,0,0,0,0,0|0,0,2]=3 88 B8R1.2 CCC1=CC=CC=C1 SBB040891 [1,0,0,0,0,0|2,0,0]=3 89 B8R1.2 CCC1=CC=CC=N1 SBB060373 [1,0,0,0,0,0|1,0,0]=2 90 B8R1.2 CCC1=CC=NC=C1 SBB061128 [1,0,0,0,0,0|3,0,0]=4 91 B8R1.2 CCC1=CN=CC=C1 SBB060374 [1,0,0,0,0,0|1,0,0]=2 92 B8R1.2 CNC1=CC=CC=C1 SBB008162 [1,0,0,0,0,0|3,0,0]=4 93 B8R1.2 CNC1=CC=CC=C1 SBB059778 [1,0,0,0,0,0|3,0,0]=4 94 B8R1.2 CNC1=NC=CN=C1 SBB018751 [1,0,0,0,0,0|1,0,0]=2 95 B8R1.2 CSC1=NN=CC=N1 SBB085690 [1,0,0,0,0,0|2,0,0]=3 96 B8R1.2 ClCC1=NC=CC=C1 SBB054925 [1,0,0,0,0,0|2,0,0]=3 97 B8R1.2 N#CC1=CC=CN=C1 SBB007554 [1,0,0,0,0,0|2,0,1]=4 98 B8R1.2 N#CC1=NC=CC=C1 SBB008920 [1,0,0,0,0,0|2,0,1]=4 99 B8R1.2 N#CC1=NC=CN=C1 SBB055876 [1,0,0,0,0,0|1,0,1]=3 100 B8R1.2 NCC1=CC=CC=C1 SBB040473 [1,0,0,0,0,0|3,0,0]=4 101 B8R1.2 NCC1=CC=CN=C1 SBB004351 [1,0,0,0,0,0|2,0,0]=3 102 B8R1.2 NCC1=NC=CC=C1 SBB004352 [1,0,0,0,0,0|2,0,0]=3 103 B8R1.2 NCC1=NC=CN=C1 SBB014584 [1,0,0,0,0,0|1,0,0]=2 104 B8R1.2 NCC1=NC=NC=C1 SBB086444 [1,0,0,0,0,0|3,0,0]=4 105 B8R1.2 O=CC1=CC=CN=C1 SBB004359 [1,0,0,0,0,0|2,0,1]=4 106 B8R1.2 O=CC1=NC=CC=C1 SBB004358 [1,0,0,0,0,0|2,0,1]=4 107 B8R1.2 O=CC1=NC=CN=C1 SBB052318 [1,0,0,0,0,0|1,0,1]=3 108 B8R1.2 OCC1=CC=CC=C1 SBB058558 [1,0,0,0,0,0|3,0,0]=4 109 B8R1.2 OCC1=CC=CN=C1 SBB004344 [1,0,0,0,0,0|2,0,0]=3 110 B8R1.2 OCC1=CC=CN=N1 SBB054829 [1,0,0,0,0,0|3,0,0]=4 111 B8R1.2 OCC1=CN=CN=C1 SBB065691 [1,0,0,0,0,0|3,0,0]=4 112 B8R1.2 OCC1=NC=CC=C1 SBB004348 [1,0,0,0,0,0|2,0,0]=3 113 B8R1.2 OCC1=NC=CN=C1 SBB054824 [1,0,0,0,0,0|1,0,0]=2 114 B8R1.2 OCC1=NC=NC=C1 SBB054828 [1,0,0,0,0,0|3,0,0]=4 115 B8R1.2 [NH+]1=CC=CC(CCl)=C1 SBB061738 [1,0,0,0,0,0|2,0,1]=4 116 B8R1.3 BrC1=CC=C(I)C=N1 SBB013974 [1,0,0,0,0,0|3,0,0]=4 117 B8R1.3 BrC1=CN=C(Br)C=C1 SBB054335 [1,0,0,0,0,0|3,0,0]=4 118 B8R1.3 BrC1=CN=C(Br)C=N1 SBB054474 [1,0,0,0,0,0|2,0,0]=3 119 B8R1.3 BrC1=CN=C(I)C=C1 SBB054355 [1,0,0,0,0,0|3,0,0]=4 120 B8R1.3 BrC1=CN=C(I)C=N1 SBB054462 [1,0,0,0,0,0|2,0,0]=3 121 B8R1.3 CC1=CC=C(Br)C=C1 SBB040884 [1,0,0,0,0,0|3,0,0]=4 122 B8R1.3 CC1=CC=C(Br)C=N1 SBB088566 [1,0,0,0,0,0|2,0,0]=3 123 B8R1.3 CC1=CC=C(C)N=C1 SBB060370 [1,0,0,0,0,0|1,0,0]=2 124 B8R1.3 CC1=CC=C(Cl)C=C1 SBB040887 [1,0,0,0,0,0|3,0,0]=4 125 B8R1.3 CC1=CC=C(N)C=C1 SBB040498 [1,0,0,0,0,0|3,0,0]=4 126 B8R1.3 CC1=CC=C(N)C=C1 SBB073002 [1,0,0,0,0,0|3,0,0]=4 127 B8R1.3 CC1=CC=C(N)C=N1 SBB051894 [1,0,0,0,0,0|2,0,0]=3 128 B8R1.3 CC1=CC=C(N)N=N1 SBB051974 [1,0,0,0,0,0|3,0,0]=4 129 B8R1.3 CC1=CC=C(O)C=C1 SBB040878 [1,0,0,0,0,0|3,0,0]=4 130 B8R1.3 CC1=CC=C(O)N=N1 SBB051111 [1,0,0,0,0,0|3,0,0]=4 131 B8R1.3 CC1=CN=C(Br)C=C1 SBB054301 [1,0,0,0,0,0|2,0,0]=3 132 B8R1.3 CC1=CN=C(Br)C=N1 SBB054471 [1,0,0,0,0,0|1,0,0]=2 133 B8R1.3 CC1=CN=C(C)C=N1 SBB058647 [1,0,0,0,0,0|0,0,0]=1 134 B8R1.3 CC1=CN=C(Cl)C=C1 SBB085698 [1,0,0,0,0,0|2,0,0]=3 135 B8R1.3 CC1=CN=C(N)C=C1 SBB004353 [1,0,0,0,0,0|2,0,0]=3 136 B8R1.3 CC1=CN=C(N)C=N1 SBB069755 [1,0,0,0,0,0|1,0,0]=2 137 B8R1.3 CC1=CN=C(O)C=C1 SBB055600 [1,0,0,0,0,0|2,0,0]=3 138 B8R1.3 CC1=CN=C(O)N=C1 SBB026947 [1,0,0,0,0,0|3,0,0]=4 139 B8R1.3 CC1=CN=C(S)C=C1 SBB068990 [1,0,0,0,0,0|2,0,0]=3 140 B8R1.3 CC1=CN=C(S)N=C1 SBB021424 [1,0,0,0,0,0|3,0,0]=4 141 B8R1.3 CC1=CNC(=O)C=C1 SBB040121 [1,0,0,0,0,0|2,0,1]=4 142 B8R1.3 CC1=NC=C(O)C=C1 SBB004349 [1,0,0,0,0,0|2,0,0]=3 143 B8R1.3 CC1=NN=C(Cl)C=C1 SBB039123 [1,0,0,0,0,0|3,0,0]=4 144 B8R1.3 ClC1=CC=C(Br)C=N1 SBB013973 [1,0,0,0,0,0|3,0,0]=4 145 B8R1.3 ClC1=CC=C(I)C=N1 SBB013975 [1,0,0,0,0,0|3,0,0]=4 146 B8R1.3 ClC1=CN=C(Br)C=C1 SBB054397 [1,0,0,0,0,0|3,0,0]=4 147 B8R1.3 ClC1=CN=C(Cl)C=C1 SBB054354 [1,0,0,0,0,0|3,0,0]=4 148 B8R1.3 ClC1=CN=C(I)C=C1 SBB054334 [1,0,0,0,0,0|3,0,0]=4 149 B8R1.3 ClC1=NC=C(Br)N=C1 SBB091627 [1,0,0,0,0,0|2,0,0]=3 150 B8R1.3 FC1=CC=C(Br)N=C1 SBB089107 [1,0,0,0,0,0|3,0,0]=4 151 B8R1.3 FC1=CC=C(I)C=N1 SBB013899 [1,0,0,0,0,0|3,0,0]=4 152 B8R1.3 FC1=CN=C(Cl)C=C1 SBB085793 [1,0,0,0,0,0|3,0,0]=4 153 B8R1.3 FC1=NC=C(Br)C=C1 SBB089108 [1,0,0,0,0,0|3,0,0]=4 154 B8R1.3 FC1=NC=C(Cl)C=C1 SBB085795 [1,0,0,0,0,0|3,0,0]=4 155 B8R1.3 NC1=CC=C(Br)N=C1 SBB005540 [1,0,0,0,0,0|3,0,0]=4 156 B8R1.3 NC1=CC=C(Cl)N=C1 SBB004234 [1,0,0,0,0,0|3,0,0]=4 157 B8R1.3 NC1=CC=C(F)N=C1 SBB051873 [1,0,0,0,0,0|3,0,0]=4 158 B8R1.3 NC1=CC=C(I)C=N1 SBB028436 [1,0,0,0,0,0|3,0,0]=4 159 B8R1.3 NC1=CC=C(O)N=C1 SBB028187 [1,0,0,0,0,0|3,0,0]=4 160 B8R1.3 NC1=CN=C(Br)C=N1 SBB028377 [1,0,0,0,0,0|2,0,0]=3 161 B8R1.3 NC1=CN=C(I)C=C1 SBB070540 [1,0,0,0,0,0|3,0,0]=4 162 B8R1.3 NC1=CN=C(N)C=C1 SBB004342 [1,0,0,0,0,0|3,0,0]=4 163 B8R1.3 NC1=NC=C(Br)C=C1 SBB003823 [1,0,0,0,0,0|3,0,0]=4 164 B8R1.3 NC1=NC=C(Cl)C=C1 SBB000059 [1,0,0,0,0,0|3,0,0]=4 165 B8R1.3 NC1=NC=C(F)C=C1 SBB013948 [1,0,0,0,0,0|3,0,0]=4 166 B8R1.3 OC1=CN=C(Cl)C=C1 SBB054276 [1,0,0,0,0,0|3,0,0]=4 167 B8R1.3 OC1=NC=C(Br)C=C1 SBB054347 [1,0,0,0,0,0|3,0,0]=4 168 B8R1.3 OC1=NC=C(Br)N=C1 SBB062713 [1,0,0,0,0,0|2,0,0]=3 169 B8R1.3 OC1=NC=C(Cl)C=C1 SBB054352 [1,0,0,0,0,0|3,0,0]=4 170 B8R1.3 OC1=NC=C(I)C=C1 SBB054372 [1,0,0,0,0,0|3,0,0]=4 171 B10R1.1 CC1=CC=C(CC#N)C=C1 SBB063995 [0,1,0,0,0,0|2,0,1]=4 172 B10R1.1 CC1=CC=C(CC=O)C=C1 SBB052212 [0,1,0,0,0,0|2,0,1]=4 173 B10R1.1 CC1=CC=C(CON)C=C1 SBB021738 [0,1,0,0,0,0|3,0,0]=4 174 B10R1.1 CCCC1=CC=C(N)C=C1 SBB008337 [0,1,0,0,0,0|3,0,0]=4 175 B10R1.1 CCCC1=CC=C(O)C=C1 SBB055506 [0,1,0,0,0,0|3,0,0]=4 176 B10R1.1 CCCC1=CN=C(Cl)N=C1 SBB054517 [0,1,0,0,0,0|3,0,0]=4 177 B10R1.1 CCCC1=CN=C(S)N=C1 SBB066482 [0,1,0,0,0,0|3,0,0]=4 178 B10R1.1 CCOC1=CC=C(Br)C=C1 SBB059353 [0,1,0,0,0,0|3,0,0]=4 179 B10R1.1 CCOC1=CC=C(C)C=C1 SBB060988 [0,1,0,0,0,0|2,0,0]=3 180 B10R1.1 CCOC1=CC=C(Cl)C=C1 SBB040853 [0,1,0,0,0,0|3,0,0]=4 181 B10R1.1 CCOC1=CC=C(Cl)N=N1 SBB049613 [0,1,0,0,0,0|3,0,0]=4 182 B10R1.1 CCOC1=CC=C(F)C=C1 SBB086157 [0,1,0,0,0,0|3,0,0]=4 183 B10R1.1 CCOC1=CC=C(N)C=C1 SBB040442 [0,1,0,0,0,0|3,0,0]=4 184 B10R1.1 CCOC1=CC=C(N)C=C1 SBB073014 [0,1,0,0,0,0|3,0,0]=4 185 B10R1.1 CCOC1=CC=C(O)C=C1 SBB043810 [0,1,0,0,0,0|3,0,0]=4 186 B10R1.1 CCOC1=NC=C(Br)C=C1 SBB054264 [0,1,0,0,0,0|2,0,0]=3 187 B10R1.1 CCSC1=CC=C(N)C=C1 SBB071614 [0,1,0,0,0,0|3,0,0]=4 188 B10R1.1 CNCC1=CC=C(C)C=C1 SBB079252 [0,1,0,0,0,0|2,0,0]=3 189 B10R1.1 CNCC1=CC=C(Cl)C=C1 SBB010371 [0,1,0,0,0,0|3,0,0]=4 190 B10R1.1 CNCC1=CC=C(F)C=C1 SBB005902 [0,1,0,0,0,0|3,0,0]=4 191 B10R1.1 CNCC1=CC=C(O)C=C1 SBB046545 [0,1,0,0,0,0|3,0,0]=4 192 B10R1.1 FC1=CC=C(CCCl)C=C1 SBB087329 [0,1,0,0,0,0|3,0,0]=4 193 B10R1.1 NC1=CC=C(CCO)C=C1 SBB042772 [0,1,0,0,0,0|3,0,0]=4 194 B10R1.1 NCCC1=CC=C(F)C=C1 SBB003787 [0,1,0,0,0,0|3,0,0]=4 195 B10R1.1 NCCC1=CC=C(F)C=C1 SBB058811 [0,1,0,0,0,0|3,0,0]=4 196 B10R1.1 NCCC1=CC=C(O)C=C1 SBB003808 [0,1,0,0,0,0|3,0,0]=4 197 B10R1.1 OCCC1=CC=C(Br)C=C1 SBB055082 [0,1,0,0,0,0|3,0,0]=4 198 B10R1.1 OCCC1=CC=C(F)C=C1 SBB086156 [0,1,0,0,0,0|3,0,0]=4 199 B10R1.1 OCCC1=CC=C(O)C=C1 SBB086008 [0,1,0,0,0,0|3,0,0]=4 200 B10R1.3 BrCC1=CC=C(CBr)C=C1 SBB038639 [0,1,0,0,0,0|3,0,0]=4 201 B10R1.3 CCC1=CC=C(C#N)C=C1 SBB059144 [0,1,0,0,0,0|2,0,1]=4 202 B10R1.3 CCC1=CC=C(C=O)C=C1 SBB040197 [0,1,0,0,0,0|2,0,1]=4 203 B10R1.3 CCC1=CC=C(CC)C=C1 SBB061169 [0,1,0,0,0,0|2,0,0]=3 204 B10R1.3 CCC1=CC=C(CN)C=C1 SBB017636 [0,1,0,0,0,0|2,0,0]=3 205 B10R1.3 CCC1=CC=C(NN)C=C1 SBB001777 [0,1,0,0,0,0|3,0,0]=4 206 B10R1.3 CCC1=CC=C(NN)C=C1 SBB064984 [0,1,0,0,0,0|3,0,0]=4 207 B10R1.3 CCC1=CC=C(OC)C=C1 SBB060457 [0,1,0,0,0,0|2,0,0]=3 208 B10R1.3 CNC1=CC=C(OC)C=C1 SBB072645 [0,1,0,0,0,0|3,0,0]=4 209 B10R1.3 COC1=CC=C(C#N)C=N1 SBB055563 [0,1,0,0,0,0|2,0,1]=4 210 B10R1.3 COC1=CC=C(C=O)C=N1 SBB052248 [0,1,0,0,0,0|2,0,1]=4 211 B10R1.3 COC1=CC=C(CBr)C=C1 SBB054916 [0,1,0,0,0,0|3,0,0]=4 212 B10R1.3 COC1=CC=C(CCl)C=C1 SBB040608 [0,1,0,0,0,0|3,0,0]=4 213 B10R1.3 COC1=CC=C(CN)C=C1 SBB040460 [0,1,0,0,0,0|3,0,0]=4 214 B10R1.3 COC1=CC=C(CO)C=C1 SBB063123 [0,1,0,0,0,0|3,0,0]=4 215 B10R1.3 COC1=CC=C(OC)C=C1 SBB060067 [0,1,0,0,0,0|3,0,0]=4 216 B10R1.3 CSC1=CC=C(CN)C=C1 SBB017654 [0,1,0,0,0,0|3,0,0]=4 217 B10R1.3 CSC1=CC=C(CO)C=C1 SBB064786 [0,1,0,0,0,0|3,0,0]=4 218 B10R1.3 ClCC1=CC=C(CCl)C=C1 SBB058873 [0,1,0,0,0,0|3,0,0]=4 219 B10R1.3 N#CC1=NC=C(CBr)C=C1 SBB054921 [0,1,0,0,0,0|2,0,1]=4 220 B10R1.3 NCC1=CC=C(CN)C=C1 SBB069890 [0,1,0,0,0,0|3,0,0]=4 221 B10R1.3 NCC1=CC=C(CO)C=C1 SBB052367 [0,1,0,0,0,0|3,0,0]=4 222 B10R1.3 OCC1=CC=C(CO)C=C1 SBB008468 [0,1,0,0,0,0|3,0,0]=4 223 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 SBB055637 [0,1,0,0,0,0|2,0,1]=4 224 B10R1.13 CC(=O)C1=CC=C(C)C=C1 SBB058845 [0,1,0,0,0,0|2,0,1]=4 225 B10R1.13 CC(=O)C1=CC=C(C)N=C1 SBB055610 [0,1,0,0,0,0|1,0,1]=3 226 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 SBB055593 [0,1,0,0,0,0|2,0,1]=4 227 B10R1.13 CC(C)C1=CC=C(N)C=C1 SBB040447 [0,1,0,0,0,0|3,0,0]=4 228 B10R1.13 CC(N)C1=CC=C(F)C=C1 SBB046789 [0,1,0,0,0,0|3,0,0]=4 229 B10R1.13 CC(N)C1=CC=C(O)C=C1 SBB008453 [0,1,0,0,0,0|3,0,0]=4 230 B10R1.13 CC(N)C1=CC=C(O)C=C1 SBB080372 [0,1,0,0,0,0|3,0,0]=4 231 B10R1.13 CC(O)C1=CC=C(Cl)C=C1 SBB063808 [0,1,0,0,0,0|3,0,0]=4 232 B10R1.13 CC(O)C1=CC=C(N)C=C1 SBB048111 [0,1,0,0,0,0|3,0,0]=4 233 B10R1.13 CC1=CC=C(B(O)O)C=N1 SBB052580 [0,1,0,0,0,0|3,0,0]=4 234 B10R1.13 CC1=CC=C(C(=O)O)C=N1 SBB006666 [0,1,0,0,0,0|2,0,1]=4 235 B10R1.13 CC1=CC=C(C(C)C)C=C1 SBB060399 [0,1,0,0,0,0|2,0,0]=3 