0 B12R2.1081 BrC1=C2C=CC=CC2=CC=C1 SBB060210 [0,0,0,0,0,0|3,0,0]=3 1 B12R2.1081 BrC1=C2C=CN=CC2=CC=C1 SBB040185 [0,0,0,0,0,0|4,0,0]=4 2 B12R2.1081 BrC1=C2C=NC=CC2=CC=C1 SBB054599 [0,0,0,0,0,0|4,0,0]=4 3 B12R2.1081 BrC1=C2N=CC=CC2=CC=C1 SBB054586 [0,0,0,0,0,0|2,0,0]=2 4 B12R2.1081 BrC1=CC=CC2=NC=CC=C12 SBB093965 [0,0,0,0,0,0|2,0,0]=2 5 B12R2.1081 BrC1=CC=NC2=CC=CC=C12 SBB054590 [0,0,0,0,0,0|4,0,0]=4 6 B12R2.1081 BrC1=CN=CC2=CC=CC=C12 SBB054598 [0,0,0,0,0,0|4,0,0]=4 7 B12R2.1081 CC1=C2C=CC=CC2=CC=C1 SBB060401 [0,0,0,0,0,0|2,0,0]=2 8 B12R2.1081 CC1=C2N=CC=NC2=CC=C1 SBB056024 [0,0,0,0,0,0|0,0,0]=0 9 B12R2.1081 CC1=CC=CC2=C1NCCC2 SBB021213 [0,0,0,0,0,0|1,0,3]=4 10 B12R2.1081 CC1=CC=CC2=CC=CN=C12 SBB080579 [0,0,0,0,0,0|1,0,0]=1 11 B12R2.1081 CC1=CC=CC2=NC=CC=C12 SBB059687 [0,0,0,0,0,0|1,0,0]=1 12 B12R2.1081 CC1=CC=NC2=C1C=CC=C2 SBB058784 [0,0,0,0,0,0|3,0,0]=3 13 B12R2.1081 CC1=NC=CC2=CC=CC=C21 SBB056020 [0,0,0,0,0,0|3,0,0]=3 14 B12R2.1081 C[N+]1=C2C=CC=CC2=CC=C1 SBB061147 [0,0,0,0,0,0|3,0,0]=3 15 B12R2.1081 ClC1=C2C=CC=CC2=CC=C1 SBB060227 [0,0,0,0,0,0|3,0,0]=3 16 B12R2.1081 ClC1=C2C=CC=CC2=NC=C1 SBB017078 [0,0,0,0,0,0|4,0,0]=4 17 B12R2.1081 ClC1=CC=CC2=C1N=CC=C2 SBB059477 [0,0,0,0,0,0|2,0,0]=2 18 B12R2.1081 ClC1=NC=CC2=C1C=CC=C2 SBB059626 [0,0,0,0,0,0|4,0,0]=4 19 B12R2.1081 FC1=CC=CC2=C1C=CC=C2 SBB086490 [0,0,0,0,0,0|3,0,0]=3 20 B12R2.1081 FC1=CC=CC2=C1N=CC=C2 SBB059577 [0,0,0,0,0,0|2,0,0]=2 21 B12R2.1081 NC1=C2C=CC=CC2=CC=C1 SBB040451 [0,0,0,0,0,0|3,0,0]=3 22 B12R2.1081 NC1=C2C=NC=CC2=CC=C1 SBB051999 [0,0,0,0,0,0|4,0,0]=4 23 B12R2.1081 NC1=C2N=CC=CC2=CC=C1 SBB004126 [0,0,0,0,0,0|2,0,0]=2 24 B12R2.1081 NC1=CC=CC2=C1C=CC=N2 SBB010065 [0,0,0,0,0,0|2,0,0]=2 25 B12R2.1081 NC1=CC=CC2=C1C=CN=C2 SBB004127 [0,0,0,0,0,0|4,0,0]=4 26 B12R2.1081 NC1=CC=NC2=C1C=CC=C2 SBB018823 [0,0,0,0,0,0|4,0,0]=4 27 B12R2.1081 NC1=CN=CC2=CC=CC=C12 SBB051995 [0,0,0,0,0,0|4,0,0]=4 28 B12R2.1081 NC1=NC=CC2=C1C=CC=C2 SBB004129 [0,0,0,0,0,0|4,0,0]=4 29 B12R2.1081 NC1=NC=CC2=CC=CN=C21 SBB052104 [0,0,0,0,0,0|3,0,0]=3 30 B12R2.1081 O=C1C=COC2=C1C=CC=C2 SBB086467 [0,0,0,0,0,0|4,0,0]=4 31 B12R2.1081 OC1=C2N=CC=CC2=CC=C1 SBB009097 [0,0,0,0,0,0|2,0,0]=2 32 B12R2.1081 OC1=CC=CC2=C1C=CC=N2 SBB004118 [0,0,0,0,0,0|2,0,0]=2 33 B12R2.1081 OC1=CC=CC2=C1C=NC=C2 SBB086406 [0,0,0,0,0,0|4,0,0]=4 34 B12R2.1081 OC1=CC=CC2=CC=CC=C12 SBB040845 [0,0,0,0,0,0|3,0,0]=3 35 B12R2.1081 OC1=CC=NC2=C1C=CC=C2 SBB086405 [0,0,0,0,0,0|4,0,0]=4 36 B12R2.1081 OC1=NC=CC2=CC=CC=C21 SBB004122 [0,0,0,0,0,0|4,0,0]=4 37 B12R2.1081 SC1=NC=CC2=CC=CC=C21 SBB046002 [0,0,0,0,0,0|4,0,0]=4 38 B12R2.1081 [O-][N+]1=CC=CC2=C1C=CC=C2 SBB058323 [0,0,0,0,0,0|4,0,0]=4 39 B12R2.1081 [S-]C1=CC=CC2=C1N=CC=C2 SBB017114 [0,0,0,0,0,0|2,0,0]=2 40 B11R2.20 C1=CC2=C(C=C1)N=CC=N2 SBB085760 [1,0,0,0,0,0|0,0,0]=1 41 B11R2.20 C1=CC2=C(C=CC=N2)N=C1 SBB059694 [1,0,0,0,0,0|2,0,0]=3 42 B11R2.20 C1=CC2=CC=NC=C2C=C1 SBB060380 [1,0,0,0,0,0|3,0,0]=4 43 B11R2.20 C1=CC2=CN=CC=C2N=C1 SBB056301 [1,0,0,0,0,0|2,0,0]=3 44 B11R2.20 C1=CC2=CN=CN=C2C=C1 SBB085761 [1,0,0,0,0,0|2,0,0]=3 45 B11R2.20 C1=CC2=NC=CN=C2N=C1 SBB056351 [1,0,0,0,0,0|1,0,0]=2 46 B11R2.20 C1=CN=C2C=CC=CC2=C1 SBB060379 [1,0,0,0,0,0|1,0,0]=2 47 B13R2.32 CC1=C(N)C2=CC=CN=C2C=C1 SBB027255 [0,1,0,0,0,0|2,0,0]=3 48 B13R2.32 CC1=CC=C2C=CC=NC2=C1N SBB041662 [0,1,0,0,0,0|2,0,0]=3 49 B13R2.32 CN1C(=O)C=CC2=C1C=CC=C2 SBB087359 [0,1,0,0,0,0|3,0,0]=4 50 B13R2.32 NC1=C(O)C=CC2=C1C=CC=C2 SBB000347 [0,1,0,0,0,0|3,0,0]=4 51 B13R2.32 NC1=C2C=CC=CC2=CC=C1O SBB013739 [0,1,0,0,0,0|3,0,0]=4 52 B13R2.32 NC1=CC=C2N=CC=NC2=C1Br SBB054605 [0,1,0,0,0,0|1,0,0]=2 53 B13R2.32 O=C1C=CC2=C(C=CC=C2)C1=O SBB069545 [0,1,0,0,0,0|3,0,0]=4 54 B13R2.32 OC1=C(Br)C2=CC=CC=C2C=C1 SBB080000 [0,1,0,0,0,0|3,0,0]=4 55 B13R2.32 OC1=C(I)C2=CC=CC=C2C=C1 SBB054689 [0,1,0,0,0,0|3,0,0]=4 56 B13R2.162 CC1=CC2=C(C=C1)N=CC=C2C SBB006296 [0,1,0,0,0,0|3,0,0]=4 57 B13R2.162 CC1=CC2=C(C=CC=C2N)N=N1 SBB027652 [0,1,0,0,0,0|3,0,0]=4 58 B13R2.162 CC1=CC=C2C=CC=C(C)C2=N1 SBB087220 [0,1,0,0,0,0|1,0,0]=2 59 B13R2.162 CC1=CC=C2C=CC=C(N)C2=N1 SBB010401 [0,1,0,0,0,0|2,0,0]=3 60 B13R2.162 CC1=NC2=C(Cl)C=CC=C2C=C1 SBB089338 [0,1,0,0,0,0|2,0,0]=3 61 B13R2.162 CC1=NC2=C(O)C=CC=C2C=C1 SBB009099 [0,1,0,0,0,0|2,0,0]=3 62 B13R2.162 NC1=CC=C2C=CC=C(O)C2=N1 SBB003966 [0,1,0,0,0,0|2,0,0]=3 63 B13R2.162 O=C1C=CC2=CC=CC(O)=C2N1 SBB071886 [0,1,0,0,0,0|2,0,1]=4 64 B13R2.162 OC1=C2N=C(Cl)C=CC2=CC=C1 SBB037864 [0,1,0,0,0,0|2,0,0]=3 65 B13R2.162 OC1=CC=C2C=CC=C(Br)C2=C1 SBB054650 [0,1,0,0,0,0|3,0,0]=4 66 B13R2.328 CC1=CC(=O)OC2=C1C=CC=C2 SBB062701 [0,1,0,0,0,0|3,0,0]=4 67 B13R2.328 CC1=CC(=S)NC2=C1C=CC=C2 SBB038631 [0,1,0,0,0,0|3,0,0]=4 68 B13R2.328 CC1=CC(Cl)=NC2=CC=CC=C12 SBB015248 [0,1,0,0,0,0|3,0,0]=4 69 B13R2.328 CC1=CC(N)=C2N=CC=CC2=C1 SBB010403 [0,1,0,0,0,0|2,0,0]=3 70 B13R2.328 NC1=CC(Br)=CC2=CC=CN=C12 SBB000618 [0,1,0,0,0,0|2,0,0]=3 71 B13R2.328 NC1=CC(Cl)=CC2=C1N=CC=C2 SBB015010 [0,1,0,0,0,0|2,0,0]=3 72 B13R2.328 O=C1C=C(O)NC2=C1C=CC=N2 SBB087588 [0,1,0,0,0,0|3,0,0]=4 73 B13R2.328 O=C1NC(=O)C2=C(N=CC=N2)N1 SBB003916 [0,1,0,0,0,0|3,0,0]=4 74 B13R2.328 OC1=CC(C)=C2C=CC=CC2=N1 SBB003978 [0,1,0,0,0,0|3,0,0]=4 75 B13R2.342 CC1=C2N=CC=C(Cl)C2=CC=C1 SBB079128 [0,1,0,0,0,0|1,0,0]=2 76 B13R2.342 CC1=C2N=CC=C(N)C2=CC=C1 