236 B10R1.13 CC1=CC=C(C(C)N)C=C1 SBB010017 [0,1,0,0,0,0|2,0,0]=3 237 B10R1.13 CC1=CC=C(C(C)O)C=C1 SBB061733 [0,1,0,0,0,0|2,0,0]=3 238 B10R1.13 CC1=CC=C(C(N)=S)C=N1 SBB055742 [0,1,0,0,0,0|2,0,1]=4 239 B10R1.13 CC1=CN=C(B(O)O)C=C1 SBB071136 [0,1,0,0,0,0|3,0,0]=4 240 B10R1.13 CC1=CN=C(C(=O)O)C=C1 SBB052876 [0,1,0,0,0,0|2,0,1]=4 241 B10R1.13 CC1=NC=C(C(=O)O)N=C1 SBB006622 [0,1,0,0,0,0|1,0,1]=3 242 B10R1.13 CC1=NC=C(C(N)=O)C=C1 SBB028251 [0,1,0,0,0,0|2,0,1]=4 243 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 SBB064275 [0,1,0,0,0,0|3,0,0]=4 244 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 SBB064274 [0,1,0,0,0,0|3,0,0]=4 245 B10R1.13 ClC1=CC=C(C(Cl)Cl)C=N1 SBB054302 [0,1,0,0,0,0|3,0,0]=4 246 B10R1.13 NC(C)C1=CC=C(Br)C=C1 SBB006746 [0,1,0,0,0,0|3,0,0]=4 247 B10R1.13 NC(C)C1=CC=C(Cl)C=C1 SBB004019 [0,1,0,0,0,0|3,0,0]=4 248 B10R1.13 O=C(O)C1=NC=C(Cl)N=C1 SBB053217 [0,1,0,0,0,0|2,0,1]=4 249 B10R1.13 O=C(O)C1=NC=C(O)N=C1 SBB047806 [0,1,0,0,0,0|2,0,1]=4 250 B10R1.25 CC1=CC(C)=C(CCl)C=C1 SBB005790 [0,1,0,0,0,0|3,0,0]=4 251 B10R1.25 CC1=CC(F)=C(CBr)C=C1 SBB093047 [0,1,0,0,0,0|3,0,0]=4 252 B10R1.25 CC1=CC(F)=C(CN)C=C1 SBB086083 [0,1,0,0,0,0|3,0,0]=4 253 B10R1.25 CC1=CC(F)=C(CO)C=C1 SBB086161 [0,1,0,0,0,0|3,0,0]=4 254 B10R1.25 CC1=CC=C(C#N)C(Cl)=N1 SBB006618 [0,1,0,0,0,0|2,0,1]=4 255 B10R1.25 CC1=CN=C(C#N)C(N)=C1 SBB085840 [0,1,0,0,0,0|2,0,1]=4 256 B10R1.25 CC1=NC=C(CN)C(N)=N1 SBB086023 [0,1,0,0,0,0|3,0,0]=4 257 B10R1.25 CCC1=C(C)C=C(C)C=C1 SBB061315 [0,1,0,0,0,0|2,0,0]=3 258 B10R1.25 CCC1=C(N)N=C(C)C=C1 SBB028253 [0,1,0,0,0,0|1,0,0]=2 259 B10R1.25 COC1=C(N)C=C(Br)C=N1 SBB093040 [0,1,0,0,0,0|3,0,0]=4 260 B10R1.25 COC1=C(O)C=C(C)C=C1 SBB008267 [0,1,0,0,0,0|3,0,0]=4 261 B10R1.25 COC1=CC=C(C)C=C1C SBB061025 [0,1,0,0,0,0|3,0,0]=4 262 B10R1.25 COC1=CC=C(C)C=C1N SBB040483 [0,1,0,0,0,0|3,0,0]=4 263 B10R1.25 COC1=CC=C(N)N=C1Br SBB005638 [0,1,0,0,0,0|3,0,0]=4 264 B10R1.25 COC1=NC=C(Br)C=C1C SBB054332 [0,1,0,0,0,0|3,0,0]=4 265 B10R1.25 O=CC1=NC=C(Cl)N=C1Cl SBB052319 [0,1,0,0,0,0|2,0,1]=4 266 B10R1.25 OCC1=CC=C(Cl)N=C1Cl SBB089352 [0,1,0,0,0,0|3,0,0]=4 267 B10R1.176 CC1=C(Cl)C=C(CN)C=C1 SBB052374 [0,1,0,0,0,0|3,0,0]=4 268 B10R1.176 CC1=C(N)C=C(CO)C=C1 SBB054776 [0,1,0,0,0,0|3,0,0]=4 269 B10R1.176 CC1=CC=C(CCl)C=C1Cl SBB008275 [0,1,0,0,0,0|3,0,0]=4 270 B10R1.176 CC1=CC=C(CN)C=C1C SBB028250 [0,1,0,0,0,0|3,0,0]=4 271 B10R1.176 CC1=CC=C(CN)C=C1F SBB069916 [0,1,0,0,0,0|3,0,0]=4 272 B10R1.176 CC1=CC=C(CO)C=C1C SBB063329 [0,1,0,0,0,0|3,0,0]=4 273 B10R1.176 CC1=CC=C(CO)C=C1Cl SBB008274 [0,1,0,0,0,0|3,0,0]=4 274 B10R1.176 CC1=CC=C(CO)C=C1F SBB086169 [0,1,0,0,0,0|3,0,0]=4 275 B10R1.176 CCC1=CC(C)=C(C)C=C1 SBB061288 [0,1,0,0,0,0|2,0,0]=3 276 B10R1.176 CCC1=CC=C(O)C(N)=C1 SBB000071 [0,1,0,0,0,0|3,0,0]=4 277 B10R1.176 COC1=CC(N)=C(C)C=C1 SBB058810 [0,1,0,0,0,0|3,0,0]=4 278 B10R1.176 COC1=CC(N)=C(N)C=N1 SBB062788 [0,1,0,0,0,0|3,0,0]=4 279 B10R1.176 COC1=CC=C(C)C(F)=C1 SBB086170 [0,1,0,0,0,0|3,0,0]=4 280 B10R1.176 COC1=CC=C(N)C(Br)=N1 SBB070409 [0,1,0,0,0,0|3,0,0]=4 281 B10R1.176 OCC1=CC(Cl)=C(Cl)N=C1 SBB054797 [0,1,0,0,0,0|3,0,0]=4 282 B8R1.1 C#CC1=CN(C)N=C1 SBB074343 [0,0,0,0,1,0|1,0,2]=4 283 B8R1.1 C(=O)C1=CC(C)=NO1 SBB073327 [0,0,0,0,1,0|2,0,1]=4 284 B8R1.1 C(=O)C1=CN(C)N=C1 SBB000002 [0,0,0,0,1,0|2,0,1]=4 285 B8R1.1 CC1=CC(C=O)=NO1 SBB052294 [0,0,0,0,1,0|2,0,1]=4 286 B8R1.1 CC1=CC(CBr)=NO1 SBB089113 [0,0,0,0,1,0|2,0,0]=3 287 B8R1.1 CC1=CC(CCl)=NO1 SBB026481 [0,0,0,0,1,0|2,0,0]=3 288 B8R1.1 CC1=CC(CN)=NO1 SBB018900 [0,0,0,0,1,0|2,0,0]=3 289 B8R1.1 CC1=CC(CO)=CS1 SBB017457 [0,0,0,0,1,0|2,0,0]=3 290 B8R1.1 CC1=CC(CO)=NO1 SBB025974 [0,0,0,0,1,0|2,0,0]=3 291 B8R1.1 CC1=CC=C(CN)O1 SBB047770 [0,0,0,0,1,0|3,0,0]=4 292 B8R1.1 CC1=CN(CCl)N=C1 SBB031559 [0,0,0,0,1,0|2,0,0]=3 293 B8R1.1 CC1=CN(CO)N=C1 SBB023299 [0,0,0,0,1,0|2,0,0]=3 294 B8R1.1 CC1=CN=C(C=O)S1 SBB052287 [0,0,0,0,1,0|2,0,1]=4 295 B8R1.1 CC1=CN=C(CO)S1 SBB054807 [0,0,0,0,1,0|2,0,0]=3 296 B8R1.1 CC1=CSC(CO)=N1 SBB054809 [0,0,0,0,1,0|2,0,0]=3 297 B8R1.1 CC1=NC(C#N)=CS1 SBB085571 [0,0,0,0,1,0|2,0,1]=4 298 B8R1.1 CC1=NC(C=O)=CN1 SBB052314 [0,0,0,0,1,0|1,0,2]=4 299 B8R1.1 CC1=NC(C=O)=CS1 SBB085686 [0,0,0,0,1,0|2,0,1]=4 300 B8R1.1 CC1=NC(CCl)=CS1 SBB005574 [0,0,0,0,1,0|2,0,0]=3 301 B8R1.1 CC1=NC(CCl)=CS1 SBB054934 [0,0,0,0,1,0|2,0,0]=3 302 B8R1.1 CC1=NC(CCl)=NO1 SBB014359 [0,0,0,0,1,0|2,0,0]=3 303 B8R1.1 CC1=NC(CN)=CS1 SBB052476 [0,0,0,0,1,0|2,0,0]=3 304 B8R1.1 CC1=NC(CN)=NO1 SBB018524 [0,0,0,0,1,0|2,0,0]=3 305 B8R1.1 CC1=NC(CO)=NO1 SBB018815 [0,0,0,0,1,0|2,0,0]=3 306 B8R1.1 CC1=NC=C(C=O)S1 SBB018895 [0,0,0,0,1,0|2,0,1]=4 307 B8R1.1 CC1=NN=C(CCl)O1 SBB012831 [0,0,0,0,1,0|3,0,0]=4 308 B8R1.1 CC1=NN=C(CN)O1 SBB018726 [0,0,0,0,1,0|3,0,0]=4 309 B8R1.1 CC1=NNC(C=O)=C1 SBB020823 [0,0,0,0,1,0|2,0,1]=4 310 B8R1.1 CC1=NNC(CN)=C1 SBB027644 [0,0,0,0,1,0|2,0,0]=3 311 B8R1.1 CC1=NNC(CN)=N1 SBB013189 [0,0,0,0,1,0|2,0,0]=3 312 B8R1.1 CC1=NNC(CO)=C1 SBB080476 [0,0,0,0,1,0|2,0,0]=3 313 B8R1.1 CC1=NOC(C#N)=C1 SBB073421 [0,0,0,0,1,0|2,0,1]=4 314 B8R1.1 CC1=NOC(CCl)=N1 SBB014390 [0,0,0,0,1,0|2,0,0]=3 315 B8R1.1 CC1=NOC(CN)=C1 SBB026727 [0,0,0,0,1,0|2,0,0]=3 316 B8R1.1 CC1=NOC(CO)=C1 SBB025975 [0,0,0,0,1,0|2,0,0]=3 317 B8R1.1 CCC1=CC(Br)=CS1 SBB073295 [0,0,0,0,1,0|2,0,0]=3 318 B8R1.1 CCC1=NN=C(N)N1 SBB017904 [0,0,0,0,1,0|2,0,1]=4 319 B8R1.1 CCC1=NN=C(N)O1 SBB059512 [0,0,0,0,1,0|3,0,0]=4 320 B8R1.1 CCC1=NN=C(N)S1 SBB028237 [0,0,0,0,1,0|3,0,0]=4 321 B8R1.1 CCC1=NN=C(S)N1 SBB024810 [0,0,0,0,1,0|2,0,1]=4 322 B8R1.1 CCC1=NSC(N)=N1 SBB005485 [0,0,0,0,1,0|2,0,0]=3 323 B8R1.1 CCN1C=C(Br)C=N1 SBB046690 [0,0,0,0,1,0|2,0,0]=3 324 B8R1.1 CCN1C=C(Cl)C=N1 SBB046646 [0,0,0,0,1,0|2,0,0]=3 325 B8R1.1 CCN1C=C(I)C=N1 SBB051456 [0,0,0,0,1,0|2,0,0]=3 326 B8R1.1 CCN1C=C(N)C=N1 SBB009610 [0,0,0,0,1,0|2,0,0]=3 327 B8R1.1 CCN1C=C(O)C=N1 SBB032284 [0,0,0,0,1,0|2,0,0]=3 328 B8R1.1 CCN1C=CC(Br)=N1 SBB054434 [0,0,0,0,1,0|3,0,0]=4 329 B8R1.1 CCN1C=CC(C)=N1 SBB020339 [0,0,0,0,1,0|2,0,0]=3 330 B8R1.1 CCN1C=CC(I)=N1 SBB116216 [0,0,0,0,1,0|3,0,0]=4 331 B8R1.1 CCN1C=CC(N)=N1 SBB020916 [0,0,0,0,1,0|3,0,0]=4 332 B8R1.1 CCN1C=NC(N)=N1 SBB073346 [0,0,0,0,1,0|2,0,0]=3 333 B8R1.1 CN1C=C(C#N)C=N1 SBB021947 [0,0,0,0,1,0|2,0,1]=4 334 B8R1.1 CN1C=C(CCl)C=N1 SBB026129 [0,0,0,0,1,0|2,0,0]=3 335 B8R1.1 CN1C=C(CN)C=N1 SBB000039 [0,0,0,0,1,0|2,0,0]=3 336 B8R1.1 CN1C=C(CO)C=N1 SBB022156 [0,0,0,0,1,0|2,0,0]=3 337 B8R1.1 CN1C=CC(CCl)=N1 SBB054941 [0,0,0,0,1,0|3,0,0]=4 338 B8R1.1 CN1C=CC(CN)=N1 SBB020585 [0,0,0,0,1,0|3,0,0]=4 339 B8R1.1 CN1C=CC(CO)=N1 SBB073640 [0,0,0,0,1,0|3,0,0]=4 340 B8R1.1 COC1=NC(Br)=NN1 SBB116034 [0,0,0,0,1,0|3,0,0]=4 341 B8R1.1 COC1=NSC(N)=N1 SBB005490 [0,0,0,0,1,0|3,0,0]=4 342 B8R1.1 CSC1=NC(N)=NS1 SBB005495 [0,0,0,0,1,0|3,0,0]=4 343 B8R1.1 CSC1=NC(O)=NS1 SBB059105 [0,0,0,0,1,0|3,0,0]=4 344 B8R1.1 CSC1=NSC(N)=N1 SBB005494 [0,0,0,0,1,0|3,0,0]=4 345 B8R1.1 ClCC1=CC(Br)=NO1 SBB054936 [0,0,0,0,1,0|3,0,0]=4 346 B8R1.1 ClCC1=CN=C(Cl)S1 SBB070711 [0,0,0,0,1,0|3,0,0]=4 347 B8R1.1 ClCN1C=C(Br)C=N1 SBB021115 [0,0,0,0,1,0|3,0,0]=4 348 B8R1.1 ClCN1C=C(Cl)C=N1 SBB022607 [0,0,0,0,1,0|3,0,0]=4 349 B8R1.1 N1C=C(C)N=C1CC SBB004334 [0,0,0,0,1,0|0,0,1]=2 350 B8R1.1 NC1=NC(CCl)=CS1 SBB027575 [0,0,0,0,1,0|3,0,0]=4 351 B8R1.1 NC1=NC(CCl)=CS1 SBB090242 [0,0,0,0,1,0|3,0,0]=4 352 B8R1.1 NC1=NC(CO)=CS1 SBB014800 [0,0,0,0,1,0|3,0,0]=4 353 B8R1.1 NC1=NC(CO)=NN1 SBB012798 [0,0,0,0,1,0|3,0,0]=4 354 B8R1.1 NC1=NC=C(CO)S1 SBB054810 [0,0,0,0,1,0|3,0,0]=4 355 B8R1.1 NC1=NNC(CO)=C1 SBB073850 [0,0,0,0,1,0|3,0,0]=4 356 B8R1.1 NCC1=NNC(N)=N1 SBB013195 [0,0,0,0,1,0|3,0,0]=4 357 B8R1.1 OCC1=CC(Br)=CS1 SBB091532 [0,0,0,0,1,0|3,0,0]=4 358 B8R1.1 OCC1=CN=C(Cl)S1 SBB086668 [0,0,0,0,1,0|3,0,0]=4 359 B8R1.1 OCN1C=C(Br)C=N1 SBB024003 [0,0,0,0,1,0|3,0,0]=4 360 B8R1.1 OCN1C=C(Cl)C=N1 SBB022509 [0,0,0,0,1,0|3,0,0]=4 361 B8R1.1 SC1=NC(SC)=NS1 SBB003912 [0,0,0,0,1,0|3,0,0]=4 362 B7R1.3 BrC1=CC=CN=C1 SBB003998 [2,0,0,0,0,0|2,0,0]=4 363 B7R1.3 BrC1=NC=CC=C1 SBB003999 [2,0,0,0,0,0|2,0,0]=4 364 B7R1.3 BrC1=NC=CN=C1 SBB087333 [2,0,0,0,0,0|1,0,0]=3 365 B7R1.3 CC1=CN=CC=N1 SBB060830 [2,0,0,0,0,0|0,0,0]=2 366 B7R1.3 ClC1=NC=CC=C1 SBB079180 [2,0,0,0,0,0|2,0,0]=4 367 B7R1.3 FC1=CC=CN=C1 SBB054315 [2,0,0,0,0,0|2,0,0]=4 368 B7R1.3 FC1=NC=CC=C1 SBB062911 [2,0,0,0,0,0|2,0,0]=4 369 B7R1.3 IC1=CC=CN=C1 SBB054246 [2,0,0,0,0,0|2,0,0]=4 370 B7R1.3 IC1=NC=CC=C1 SBB054364 [2,0,0,0,0,0|2,0,0]=4 371 B7R1.3 IC1=NC=CN=C1 SBB093563 [2,0,0,0,0,0|1,0,0]=3 372 B7R1.3 NC1=CC=CC=N1 SBB004394 [2,0,0,0,0,0|2,0,0]=4 373 B7R1.3 NC1=CN=CC=C1 SBB004395 [2,0,0,0,0,0|2,0,0]=4 374 B7R1.3 NC1=CN=CC=N1 SBB004388 [2,0,0,0,0,0|1,0,0]=3 375 B7R1.3 NC1=NN=CC=N1 SBB004379 [2,0,0,0,0,0|2,0,0]=4 376 B7R1.3 OC1=CC=CC=N1 SBB004392 [2,0,0,0,0,0|2,0,0]=4 377 B7R1.3 OC1=CN=CC=C1 SBB004391 [2,0,0,0,0,0|2,0,0]=4 378 B7R1.3 SC1=CC=CC=N1 SBB058593 [2,0,0,0,0,0|2,0,0]=4 379 B9R1.2 CC1=CC(CN)=NC=C1 SBB052434 [1,1,0,0,0,0|2,0,0]=4 380 B9R1.2 CC1=CC=CC(CBr)=N1 SBB070747 [1,1,0,0,0,0|2,0,0]=4 381 B9R1.2 CC1=CC=CC(CN)=N1 SBB079460 [1,1,0,0,0,0|2,0,0]=4 382 B9R1.2 CC1=CC=CC(CO)=N1 SBB065460 [1,1,0,0,0,0|2,0,0]=4 383 B9R1.2 CCC1=CC(C)=CC=C1 SBB061286 [1,1,0,0,0,0|2,0,0]=4 384 B9R1.2 CCC1=CC(C)=CC=C1 SBB061444 [1,1,0,0,0,0|2,0,0]=4 385 B9R1.2 CCC1=CC=CC(Br)=C1 SBB090239 [1,1,0,0,0,0|2,0,0]=4 386 B9R1.2 CCC1=CN=CC(Br)=C1 SBB054407 [1,1,0,0,0,0|1,0,0]=3 387 B9R1.2 CCC1=NC(N)=CC=C1 SBB028205 [1,1,0,0,0,0|1,0,0]=3 388 B9R1.2 COC1=CC=CC(Br)=N1 SBB054383 [1,1,0,0,0,0|2,0,0]=4 389 B9R1.2 COC1=CC=CC(F)=N1 SBB085671 [1,1,0,0,0,0|2,0,0]=4 390 B9R1.2 COC1=CC=CC(N)=N1 SBB051862 [1,1,0,0,0,0|2,0,0]=4 391 B9R1.2 COC1=CN=CC(Br)=C1 SBB054402 [1,1,0,0,0,0|2,0,0]=4 392 B9R1.2 COC1=NC=CC(Br)=C1 SBB054328 [1,1,0,0,0,0|2,0,0]=4 393 B9R1.2 COC1=NC=CC(N)=C1 SBB051798 [1,1,0,0,0,0|2,0,0]=4 394 B9R1.2 ClCC1=CC(Br)=CN=C1 SBB054923 [1,1,0,0,0,0|2,0,0]=4 395 B9R1.2 NCC1=CC(Br)=CN=C1 SBB090527 [1,1,0,0,0,0|2,0,0]=4 396 B9R1.2 OCC1=CC(Br)=CN=C1 SBB065467 [1,1,0,0,0,0|2,0,0]=4 397 B9R1.2 OCC1=CC(Cl)=CC=N1 SBB065656 [1,1,0,0,0,0|2,0,0]=4 398 B9R1.2 OCC1=NC(Cl)=CC=C1 SBB054794 [1,1,0,0,0,0|2,0,0]=4 399 B9R1.6 CC(=O)C1=CN=CC=C1 SBB040255 [1,1,0,0,0,0|1,0,1]=4 400 B9R1.6 CC(=O)C1=CN=CC=N1 SBB006738 [1,1,0,0,0,0|0,0,1]=3 401 B9R1.6 CC(=O)C1=NC=CC=C1 SBB058824 [1,1,0,0,0,0|1,0,1]=4 402 B9R1.6 CC(Br)C1=CC=CC=C1 SBB040667 [1,1,0,0,0,0|2,0,0]=4 403 B9R1.6 CC(C)C1=CC=CC=C1 SBB040817 [1,1,0,0,0,0|2,0,0]=4 404 B9R1.6 CC(Cl)C1=CC=CC=C1 SBB007671 [1,1,0,0,0,0|2,0,0]=4 405 B9R1.6 CC(N)C1=CC=CC=C1 SBB040514 [1,1,0,0,0,0|2,0,0]=4 406 B9R1.6 CC(N)C1=CN=CC=C1 SBB027288 [1,1,0,0,0,0|1,0,0]=3 407 B9R1.6 CC(N)C1=NC=CC=C1 SBB018707 [1,1,0,0,0,0|1,0,0]=3 408 B9R1.6 CC(O)C1=CC=CC=C1 SBB058702 [1,1,0,0,0,0|2,0,0]=4 409 B9R1.6 C[C@H](N)C1=CC=CC=C1 SBB051709 [1,1,0,0,0,0|2,0,0]=4 410 B9R1.6 N=C(N)C1=NC=CN=C1 SBB055879 [1,1,0,0,0,0|1,0,1]=4 411 B9R1.6 NC(=O)C1=CN=CC=N1 SBB004276 [1,1,0,0,0,0|1,0,1]=4 412 B9R1.6 NC(=S)C1=CN=CC=N1 SBB028262 [1,1,0,0,0,0|1,0,1]=4 413 B9R1.6 O=C(Cl)C1=CN=CC=N1 SBB010290 [1,1,0,0,0,0|1,0,1]=4 414 B9R1.6 O=C(O)C1=NC=CN=C1 SBB000051 [1,1,0,0,0,0|1,0,1]=4 415 B9R1.8 BrCCC1=CC=CC=C1 SBB059945 [1,1,0,0,0,0|2,0,0]=4 416 B9R1.8 BrCCC1=NC=CC=C1 SBB014931 [1,1,0,0,0,0|1,0,0]=3 417 B9R1.8 CCCC1=CC=CC=C1 SBB061210 [1,1,0,0,0,0|2,0,0]=4 418 B9R1.8 CCNC1=CC=CC=C1 SBB058818 [1,1,0,0,0,0|2,0,0]=4 419 B9R1.8 CNCC1=CC=CC=C1 SBB073015 [1,1,0,0,0,0|2,0,0]=4 420 B9R1.8 CNCC1=CC=CN=C1 SBB052430 [1,1,0,0,0,0|1,0,0]=3 421 B9R1.8 CNCC1=NC=CC=C1 SBB052457 [1,1,0,0,0,0|1,0,0]=3 422 B9R1.8 CNCC1=NC=CN=C1 SBB014431 [1,1,0,0,0,0|0,0,0]=2 423 B9R1.8 COCC1=CC=CC=C1 SBB063549 [1,1,0,0,0,0|2,0,0]=4 424 B9R1.8 ClCCC1=NC=CC=C1 SBB014886 [1,1,0,0,0,0|1,0,0]=3 425 B9R1.8 N#CCC1=CC=CN=C1 SBB027148 [1,1,0,0,0,0|1,0,1]=4 426 B9R1.8 N#CCC1=NC=CC=C1 SBB049639 [1,1,0,0,0,0|1,0,1]=4 427 B9R1.8 NCCC1=CC=CC=C1 SBB058801 [1,1,0,0,0,0|2,0,0]=4 428 B9R1.8 NCCC1=CC=CN=C1 SBB028204 [1,1,0,0,0,0|1,0,0]=3 429 B9R1.8 NCCC1=CC=CN=C1 SBB052465 [1,1,0,0,0,0|1,0,0]=3 430 B9R1.8 NCCC1=NC=CC=C1 SBB028206 [1,1,0,0,0,0|1,0,0]=3 431 B9R1.8 NCCC1=NC=CN=C1 SBB010197 [1,1,0,0,0,0|0,0,0]=2 432 B9R1.8 OCCC1=CC=CC=C1 SBB040879 [1,1,0,0,0,0|2,0,0]=4 433 B9R1.8 SCCC1=NC=CN=C1 SBB067078 [1,1,0,0,0,0|0,0,0]=2 434 B9R1.15 BrCC1=CC=CN=C1Br SBB070876 [1,1,0,0,0,0|2,0,0]=4 435 B9R1.15 CC1=C(CBr)N=CC=C1 SBB021212 [1,1,0,0,0,0|2,0,0]=4 436 B9R1.15 CC1=CC=CN=C1CN SBB052454 [1,1,0,0,0,0|2,0,0]=4 437 B9R1.15 CCC1=C(N)C=CC=C1 SBB040452 [1,1,0,0,0,0|2,0,0]=4 438 B9R1.15 CCC1=CC=CC=C1C SBB061450 [1,1,0,0,0,0|2,0,0]=4 439 B9R1.15 COC1=C(I)N=CC=C1 SBB098345 [1,1,0,0,0,0|2,0,0]=4 440 B9R1.15 COC1=CC=CN=C1Br SBB005633 [1,1,0,0,0,0|2,0,0]=4 441 B9R1.15 COC1=CC=CN=C1N SBB051907 [1,1,0,0,0,0|2,0,0]=4 442 B9R1.15 COC1=CC=CN=C1O SBB046500 [1,1,0,0,0,0|2,0,0]=4 443 B9R1.15 COC1=NC=CN=C1N SBB051948 [1,1,0,0,0,0|1,0,0]=3 444 B9R1.15 CSC1=C(C)N=CC=N1 SBB008573 [1,1,0,0,0,0|1,0,0]=3 445 B9R1.15 CSC1=NC=CC=C1N SBB072554 [1,1,0,0,0,0|2,0,0]=4 446 B9R1.15 N#CC1=NC=CN=C1Cl SBB055887 [1,1,0,0,0,0|1,0,1]=4 447 B9R1.15 NC1=CC=NC=C1CO SBB054791 [1,1,0,0,0,0|2,0,0]=4 448 B9R1.15 NC1=NC=CC=C1CO SBB054786 [1,1,0,0,0,0|2,0,0]=4 449 B9R1.15 OCC1=C(O)C=CC=N1 SBB085588 [1,1,0,0,0,0|2,0,0]=4 450 B9R1.15 OCC1=CC=CN=C1Cl SBB054785 [1,1,0,0,0,0|2,0,0]=4 451 B9R1.69 CC1=CC(C)=C(C)C=C1 SBB060396 [1,1,0,0,0,0|2,0,0]=4 452 B9R1.69 CC1=CC(C)=C(N)C=N1 SBB051865 [1,1,0,0,0,0|2,0,0]=4 453 B9R1.69 CC1=CC(F)=C(C)C=C1 SBB085563 [1,1,0,0,0,0|2,0,0]=4 454 B9R1.69 CC1=CC(O)=C(C)C=C1 SBB060426 [1,1,0,0,0,0|2,0,0]=4 455 B9R1.69 CC1=CC=C(Br)C(N)=N1 SBB005516 [1,1,0,0,0,0|2,0,0]=4 456 B9R1.69 CC1=CC=C(C)C(N)=C1 SBB040497 [1,1,0,0,0,0|2,0,0]=4 457 B9R1.69 CC1=CN=C(Br)C(Cl)=C1 SBB054317 [1,1,0,0,0,0|2,0,0]=4 458 B9R1.69 CC1=CN=C(Cl)C(C)=N1 SBB054473 [1,1,0,0,0,0|1,0,0]=3 459 B9R1.69 CC1=CN=C(F)C(Br)=C1 SBB091032 [1,1,0,0,0,0|2,0,0]=4 460 B9R1.69 CC1=CN=C(F)C(I)=C1 SBB054399 [1,1,0,0,0,0|2,0,0]=4 461 B9R1.69 CC1=CN=C(N)C(Br)=C1 SBB000261 [1,1,0,0,0,0|2,0,0]=4 462 B9R1.69 CC1=CN=C(N)C(Br)=N1 SBB054470 [1,1,0,0,0,0|1,0,0]=3 463 B9R1.69 CC1=CN=C(N)C(Cl)=C1 SBB069949 [1,1,0,0,0,0|2,0,0]=4 464 B9R1.69 CC1=CN=C(O)C(Br)=C1 SBB003679 [1,1,0,0,0,0|2,0,0]=4 465 B9R1.69 CC1=CN=C(O)C(N)=C1 SBB051872 [1,1,0,0,0,0|2,0,0]=4 466 B9R1.69 CC1=NC(C)=C(C)C=C1 SBB061698 [1,1,0,0,0,0|1,0,0]=3 467 B9R1.69 CC1=NC(C)=C(N)C=C1 SBB013931 [1,1,0,0,0,0|2,0,0]=4 468 B9R1.69 CC1=NC(C)=C(O)C=C1 SBB013900 [1,1,0,0,0,0|2,0,0]=4 469 B9R1.69 CC1=NC(Cl)=C(N)C=C1 SBB004142 [1,1,0,0,0,0|2,0,0]=4 470 B9R1.69 CC1=NC=C(Br)C=C1N SBB051825 [1,1,0,0,0,0|2,0,0]=4 471 B9R1.69 CC1=NN=C(N)N=C1C SBB028209 [1,1,0,0,0,0|2,0,0]=4 472 B9R1.69 CC1=NN=C(S)N=C1S SBB079027 [1,1,0,0,0,0|2,0,0]=4 473 B9R1.69 NC1=NC=C(Br)N=C1Br SBB101186 [1,1,0,0,0,0|2,0,0]=4 474 B9R1.69 [NH3+]C1=C(C)C=C(C)N=C1 SBB055666 [1,1,0,0,0,0|2,0,0]=4 475 B9R1.7 CC1=CC(CC#N)=NO1 SBB073573 [0,1,0,0,1,0|1,0,1]=4 476 B9R1.7 CC1=CC=C(CCN)S1 SBB027633 [0,1,0,0,1,0|2,0,0]=4 477 B9R1.7 CC1=CN(CC#N)N=C1 SBB021939 [0,1,0,0,1,0|1,0,1]=4 478 B9R1.7 CC1=CN(CCN)N=C1 SBB021469 [0,1,0,0,1,0|1,0,0]=3 479 B9R1.7 CC1=CN(CCN)N=N1 SBB074232 [0,1,0,0,1,0|2,0,0]=4 480 B9R1.7 CC1=CN(CCO)N=C1 SBB033466 [0,1,0,0,1,0|1,0,0]=3 481 B9R1.7 CC1=CN=C(CCN)S1 SBB027447 [0,1,0,0,1,0|1,0,0]=3 482 B9R1.7 CC1=CSC(CC#N)=N1 SBB022616 [0,1,0,0,1,0|1,0,1]=4 483 B9R1.7 CC1=CSC(CCN)=N1 SBB044025 [0,1,0,0,1,0|1,0,0]=3 484 B9R1.7 CC1=NN(CCBr)C=C1 SBB014949 [0,1,0,0,1,0|2,0,0]=4 485 B9R1.7 CC1=NN(CCN)C=C1 SBB009659 [0,1,0,0,1,0|2,0,0]=4 486 B9R1.7 CC1=NN(CCO)C=C1 SBB033467 [0,1,0,0,1,0|2,0,0]=4 487 B9R1.7 CC1=NNC(CC#N)=N1 SBB002335 [0,1,0,0,1,0|1,0,1]=4 488 B9R1.7 CC1=NOC(CC#N)=C1 SBB073572 [0,1,0,0,1,0|1,0,1]=4 489 B9R1.7 CC1=NOC(CCN)=N1 SBB050221 [0,1,0,0,1,0|1,0,0]=3 490 B9R1.7 CCCC1=CC(N)=NN1 SBB085612 [0,1,0,0,1,0|2,0,0]=4 491 B9R1.7 CCCC1=NNC(N)=N1 SBB042025 [0,1,0,0,1,0|2,0,0]=4 492 B9R1.7 CCCN1C=C(Br)C=N1 SBB303293 [0,1,0,0,1,0|2,0,0]=4 493 B9R1.7 CCCN1C=C(Cl)C=N1 SBB046647 [0,1,0,0,1,0|2,0,0]=4 494 B9R1.7 CCCN1C=C(I)C=N1 SBB073997 [0,1,0,0,1,0|2,0,0]=4 495 B9R1.7 CCCN1C=C(N)C=N1 SBB025685 [0,1,0,0,1,0|2,0,0]=4 496 B9R1.7 CCCN1C=CC(C)=N1 SBB024160 [0,1,0,0,1,0|2,0,0]=4 497 B9R1.7 CCCN1C=NC(N)=N1 SBB010251 [0,1,0,0,1,0|2,0,0]=4 498 B9R1.7 CCSC1=NNC(N)=N1 SBB043688 [0,1,0,0,1,0|2,0,0]=4 499 B9R1.7 CCSC1=NSC(N)=N1 SBB018390 [0,1,0,0,1,0|2,0,0]=4 500 B9R1.7 CN1C=C(CCCl)C=N1 SBB073778 [0,1,0,0,1,0|1,0,0]=3 501 B9R1.7 CN1C=C(CCN)C=N1 SBB073762 [0,1,0,0,1,0|1,0,0]=3 502 B9R1.7 CN1C=C(CCO)C=N1 SBB026809 [0,1,0,0,1,0|1,0,0]=3 503 B9R1.7 CN1C=CC(CCN)=N1 SBB073919 [0,1,0,0,1,0|2,0,0]=4 504 B9R1.7 CN1C=NC(CCN)=C1 SBB003561 [0,1,0,0,1,0|1,0,0]=3 505 B9R1.7 CN1C=NC(CCN)=C1 SBB116842 [0,1,0,0,1,0|1,0,0]=3 506 B9R1.7 CNCC1=CC(C)=NO1 SBB026735 [0,1,0,0,1,0|1,0,0]=3 507 B9R1.7 CNCC1=CC=C(C)O1 SBB085300 [0,1,0,0,1,0|2,0,0]=4 508 B9R1.7 CNCC1=CC=C(C)S1 SBB052471 [0,1,0,0,1,0|2,0,0]=4 509 B9R1.7 CNCC1=CN(C)N=C1 SBB019590 [0,1,0,0,1,0|1,0,0]=3 510 B9R1.7 CNCC1=CSC(C)=N1 SBB086256 [0,1,0,0,1,0|1,0,0]=3 511 B9R1.7 CNCC1=NN(C)C=C1 SBB020588 [0,1,0,0,1,0|2,0,0]=4 512 B9R1.7 CNCC1=NNC(C)=C1 SBB010242 [0,1,0,0,1,0|1,0,0]=3 513 B9R1.7 CNCC1=NOC(C)=C1 SBB026783 [0,1,0,0,1,0|1,0,0]=3 514 B9R1.7 COCC1=NNC(N)=N1 SBB027186 [0,1,0,0,1,0|2,0,0]=4 515 B9R1.7 COCN1C=C(N)C=N1 SBB022063 [0,1,0,0,1,0|2,0,0]=4 516 B9R1.7 N1C(C)=NN=C1OCC SBB059639 [0,1,0,0,1,0|1,0,1]=4 517 B9R1.7 NCCC1=NNC(N)=N1 SBB013221 [0,1,0,0,1,0|2,0,0]=4 518 B9R1.7 NCCN1C=C(Br)C=N1 SBB020912 [0,1,0,0,1,0|2,0,0]=4 519 B9R1.7 NCCN1C=C(Cl)C=N1 SBB020913 [0,1,0,0,1,0|2,0,0]=4 520 B9R1.7 NCCN1C=C(I)C=N1 SBB074290 [0,1,0,0,1,0|2,0,0]=4 521 B9R1.7 OCCN1C=C(Br)C=N1 SBB014946 [0,1,0,0,1,0|2,0,0]=4 522 B9R1.7 OCCN1C=C(Cl)C=N1 SBB022876 [0,1,0,0,1,0|2,0,0]=4 523 B9R1.21 C#CC1=CN(CC)N=C1 SBB116319 [0,1,0,0,1,0|1,0,1]=4 524 B9R1.21 C(=O)C1=CC(CC)=NO1 SBB073356 [0,1,0,0,1,0|1,0,1]=4 525 B9R1.21 C(=O)C1=CN(CC)N=C1 SBB000003 [0,1,0,0,1,0|1,0,1]=4 526 B9R1.21 CCC1=NC(CN)=NO1 SBB047171 [0,1,0,0,1,0|1,0,0]=3 527 B9R1.21 CCC1=NN=C(CCl)O1 SBB018931 [0,1,0,0,1,0|2,0,0]=4 528 B9R1.21 CCC1=NOC(CCl)=C1 SBB026127 [0,1,0,0,1,0|1,0,0]=3 529 B9R1.21 CCC1=NOC(CN)=C1 SBB010250 [0,1,0,0,1,0|1,0,0]=3 530 B9R1.21 CCC1=NOC(CO)=C1 SBB050112 [0,1,0,0,1,0|1,0,0]=3 531 B9R1.21 CCN1C=C(C#N)C=N1 SBB032256 [0,1,0,0,1,0|1,0,1]=4 532 B9R1.21 CCN1C=C(CN)C=N1 SBB018639 [0,1,0,0,1,0|1,0,0]=3 533 B9R1.21 CCN1C=C(CO)C=N1 SBB019664 [0,1,0,0,1,0|1,0,0]=3 534 B9R1.21 CCN1C=CC(CCl)=N1 