SBB015019 [0,1,0,0,0,0|1,0,0]=2 77 B13R2.342 ClC1=CC=NC2=C(Cl)C=CC=C12 SBB018952 [0,1,0,0,0,0|2,0,0]=3 78 B13R2.342 FC1=C2N=CC=C(Cl)C2=CC=C1 SBB019319 [0,1,0,0,0,0|2,0,0]=3 79 B13R2.342 NC1=C2C=CC=C(Br)C2=NC=C1 SBB051502 [0,1,0,0,0,0|2,0,0]=3 80 B13R2.342 NC1=CC=CC2=C(N)C=CC=C12 SBB056788 [0,1,0,0,0,0|3,0,0]=4 81 B13R2.342 NC1=CC=CC2=C(O)C=CC=C12 SBB056892 [0,1,0,0,0,0|3,0,0]=4 82 B13R2.342 NC1=CC=NC2=C(Cl)C=CC=C12 SBB015020 [0,1,0,0,0,0|2,0,0]=3 83 B13R2.342 NC1=CC=NC2=C(F)C=CC=C12 SBB018955 [0,1,0,0,0,0|2,0,0]=3 84 B13R2.342 O=C1C=CNC2=C(Cl)C=CC=C12 SBB018777 [0,1,0,0,0,0|2,0,1]=4 85 B13R2.342 OC1=CC=CC2=C(O)C=CC=C12 SBB059460 [0,1,0,0,0,0|3,0,0]=4 86 B13R2.342 OC1=CC=NC2=C(Cl)C=CC=C12 SBB019040 [0,1,0,0,0,0|2,0,0]=3 87 B13R2.342 OC1=CC=NC2=C(F)C=CC=C12 SBB018954 [0,1,0,0,0,0|2,0,0]=3 88 B13R2.371 CC1=C2N=CC=CC2=C(N)C=C1 SBB027954 [0,1,0,0,0,0|1,0,0]=2 89 B13R2.371 FC1=CC=C(Br)C2=CC=CC=C12 SBB096776 [0,1,0,0,0,0|3,0,0]=4 90 B13R2.371 NC1=C2C=CC=NC2=C(O)C=C1 SBB005680 [0,1,0,0,0,0|2,0,0]=3 91 B13R2.371 NC1=CC=C(Br)C2=CC=CN=C12 SBB001595 [0,1,0,0,0,0|2,0,0]=3 92 B13R2.371 NC1=CC=C(Cl)C2=C1C=CC=C2 SBB003769 [0,1,0,0,0,0|3,0,0]=4 93 B13R2.371 NC1=CC=C(O)C2=C1C=CC=C2 SBB000349 [0,1,0,0,0,0|3,0,0]=4 94 B13R2.371 NC1=CC=C(O)C2=C1C=CC=N2 SBB000357 [0,1,0,0,0,0|2,0,0]=3 95 B13R2.371 NC1=CC=C(O)C2=CC=CC=C12 SBB050391 [0,1,0,0,0,0|3,0,0]=4 96 B13R2.371 O=C1C=CC(=O)C2=CC=CC=C12 SBB058659 [0,1,0,0,0,0|3,0,0]=4 97 B13R2.371 OC1=C2N=CC=CC2=C(Br)C=C1 SBB072390 [0,1,0,0,0,0|2,0,0]=3 98 B13R2.371 OC1=NN=C(O)C2=NC=CN=C12 SBB012793 [0,1,0,0,0,0|3,0,0]=4 99 B13R2.1613 CCC1=C2C=CC=CC2=CC=C1 SBB061448 [0,1,0,0,0,0|2,0,0]=3 100 B13R2.1613 COC1=C2C=CC=CC2=CC=C1 SBB057507 [0,1,0,0,0,0|2,0,0]=3 101 B13R2.1613 ClCC1=CC=CC2=C1C=CC=C2 SBB040680 [0,1,0,0,0,0|2,0,0]=3 102 B13R2.1613 N#CC1=CC=CC2=C1C=CC=C2 SBB058903 [0,1,0,0,0,0|2,0,1]=4 103 B13R2.1613 NCC1=C2C=CC=CC2=CC=C1 SBB028328 [0,1,0,0,0,0|2,0,0]=3 104 B13R2.1613 NCC1=CC=CC2=C1C=CC=N2 SBB025620 [0,1,0,0,0,0|1,0,0]=2 105 B13R2.1613 NCC1=CC=CC2=C1C=CN=C2 SBB025624 [0,1,0,0,0,0|3,0,0]=4 106 B13R2.1613 NCC1=NC=CC2=CC=CC=C21 SBB013367 [0,1,0,0,0,0|3,0,0]=4 107 B13R2.1613 NNC1=CC=CC2=C1C=CC=N2 SBB013763 [0,1,0,0,0,0|2,0,0]=3 108 B13R2.1613 NNC1=CC=CC2=C1N=CC=C2 SBB097877 [0,1,0,0,0,0|2,0,0]=3 109 B13R2.1613 NNC1=CC=CC2=CC=CN=C21 SBB018548 [0,1,0,0,0,0|2,0,0]=3 110 B13R2.1613 O=CC1=C2C=CC=NC2=CC=C1 SBB027271 [0,1,0,0,0,0|1,0,1]=3 111 B13R2.1613 O=CC1=C2N=CC=CC2=CC=C1 SBB010129 [0,1,0,0,0,0|1,0,1]=3 112 B13R2.1613 O=CC1=CC=CC2=C1C=CC=C2 SBB040200 [0,1,0,0,0,0|2,0,1]=4 113 B13R2.1613 OCC1=CC=CC2=C1C=CC=C2 SBB067167 [0,1,0,0,0,0|2,0,0]=3 114 B13R2.4818 NC1=CC=CC2=CC=CC(N)=C12 SBB057082 [0,1,0,0,0,0|3,0,0]=4 115 B13R2.4818 NC1=NC=NC2=C1C(F)=CC=C2 SBB070099 [0,1,0,0,0,0|3,0,0]=4 116 B13R2.4818 OC1=NC=NC2=CC=CC(F)=C21 SBB087769 [0,1,0,0,0,0|3,0,0]=4 117 B13R2.4818 [O-][N+]1=CC=CC2=CC=CC(O)=C21 SBB056011 [0,1,0,0,0,0|2,0,1]=4 118 B13R2.5179 OC1=CC2=CC=CC(O)=C2C=C1 SBB060481 [0,1,0,0,0,0|3,0,0]=4 119 B11R1.13 CC1=C(C)C(N=C=O)=CC=C1 SBB048844 [0,0,1,0,0,0|2,0,1]=4 120 B11R1.13 CC1=C(C)C(N=C=S)=CC=C1 SBB017402 [0,0,1,0,0,0|2,0,1]=4 121 B11R1.17 C=CCOC1=C(C)C=CC=C1 SBB008365 [0,0,1,0,0,0|2,0,1]=4 122 B11R1.53 CCC1=NC=CN=C1C(C)=O SBB067086 [0,0,1,0,0,0|1,0,2]=4 123 B11R1.605 C(=O)NC1=C(C)C=CC=C1C SBB008213 [0,0,1,0,0,0|2,0,1]=4 124 B11R1.605 C(=O)NC1=C(C)C=CC=C1Cl SBB003862 [0,0,1,0,0,0|2,0,1]=4 125 B11R1.605 CC1=CC=CC(C)=C1N=C=O SBB048882 [0,0,1,0,0,0|2,0,1]=4 126 B11R1.605 CC1=CC=CC(C)=C1N=C=S SBB087724 [0,0,1,0,0,0|2,0,1]=4 127 B11R2.1 BrC1=CNC2=NC=CC=C12 SBB054700 [0,0,0,0,1,0|3,0,0]=4 128 B11R2.1 CC1=CNC2=CC=CC=C12 SBB055975 [0,0,0,0,1,0|3,0,0]=4 129 B11R2.1 CC1=CSC2=CC=CC=C12 SBB086600 [0,0,0,0,1,0|3,0,0]=4 130 B11R2.1 CC1CCC2=NC=CN=C21 SBB057575 [0,0,0,0,1,0|0,0,3]=4 131 B11R2.1 N1N=C(C)C2=CC=CN=C21 SBB085837 [0,0,0,0,1,0|3,0,0]=4 132 B11R2.1 NC1=CNC2=NC=CC=C12 SBB106824 [0,0,0,0,1,0|3,0,0]=4 133 B11R2.1 NC1=CSC2=C1C=CC=N2 SBB086727 [0,0,0,0,1,0|3,0,0]=4 134 B11R2.106 BrC1=C2C=CNC2=CC=C1 SBB054556 [0,0,0,0,1,0|1,0,1]=3 135 B11R2.106 BrC1=C2NC=CC2=CC=C1 SBB054562 [0,0,0,0,1,0|1,0,1]=3 136 B11R2.106 BrC1=CC=CC2=C1C=NN2 SBB054645 [0,0,0,0,1,0|2,0,1]=4 137 B11R2.106 BrC1=CC=CC2=C1OC=C2 SBB092095 [0,0,0,0,1,0|2,0,0]=3 138 B11R2.106 BrC1=CC=CC2=NC=CN12 SBB092099 [0,0,0,0,1,0|2,0,0]=3 139 B11R2.106 BrC1=CC=CC2=NSN=C12 SBB040065 [0,0,0,0,1,0|2,0,0]=3 140 B11R2.106 BrC1=CC=NC2=C1C=CN2 SBB054657 [0,0,0,0,1,0|2,0,1]=4 141 B11R2.106 BrC1=CN=CC2=NC=CN12 SBB054694 [0,0,0,0,1,0|3,0,0]=4 142 B11R2.106 CC1=C2NC=CC2=CC=C1 SBB055973 [0,0,0,0,1,0|0,0,1]=2 143 B11R2.106 CC1=CC=CC2=C1C=CN2 SBB048040 [0,0,0,0,1,0|0,0,1]=2 144 B11R2.106 ClC1=C2C=NNC2=CC=C1 SBB054691 [0,0,0,0,1,0|2,0,1]=4 145 B11R2.106 ClC1=C2NC=CC2=CC=N1 SBB054682 [0,0,0,0,1,0|2,0,1]=4 146 B11R2.106 ClC1=C2NN=CC2=CC=C1 SBB054730 [0,0,0,0,1,0|2,0,1]=4 147 B11R2.106 ClC1=CC=CC2=C1NN=N2 SBB074313 [0,0,0,0,1,0|2,0,1]=4 148 B11R2.106 ClC1=NC=CC2=C1C=CO2 SBB054668 [0,0,0,0,1,0|3,0,0]=4 149 B11R2.106 ClC1=NC=CC2=C1C=CS2 SBB054672 [0,0,0,0,1,0|3,0,0]=4 150 B11R2.106 FC1=C2C=CNC2=CC=C1 SBB054560 [0,0,0,0,1,0|1,0,1]=3 151 B11R2.106 FC1=C2NC=CC2=CC=C1 SBB054566 [0,0,0,0,1,0|1,0,1]=3 152 B11R2.106 N1C=CC2=C(Cl)C=CN=C21 SBB086870 [0,0,0,0,1,0|2,0,1]=4 153 B11R2.106 N1C=CC2=C1C(Cl)=CC=C2 SBB004058 [0,0,0,0,1,0|1,0,1]=3 154 B11R2.106 N1C=CC2=C1C=CC=C2Cl SBB004057 [0,0,0,0,1,0|1,0,1]=3 155 B11R2.106 N1N=CC2=C1C(Br)=CC=C2 SBB092096 [0,0,0,0,1,0|2,0,1]=4 156 B11R2.106 NC1=C2C=CNC2=CC=C1 SBB051981 [0,0,0,0,1,0|1,0,1]=3 157 B11R2.106 NC1=C2N=CNC2=CC=C1 SBB002544 [0,0,0,0,1,0|1,0,1]=3 158 B11R2.106 NC1=C2N=COC2=CC=C1 SBB051991 [0,0,0,0,1,0|2,0,0]=3 159 B11R2.106 NC1=C2OC=CC2=CC=C1 SBB074372 [0,0,0,0,1,0|2,0,0]=3 160 B11R2.106 NC1=CC=CC2=C1N=NN2 SBB013566 [0,0,0,0,1,0|2,0,1]=4 161 B11R2.106 NC1=CC=CC2=C1NC=C2 SBB069862 [0,0,0,0,1,0|1,0,1]=3 162 B11R2.106 NC1=CC=CC2=C1NN=C2 SBB002545 [0,0,0,0,1,0|2,0,1]=4 163 B11R2.106 NC1=CC=CC2=NON=C12 SBB005651 [0,0,0,0,1,0|2,0,0]=3 164 B11R2.106 NC1=CC=CC2=NSN=C12 SBB028306 [0,0,0,0,1,0|2,0,0]=3 165 B11R2.106 NC1=CC=CN2C=CN=C12 SBB052098 [0,0,0,0,1,0|2,0,0]=3 166 B11R2.106 NC1=CC=CN2C=NN=C12 SBB072104 [0,0,0,0,1,0|3,0,0]=4 167 B11R2.106 NC1=CC=CN2N=NN=C12 SBB050963 [0,0,0,0,1,0|3,0,0]=4 168 B11R2.106 NC1=CC=NC2=NC=NN12 SBB052107 [0,0,0,0,1,0|3,0,0]=4 169 B11R2.106 O=C1NC=CC2=C1C=CO2 SBB056369 [0,0,0,0,1,0|3,0,0]=4 170 B11R2.106 OC1=C2C=CNC2=CC=C1 SBB055976 [0,0,0,0,1,0|1,0,1]=3 171 B11R2.106 OC1=CC=CC2=NSN=C12 SBB014184 [0,0,0,0,1,0|2,0,0]=3 172 B11R2.106 OC1=CC=NC2=C1SC=C2 SBB071463 [0,0,0,0,1,0|3,0,0]=4 173 B11R2.106 [O-][N+]1=C2NC=CC2=CC=C1 SBB085857 [0,0,0,0,1,0|2,0,1]=4 174 B10R1.2 CC1=C(C)C(C=O)=CC=C1 SBB060150 [1,0,1,0,0,0|2,0,0]=4 175 B10R1.2 CC1=C(C)C(C=O)=CC=C1 SBB062996 [1,0,1,0,0,0|2,0,0]=4 176 B10R1.2 CC1=C(F)C(C=O)=CC=C1 SBB064504 [1,0,1,0,0,0|2,0,0]=4 177 B10R1.2 CC1=C(O)C(C=O)=CC=C1 SBB068759 [1,0,1,0,0,0|2,0,0]=4 178 B10R1.4 C=CCC1=CC=CC=C1O SBB044905 [1,0,1,0,0,0|2,0,0]=4 179 B10R1.4 CC1=C(N=C=S)C=CC=C1 SBB006592 [1,0,1,0,0,0|1,0,1]=4 180 B10R1.4 C\C=C\C1=C(O)C=CC=C1 SBB071429 [1,0,1,0,0,0|2,0,0]=4 181 B10R1.10 CC1=CC(N=C=O)=CC=C1 SBB064239 [1,0,1,0,0,0|1,0,1]=4 182 B10R1.17 O=C\C=C\C1=CC=CC=C1 SBB028652 [1,0,1,0,0,0|2,0,0]=4 183 B10R1.61 CC(=O)C1=C(C)N=CC=N1 SBB005785 [1,0,1,0,0,0|1,0,1]=4 184 B10R1.245 C=CC1=C(F)C=CC=C1F SBB086132 [1,0,1,0,0,0|2,0,0]=4 185 B10R1.245 CC1=CC=CC(F)=C1C=O SBB086001 [1,0,1,0,0,0|2,0,0]=4 186 B12R1.121 COC1=CC=CC=C1\C=C\C=O SBB040240 [0,1,1,0,0,0|2,0,0]=4 187 B12R1.125 CC1=CC=CC=C1\C=C\C(=O)O SBB003946 [0,1,1,0,0,0|2,0,0]=4 188 B12R1.226 CC1=CC(\C=C\C(=O)O)=CC=C1 SBB006620 [0,1,1,0,0,0|2,0,0]=4 189 B12R2.24 BrC1=CC2=C(C=C1)N=CC=C2 SBB001559 [1,1,0,0,0,0|1,0,0]=3 190 B12R2.24 BrC1=CC2=C(C=CC=C2)N=C1 SBB059386 [1,1,0,0,0,0|1,0,0]=3 191 B12R2.24 BrC1=CC2=NC=CN=C2C=C1 SBB054603 [1,1,0,0,0,0|0,0,0]=2 192 