SBB025730 [0,1,0,0,1,0|2,0,0]=4 535 B9R1.21 CCN1C=CC(CN)=N1 SBB020586 [0,1,0,0,1,0|2,0,0]=4 536 B9R1.21 CCN1C=CC(CO)=N1 SBB025856 [0,1,0,0,1,0|2,0,0]=4 537 B9R1.22 CC1=NC(C)=C(CO)S1 SBB054806 [0,1,0,0,1,0|2,0,0]=4 538 B9R1.22 CC1=NC(CO)=C(C)O1 SBB085678 [0,1,0,0,1,0|2,0,0]=4 539 B9R1.22 CC1=NN(C)C(CCl)=C1 SBB025118 [0,1,0,0,1,0|2,0,0]=4 540 B9R1.22 CC1=NN(C)C(CN)=C1 SBB004264 [0,1,0,0,1,0|2,0,0]=4 541 B9R1.22 CC1=NN(C)C(CO)=C1 SBB024986 [0,1,0,0,1,0|2,0,0]=4 542 B9R1.22 CC1=NN(C)C=C1CN SBB004263 [0,1,0,0,1,0|2,0,0]=4 543 B9R1.22 CC1=NN(C)C=C1CO SBB019670 [0,1,0,0,1,0|2,0,0]=4 544 B9R1.22 CCC1=C(C)SC(N)=N1 SBB085468 [0,1,0,0,1,0|2,0,0]=4 545 B9R1.22 CCN1C=C(C)C=C1N SBB059485 [0,1,0,0,1,0|2,0,0]=4 546 B9R1.22 CCN1N=C(Br)N=C1Br SBB054619 [0,1,0,0,1,0|2,0,0]=4 547 B9R1.22 CCN1N=C(C)C=C1C SBB024588 [0,1,0,0,1,0|2,0,0]=4 548 B9R1.22 CCN1N=C(C)C=C1N SBB022583 [0,1,0,0,1,0|2,0,0]=4 549 B9R1.23 CC1=CC(CN)=NN1C SBB020887 [0,1,0,0,1,0|2,0,0]=4 550 B9R1.23 CC1=CC(CO)=NN1C SBB054817 [0,1,0,0,1,0|2,0,0]=4 551 B9R1.23 CCN1C=C(Br)C(C)=N1 SBB020342 [0,1,0,0,1,0|2,0,0]=4 552 B9R1.23 CCN1C=C(Br)C(N)=N1 SBB022909 [0,1,0,0,1,0|2,0,0]=4 553 B9R1.23 CCN1C=C(C)C(N)=N1 SBB027023 [0,1,0,0,1,0|1,0,0]=3 554 B9R1.23 CCN1C=C(Cl)C(C)=N1 SBB046652 [0,1,0,0,1,0|2,0,0]=4 555 B9R1.23 CCN1C=C(Cl)C(N)=N1 SBB022307 [0,1,0,0,1,0|2,0,0]=4 556 B9R1.23 CCN1C=C(I)C(C)=N1 SBB051459 [0,1,0,0,1,0|2,0,0]=4 557 B9R1.23 CCN1C=C(I)C(N)=N1 SBB074171 [0,1,0,0,1,0|2,0,0]=4 558 B9R1.23 CCN1C=C(N)C(C)=N1 SBB009354 [0,1,0,0,1,0|2,0,0]=4 559 B9R1.35 CC(=O)C1=CC(C)=CS1 SBB066532 [0,1,0,0,1,0|1,0,1]=4 560 B9R1.35 CC(=O)C1=CN(C)N=C1 SBB020594 [0,1,0,0,1,0|1,0,1]=4 561 B9R1.35 CC(=O)C1=CSC(C)=N1 SBB109134 [0,1,0,0,1,0|1,0,1]=4 562 B9R1.35 CC(C)C1=CC(N)=NN1 SBB051943 [0,1,0,0,1,0|2,0,0]=4 563 B9R1.35 CC(C)C1=CSC(N)=N1 SBB044873 [0,1,0,0,1,0|2,0,0]=4 564 B9R1.35 CC(C)C1=NNC(N)=N1 SBB042027 [0,1,0,0,1,0|2,0,0]=4 565 B9R1.35 CC(C)C1=NSC(N)=N1 SBB005493 [0,1,0,0,1,0|2,0,0]=4 566 B9R1.35 CC(C)N1C=C(Br)C=N1 SBB073443 [0,1,0,0,1,0|2,0,0]=4 567 B9R1.35 CC(C)N1C=C(Cl)C=N1 SBB073389 [0,1,0,0,1,0|2,0,0]=4 568 B9R1.35 CC(C)N1C=C(I)C=N1 SBB073996 [0,1,0,0,1,0|2,0,0]=4 569 B9R1.35 CC(C)N1C=C(N)C=N1 SBB026436 [0,1,0,0,1,0|2,0,0]=4 570 B9R1.35 CC(N)C1=CN(C)N=C1 SBB026475 [0,1,0,0,1,0|1,0,0]=3 571 B9R1.35 CC(N)C1=NN(C)C=C1 SBB009481 [0,1,0,0,1,0|2,0,0]=4 572 B9R1.35 CC1=CC(C(F)F)=NN1 SBB021413 [0,1,0,0,1,0|2,0,0]=4 573 B9R1.35 CC1=CC=C(C(C)N)O1 SBB010239 [0,1,0,0,1,0|2,0,0]=4 574 B9R1.35 CC1=NN(C(C)C)C=C1 SBB024815 [0,1,0,0,1,0|2,0,0]=4 575 B9R1.132 CC1=C(C)C(CO)=CS1 SBB017430 [0,1,0,0,1,0|2,0,0]=4 576 B9R1.132 CC1=C(CN)C=NN1C SBB004262 [0,1,0,0,1,0|2,0,0]=4 577 B9R1.132 CC1=C(CO)C=NN1C SBB019663 [0,1,0,0,1,0|2,0,0]=4 578 B9R1.132 CCN1N=CC(Br)=C1C SBB047364 [0,1,0,0,1,0|2,0,0]=4 579 B9R1.132 CCN1N=CC(Br)=C1F SBB116439 [0,1,0,0,1,0|2,0,0]=4 580 B9R1.132 CCN1N=CC(C)=C1N SBB073537 [0,1,0,0,1,0|1,0,0]=3 581 B9R1.132 CCN1N=CC(Cl)=C1C SBB047363 [0,1,0,0,1,0|2,0,0]=4 582 B9R1.132 CCN1N=CC(I)=C1C SBB051460 [0,1,0,0,1,0|2,0,0]=4 583 B9R1.132 CCN1N=CC(I)=C1F SBB116440 [0,1,0,0,1,0|2,0,0]=4 584 B9R1.132 CCN1N=CC(N)=C1C SBB009355 [0,1,0,0,1,0|2,0,0]=4 585 B11R1.1 CC1=CC=C(NCCO)C=C1 SBB010327 [0,2,0,0,0,0|2,0,0]=4 586 B11R1.1 CC1=CC=C(OCCBr)C=C1 SBB018129 [0,2,0,0,0,0|2,0,0]=4 587 B11R1.1 CC1=CC=C(OCCN)C=C1 SBB016458 [0,2,0,0,0,0|2,0,0]=4 588 B11R1.1 CC1=CC=C(SCCN)C=C1 SBB076443 [0,2,0,0,0,0|2,0,0]=4 589 B11R1.1 OCCSC1=CC=C(Cl)C=N1 SBB054333 [0,2,0,0,0,0|2,0,0]=4 590 B11R1.20 CC(=O)NC1=CC=C(C)C=N1 SBB086721 [0,2,0,0,0,0|1,0,1]=4 591 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 SBB056753 [0,2,0,0,0,0|2,0,0]=4 592 B11R1.22 CCC(N)C1=CC=C(C)C=C1 SBB017924 [0,2,0,0,0,0|2,0,0]=4 593 B11R1.22 COC(=O)C1=CC=C(C)N=C1 SBB053798 [0,2,0,0,0,0|1,0,1]=4 594 B11R1.22 COC(=O)C1=NC=C(C)N=C1 SBB053940 [0,2,0,0,0,0|0,0,1]=3 595 B11R1.22 COC(=O)C1=NC=C(Cl)N=C1 SBB053941 [0,2,0,0,0,0|1,0,1]=4 596 B11R1.22 COC(=O)C1=NC=C(O)N=C1 SBB014253 [0,2,0,0,0,0|1,0,1]=4 597 B11R1.81 CCOC1=CC=C(C)C=C1C SBB061026 [0,2,0,0,0,0|2,0,0]=4 598 B11R1.83 CCC1=CC=C(CC#N)C=C1 SBB065173 [0,2,0,0,0,0|2,0,0]=4 599 B11R1.83 CCC1=CN=C(CCO)C=C1 SBB055692 [0,2,0,0,0,0|1,0,0]=3 600 B11R1.83 CCCC1=CC=C(CN)C=C1 SBB059679 [0,2,0,0,0,0|2,0,0]=4 601 B11R1.83 CCCC1=CC=C(OC)C=C1 SBB007737 [0,2,0,0,0,0|2,0,0]=4 602 B11R1.83 CCNC1=CC=C(CC)C=C1 SBB072094 [0,2,0,0,0,0|2,0,0]=4 603 B11R1.83 CCOC1=CC=C(CBr)C=C1 SBB081616 [0,2,0,0,0,0|2,0,0]=4 604 B11R1.83 CCOC1=CC=C(CN)C=C1 SBB017652 [0,2,0,0,0,0|2,0,0]=4 605 B11R1.83 CNCC1=CC=C(OC)C=C1 SBB086791 [0,2,0,0,0,0|2,0,0]=4 606 B11R1.83 