B12R2.24 BrC1=CC2=NC=CN=C2N=C1 SBB054638 [1,1,0,0,0,0|1,0,0]=3 193 B12R2.24 BrC1=CC=C2C=CC=CC2=N1 SBB093967 [1,1,0,0,0,0|1,0,0]=3 194 B12R2.24 CC1=CC2=C(C=C1)N=CC=C2 SBB059125 [1,1,0,0,0,0|1,0,0]=3 195 B12R2.24 CC1=CC2=C(C=CC=N2)C=C1 SBB059301 [1,1,0,0,0,0|1,0,0]=3 196 B12R2.24 CC1=CC=C2C=CC=CC2=C1 SBB060085 [1,1,0,0,0,0|2,0,0]=4 197 B12R2.24 CC1=CC=C2N=CC=NC2=C1 SBB086354 [1,1,0,0,0,0|0,0,0]=2 198 B12R2.24 CC1=NC2=C(C=CC=C2)C=C1 SBB008939 [1,1,0,0,0,0|1,0,0]=3 199 B12R2.24 CC1=NC2=NC=CC=C2C=C1 SBB042157 [1,1,0,0,0,0|2,0,0]=4 200 B12R2.24 ClC1=CC=C2C=CC=CC2=N1 SBB056975 [1,1,0,0,0,0|1,0,0]=3 201 B12R2.24 ClC1=NC2=CC=CC=C2N=C1 SBB054606 [1,1,0,0,0,0|0,0,0]=2 202 B12R2.24 ClC1=NC2=NC=CC=C2C=C1 SBB081928 [1,1,0,0,0,0|2,0,0]=4 203 B12R2.24 FC1=CC2=C(C=C1)N=CC=C2 SBB086530 [1,1,0,0,0,0|1,0,0]=3 204 B12R2.24 FC1=CC2=C(C=C1)N=CC=N2 SBB086576 [1,1,0,0,0,0|0,0,0]=2 205 B12R2.24 FC1=CC2=C(C=CC=C2)C=C1 SBB086491 [1,1,0,0,0,0|2,0,0]=4 206 B12R2.24 IC1=CC=C2N=CC=CC2=C1 SBB054593 [1,1,0,0,0,0|1,0,0]=3 207 B12R2.24 NC1=CC2=C(C=C1)N=CC=C2 SBB008124 [1,1,0,0,0,0|1,0,0]=3 208 B12R2.24 NC1=CC2=C(C=C1)N=CC=N2 SBB013496 [1,1,0,0,0,0|0,0,0]=2 209 B12R2.24 NC1=CC2=C(C=CC=C2)N=C1 SBB004125 [1,1,0,0,0,0|1,0,0]=3 210 B12R2.24 NC1=CC2=C(C=CC=C2)N=C1 SBB004128 [1,1,0,0,0,0|1,0,0]=3 211 B12R2.24 NC1=CC=C2C=CC=CC2=C1 SBB057506 [1,1,0,0,0,0|2,0,0]=4 212 B12R2.24 NC1=CC=C2N=CC=CC2=C1 SBB004130 [1,1,0,0,0,0|1,0,0]=3 213 B12R2.24 NC1=NC2=C(C=C1)N=CC=C2 SBB086414 [1,1,0,0,0,0|2,0,0]=4 214 B12R2.24 NC1=NC2=CC=CC=C2C=C1 SBB051994 [1,1,0,0,0,0|1,0,0]=3 215 B12R2.24 NC1=NC2=NC=CC=C2C=C1 SBB081929 [1,1,0,0,0,0|2,0,0]=4 216 B12R2.24 NC1=NC2=NC=CN=C2C=C1 SBB069995 [1,1,0,0,0,0|1,0,0]=3 217 B12R2.24 O=C1C=CC2=C(C=CC=C2)O1 SBB000094 [1,1,0,0,0,0|2,0,0]=4 218 B12R2.24 O=C1C=CC2=CC=CC=C2N1 SBB004119 [1,1,0,0,0,0|1,0,1]=4 219 B12R2.24 OC1=CC2=C(C=CC=C2)N=C1 SBB059635 [1,1,0,0,0,0|1,0,0]=3 220 B12R2.24 OC1=CC2=CC=CC=C2C=C1 SBB040896 [1,1,0,0,0,0|2,0,0]=4 221 B12R2.24 OC1=CC=C2N=CC=CC2=C1 SBB004117 [1,1,0,0,0,0|1,0,0]=3 222 B12R2.24 OC1=NC2=CC=CC=C2N=C1 SBB056025 [1,1,0,0,0,0|0,0,0]=2 223 B12R2.24 OC1=NC2=NC=CC=C2C=C1 SBB081927 [1,1,0,0,0,0|2,0,0]=4 224 B12R2.24 SC1=CC2=C(C=CC=C2)C=C1 SBB059269 [1,1,0,0,0,0|2,0,0]=4 225 B12R2.24 SC1=CN=C2C=CC=CC2=N1 SBB059750 [1,1,0,0,0,0|0,0,0]=2 226 B12R2.2028 O=C1OC(=O)C2=NC=CN=C12 SBB013291 [0,1,0,0,1,0|2,0,0]=4 227 B12R2.82 CC1=C(N)C2=C(C=C1)NC=N2 SBB018513 [0,1,0,0,1,0|1,0,1]=4 228 B12R2.82 CC1=C(N)C2=NSN=C2C=C1 SBB017959 [0,1,0,0,1,0|2,0,0]=4 229 B12R2.82 NC1=C(Cl)C=CC2=NSN=C21 SBB050386 [0,1,0,0,1,0|2,0,0]=4 230 B12R2.82 NC1=C(N)C2=NON=C2C=C1 SBB014864 [0,1,0,0,1,0|2,0,0]=4 231 B12R2.82 NC1=C(O)C=CC2=NSN=C21 SBB300095 [0,1,0,0,1,0|2,0,0]=4 232 B12R2.202 CC1=C2N=C(S)NC2=CC=C1 SBB046525 [0,1,0,0,1,0|0,0,1]=3 233 B12R2.202 CC1=CC2=C(O1)C(N)=CC=C2 SBB010312 [0,1,0,0,1,0|2,0,0]=4 234 B12R2.202 CC1=CC=CC2=C1N=C(N)S2 SBB028351 [0,1,0,0,1,0|1,0,0]=3 235 B12R2.202 CC1=NC2=C(C=CC=C2N)N1 SBB013180 [0,1,0,0,1,0|1,0,1]=4 236 B12R2.202 CC1=NN2C=CC=C(N)C2=N1 SBB072093 [0,1,0,0,1,0|2,0,0]=4 237 B12R2.202 CN1N=C2C=CC=C(N)C2=N1 SBB073711 [0,1,0,0,1,0|2,0,0]=4 238 B12R2.202 NC1=NC2=C(Br)C=CC=C2S1 SBB027128 [0,1,0,0,1,0|2,0,0]=4 239 B12R2.202 NC1=NC2=C(C=CC=C2Cl)S1 SBB000250 [0,1,0,0,1,0|2,0,0]=4 240 B12R2.202 NC1=NC2=C(C=CC=C2Cl)S1 SBB057980 [0,1,0,0,1,0|2,0,0]=4 241 B12R2.202 NC1=NC2=CC=CC(Cl)=C2O1 SBB072543 [0,1,0,0,1,0|2,0,0]=4 242 B12R2.202 NC1=NC2=CC=CC(Cl)=C2S1 SBB018578 [0,1,0,0,1,0|2,0,0]=4 243 B12R2.202 SC1=NC2=C(O1)C(Cl)=CC=C2 SBB015052 [0,1,0,0,1,0|2,0,0]=4 244 B12R2.221 FC1=C2C=CNC2=C(Br)C=C1 SBB094888 [0,1,0,0,1,0|1,0,1]=4 245 B12R2.221 FC1=CC=C(Br)C2=C1NC=C2 SBB094885 [0,1,0,0,1,0|1,0,1]=4 246 B12R2.246 CC1=C2NN=CC2=CC(Br)=C1 SBB002553 [0,1,0,0,1,0|1,0,1]=4 247 B12R2.246 CC1=C2NN=CC2=CC(N)=C1 SBB002520 [0,1,0,0,1,0|1,0,1]=4 248 B12R2.246 CC1=CC(C)=NC2=CC=NN12 SBB026650 [0,1,0,0,1,0|2,0,0]=4 249 B12R2.246 CC1=CC(C)=NC2=NC=NN12 SBB032978 [0,1,0,0,1,0|2,0,0]=4 250 B12R2.246 CC1=CC(O)=NC2=CC=NN12 SBB023767 [0,1,0,0,1,0|2,0,0]=4 251 B12R2.246 CC1=CC2=NC=NN2C(O)=C1 SBB059274 [0,1,0,0,1,0|2,0,0]=4 252 B12R2.246 FC1=CC(Br)=C2NC=CC2=C1 SBB094889 [0,1,0,0,1,0|1,0,1]=4 253 B12R2.246 FC1=CC2=C(C=CN2)C(F)=C1 SBB086885 [0,1,0,0,1,0|1,0,1]=4 254 B12R2.246 NC1=C2NC=CC2=CC(Br)=C1 SBB094449 [0,1,0,0,1,0|1,0,1]=4 255 B12R2.315 BrCC1=CC=CC2=NSN=C12 SBB079174 [0,1,0,0,1,0|1,0,0]=3 256 B12R2.315 CCC1=C2NC=CC2=CC=C1 SBB007573 [0,1,0,0,1,0|0,0,1]=3 257 B12R2.315 COC1=C2C=CNC2=CC=C1 SBB055969 [0,1,0,0,1,0|0,0,1]=3 258 B12R2.315 COC1=C2NC=CC2=CC=C1 SBB055971 [0,1,0,0,1,0|0,0,1]=3 259 B12R2.315 COC1=C2NC=CC2=CC=N1 SBB056382 [0,1,0,0,1,0|1,0,1]=4 260 B12R2.315 N#CC1=CC=CC2=C1C=CN2 SBB018741 [0,1,0,0,1,0|0,0,2]=4 261 B12R2.315 N#CC1=CC=CC2=C1NC=C2 SBB066719 [0,1,0,0,1,0|0,0,2]=4 262 B12R2.315 NCC1=C2C=CNC2=CC=C1 SBB108728 [0,1,0,0,1,0|0,0,1]=3 263 B12R2.315 O=CC1=CC=CC2=C1C=CN2 SBB014557 [0,1,0,0,1,0|0,0,2]=4 264 B12R2.315 O=CC1=CC=CC2=C1NC=C2 SBB066621 [0,1,0,0,1,0|0,0,2]=4 265 B12R2.315 O=CC1=CC=CC2=NSN=C12 SBB087797 [0,1,0,0,1,0|1,0,1]=4 266 B12R2.315 OCC1=CC=CC2=C1C=CN2 SBB018599 [0,1,0,0,1,0|0,0,1]=3 267 B14R2.7724 NC1=CC(Cl)=C2C=CC=NC2=C1O SBB013138 [0,2,0,0,0,0|2,0,0]=4 268 B14R2.7724 OC1=C(Br)C=C(Br)C2=CC=CN=C21 