COC1=CC=C(CCN)C=C1 SBB058795 [0,2,0,0,0,0|2,0,0]=4 607 B11R1.3 CC(C)C1=CC=C(CCl)C=C1 SBB042664 [0,2,0,0,0,0|2,0,0]=4 608 B11R1.3 CC(C)C1=CC=C(CN)C=C1 SBB017646 [0,2,0,0,0,0|2,0,0]=4 609 B11R1.3 CC(C)C1=CC=C(CO)C=C1 SBB065188 [0,2,0,0,0,0|2,0,0]=4 610 B11R1.3 CCC1=CC=C(C(C)=O)C=C1 SBB040909 [0,2,0,0,0,0|2,0,0]=4 611 B11R1.3 CCC1=CC=C(C(C)N)C=C1 SBB016483 [0,2,0,0,0,0|2,0,0]=4 612 B11R1.3 COC1=CC=C(C(C)N)C=C1 SBB007015 [0,2,0,0,0,0|2,0,0]=4 613 B11R1.19 CC1=CC=C(C(C)(C)N)C=C1 SBB052376 [0,2,0,0,0,0|2,0,0]=4 614 B11R1.19 CC1=CC=C(C(C)(C)O)C=C1 SBB063535 [0,2,0,0,0,0|2,0,0]=4 615 B11R1.21 CC1=C(C)C=C(C(C)N)C=C1 SBB009345 [0,2,0,0,0,0|2,0,0]=4 616 B11R1.21 CC1=C(O)C=C(C(C)C)C=C1 SBB060790 [0,2,0,0,0,0|2,0,0]=4 617 B11R1.166 CC1=CC(C)=C(C(C)N)C=C1 SBB020377 [0,2,0,0,0,0|2,0,0]=4 618 B11R1.166 CC1=CC(O)=C(C(C)C)C=C1 SBB060429 [0,2,0,0,0,0|2,0,0]=4 619 B11R1.37 CC1=CN=C(C#N)C(C#N)=N1 SBB055882 [0,2,0,0,0,0|1,0,1]=4 620 B11R1.37 CCC1=C(CC)N=C(C)C=N1 SBB057797 [0,2,0,0,0,0|0,0,0]=2 621 B9R1.3 CC1=NC=CC(C)=C1N SBB051855 [0,0,1,1,0,0|0,0,2]=4 622 B9R1.3 CC1=NC=CC(C)=C1O SBB055655 [0,0,1,1,0,0|1,0,1]=4 623 B7R1.1 BrCC1=CSC=C1 SBB070721 [1,0,0,0,1,0|2,0,0]=4 624 B7R1.1 BrCC1=CSC=N1 SBB054932 [1,0,0,0,1,0|2,0,0]=4 625 B7R1.1 CCN1C=CC=N1 SBB020346 [1,0,0,0,1,0|1,0,0]=3 626 B7R1.1 CCN1C=CN=C1 SBB045396 [1,0,0,0,1,0|1,0,0]=3 627 B7R1.1 CSC1=CC=CS1 SBB085766 [1,0,0,0,1,0|2,0,0]=4 628 B7R1.1 CSC1=CSC=C1 SBB055747 [1,0,0,0,1,0|2,0,0]=4 629 B7R1.1 ClCC1=CC=NO1 SBB013787 [1,0,0,0,1,0|2,0,0]=4 630 B7R1.1 ClCC1=CSC=N1 SBB054935 [1,0,0,0,1,0|2,0,0]=4 631 B7R1.1 ClCC1=NOC=C1 SBB013648 [1,0,0,0,1,0|2,0,0]=4 632 B7R1.1 ClCC1=NOC=N1 SBB005592 [1,0,0,0,1,0|2,0,0]=4 633 B7R1.1 NCC1=CC=CO1 SBB004376 [1,0,0,0,1,0|2,0,0]=4 634 B7R1.1 NCC1=CC=CS1 SBB004315 [1,0,0,0,1,0|2,0,0]=4 635 B7R1.1 NCC1=CN=CS1 SBB047473 [1,0,0,0,1,0|2,0,0]=4 636 B7R1.1 NCC1=CNN=C1 SBB026489 [1,0,0,0,1,0|2,0,0]=4 637 B7R1.1 NCC1=CSC=C1 SBB079179 [1,0,0,0,1,0|2,0,0]=4 638 B7R1.1 NCC1=CSC=N1 SBB047472 [1,0,0,0,1,0|2,0,0]=4 639 B7R1.1 NCC1=NC=CN1 SBB013485 [1,0,0,0,1,0|1,0,1]=4 640 B7R1.1 NCC1=NC=CN1 SBB052487 [1,0,0,0,1,0|1,0,1]=4 641 B7R1.1 NCC1=NC=CS1 SBB052479 [1,0,0,0,1,0|2,0,0]=4 642 B7R1.1 NCC1=NNC=C1 SBB020888 [1,0,0,0,1,0|2,0,0]=4 643 B7R1.1 NCC1=NOC=N1 SBB052491 [1,0,0,0,1,0|2,0,0]=4 644 B7R1.1 OCC1=CC=CO1 SBB004373 [1,0,0,0,1,0|2,0,0]=4 645 B7R1.1 OCC1=CC=CS1 SBB058563 [1,0,0,0,1,0|2,0,0]=4 646 B7R1.1 OCC1=CC=NN1 SBB014141 [1,0,0,0,1,0|2,0,0]=4 647 B7R1.1 OCC1=CN=CS1 SBB066375 [1,0,0,0,1,0|2,0,0]=4 648 B7R1.1 OCC1=CNC=N1 SBB004207 [1,0,0,0,1,0|1,0,1]=4 649 B7R1.1 OCC1=CNC=N1 SBB054821 [1,0,0,0,1,0|1,0,1]=4 650 B7R1.1 OCC1=CNN=C1 SBB073660 [1,0,0,0,1,0|2,0,0]=4 651 B7R1.1 OCC1=CSC=C1 SBB004309 [1,0,0,0,1,0|2,0,0]=4 652 B7R1.1 OCC1=CSC=N1 SBB066562 [1,0,0,0,1,0|2,0,0]=4 653 B7R1.1 OCC1=NC=CN1 SBB054820 [1,0,0,0,1,0|1,0,1]=4 654 B7R1.1 OCC1=NC=CS1 SBB054805 [1,0,0,0,1,0|2,0,0]=4 655 B7R1.1 SCC1=CC=CO1 SBB004308 [1,0,0,0,1,0|2,0,0]=4 656 B7R1.2 CC1=CC(C)=NN1 SBB004377 [1,0,0,0,1,0|1,0,0]=3 657 B7R1.2 CC1=CC(C)=NO1 SBB042637 [1,0,0,0,1,0|1,0,0]=3 658 B7R1.2 CC1=CC(N)=NO1 SBB005553 [1,0,0,0,1,0|2,0,0]=4 659 B7R1.2 CC1=CC=C(C)N1 SBB059455 [1,0,0,0,1,0|1,0,1]=4 660 B7R1.2 CC1=CN(C)C=N1 SBB073385 [1,0,0,0,1,0|1,0,0]=3 661 B7R1.2 CC1=CN(C)N=C1 SBB073292 [1,0,0,0,1,0|1,0,0]=3 662 B7R1.2 CC1=CN=C(Br)S1 SBB054420 [1,0,0,0,1,0|2,0,0]=4 663 B7R1.2 CC1=CN=C(N)S1 SBB028194 [1,0,0,0,1,0|2,0,0]=4 664 B7R1.2 CC1=CNC(C)=C1 SBB059454 [1,0,0,0,1,0|0,0,1]=3 665 B7R1.2 CC1=COC(N)=N1 SBB051930 [1,0,0,0,1,0|2,0,0]=4 666 B7R1.2 CC1=CSC(Br)=N1 SBB054421 [1,0,0,0,1,0|2,0,0]=4 667 B7R1.2 CC1=CSC(S)=N1 SBB041075 [1,0,0,0,1,0|2,0,0]=4 668 B7R1.2 CC1=NN(C)C=C1 SBB015024 [1,0,0,0,1,0|2,0,0]=4 669 B7R1.2 CC1=NNC(C)=N1 SBB108831 [1,0,0,0,1,0|1,0,0]=3 670 B7R1.2 CC1=NNC(Cl)=N1 SBB019449 [1,0,0,0,1,0|2,0,0]=4 671 B7R1.2 CC1=NNC(N)=C1 SBB004375 [1,0,0,0,1,0|2,0,0]=4 672 B7R1.2 CC1=NNC(N)=N1 SBB013163 [1,0,0,0,1,0|2,0,0]=4 673 B7R1.2 CC1=NOC(N)=C1 SBB006539 [1,0,0,0,1,0|2,0,0]=4 674 B7R1.2 CC1=NSC(N)=C1 SBB004066 [1,0,0,0,1,0|2,0,0]=4 675 B7R1.2 CC1=NSC(N)=N1 SBB005481 [1,0,0,0,1,0|2,0,0]=4 676 B7R1.2 CN1C=C(Br)C=N1 SBB019150 [1,0,0,0,1,0|2,0,0]=4 677 B7R1.2 CN1C=C(Cl)C=N1 SBB047361 [1,0,0,0,1,0|2,0,0]=4 678 B7R1.2 CN1C=C(I)C=N1 SBB027265 [1,0,0,0,1,0|2,0,0]=4 679 B7R1.2 CN1C=C(N)C=N1 SBB009607 [1,0,0,0,1,0|2,0,0]=4 680 B7R1.2 CN1C=NC(N)=N1 SBB073304 [1,0,0,0,1,0|2,0,0]=4 681 B7R1.2 N1C=C(C)N=C1C SBB004378 [1,0,0,0,1,0|0,0,1]=3 682 B7R1.2 N1C=C(C)N=C1S SBB059569 [1,0,0,0,1,0|1,0,1]=4 683 B7R1.2 NC1=NC(C)=CS1 SBB004307 [1,0,0,0,1,0|2,0,0]=4