SBB058002 [0,2,0,0,0,0|2,0,0]=4 269 B14R2.7724 OC1=C(I)C=C(Cl)C2=C1N=CC=C2 SBB032280 [0,2,0,0,0,0|2,0,0]=4 270 B14R2.7724 OC1=C2N=CC=CC2=C(Cl)C=C1Cl SBB039926 [0,2,0,0,0,0|2,0,0]=4 271 B14R2.29369 CC1=CC=C2C(=N1)C=CC(C)=C2N SBB010547 [0,2,0,0,0,0|2,0,0]=4 272 B14R2.142 N#CC1=CC=C2C=CC=C(O)C2=N1 SBB071410 [0,2,0,0,0,0|2,0,0]=4 273 B14R2.142 O=CC1=NC2=C(Cl)C=CC=C2C=C1 SBB010860 [0,2,0,0,0,0|2,0,0]=4 274 B14R2.8045 CC1=CC(Cl)=NC2=C(C)C=CC=C12 SBB016320 [0,2,0,0,0,0|1,0,0]=3 275 B14R2.8045 CC1=CC(O)=NC2=C1C=CC=C2C SBB088770 [0,2,0,0,0,0|1,0,0]=3 276 B14R2.8045 CC1=CC=CC2=C1N=C(C)C=C2Cl SBB014618 [0,2,0,0,0,0|1,0,0]=3 277 B14R2.8045 CC1=CC=CC2=C1N=C(C)C=C2O SBB014492 [0,2,0,0,0,0|1,0,0]=3 278 B14R2.8045 CC1=NC2=C(Br)C=CC=C2C(Cl)=C1 SBB101769 [0,2,0,0,0,0|2,0,0]=4 279 B14R2.8045 CC1=NC2=C(C=CC=C2F)C(Cl)=C1 SBB079102 [0,2,0,0,0,0|2,0,0]=4 280 B14R2.8045 CC1=NC2=C(Cl)C=CC=C2C(Cl)=C1 SBB019318 [0,2,0,0,0,0|2,0,0]=4 281 B14R2.8045 CC1=NC2=C(Cl)C=CC=C2C(N)=C1 SBB015018 [0,2,0,0,0,0|2,0,0]=4 282 B14R2.8045 CC1=NC2=C(F)C=CC=C2C(N)=C1 SBB019222 [0,2,0,0,0,0|2,0,0]=4 283 B14R2.8045 CC1=NC2=C(F)C=CC=C2C(O)=C1 SBB019390 [0,2,0,0,0,0|2,0,0]=4 284 B14R2.8045 FC1=CC2=C(Cl)C=CN=C2C(F)=C1 SBB092515 [0,2,0,0,0,0|2,0,0]=4 285 B14R2.8045 NC1=CC=NC2=C(Cl)C=C(Cl)C=C12 SBB018581 [0,2,0,0,0,0|2,0,0]=4 286 B14R2.8045 NC1=CC=NC2=C(F)C=C(F)C=C12 SBB074360 [0,2,0,0,0,0|2,0,0]=4 287 B14R2.8045 OC1=C2C=C(F)C=C(F)C2=NC=C1 SBB089757 [0,2,0,0,0,0|2,0,0]=4 288 B14R2.1019 COC1=CC2=C(N=CC=C2)C(N)=C1 SBB014274 [0,2,0,0,0,0|2,0,0]=4 289 B14R2.29365 CC1=CC(=O)NC2=C1C=CC(N)=N2 SBB013623 [0,2,0,0,0,0|2,0,0]=4 290 B14R2.29365 CC1=CC(C)=C2C=CC(N)=NC2=N1 SBB027559 [0,2,0,0,0,0|2,0,0]=4 291 B14R2.1078 COC1=C2N=CC=C(N)C2=CC=C1 SBB018763 [0,2,0,0,0,0|1,0,0]=3 292 B14R2.1078 COC1=C2NC=CC(=O)C2=CC=C1 SBB027213 [0,2,0,0,0,0|1,0,1]=4 293 B14R2.1131 COC1=C2C=CC=CC2=C(O)C=C1 SBB061646 [0,2,0,0,0,0|2,0,0]=4 294 B14R2.1131 COC1=CC=C(N)C2=CC=CN=C12 SBB077711 [0,2,0,0,0,0|1,0,0]=3 295 B14R2.1131 FC1=CC=C(CCl)C2=CC=CC=C12 SBB072373 [0,2,0,0,0,0|2,0,0]=4 296 B14R2.1131 OC1=C2N=CC=CC2=C(CCl)C=C1 SBB000700 [0,2,0,0,0,0|1,0,0]=3 297 B14R2.1131 OC1=C2N=CC=CC2=C(CCl)C=C1 SBB050289 [0,2,0,0,0,0|1,0,0]=3 298 B14R2.1131 OCC1=C2C=CC=NC2=C(O)C=C1 SBB001507 [0,2,0,0,0,0|1,0,0]=3 299 B14R2.7150 BrCCC1=CC=CC2=C1C=CC=C2 SBB008158 [0,2,0,0,0,0|2,0,0]=4 300 B14R2.7150 CCNC1=CC=CC2=CC=CC=C21 SBB072179 [0,2,0,0,0,0|2,0,0]=4 301 B14R2.7150 CCOC1=C2C=CC=CC2=CC=C1 SBB058064 [0,2,0,0,0,0|2,0,0]=4 302 B14R2.7150 CNCC1=CC=CC2=C1C=CC=N2 SBB025619 [0,2,0,0,0,0|1,0,0]=3 303 B14R2.7150 N#CCC1=CC=CC2=CC=CC=C21 SBB056313 [0,2,0,0,0,0|2,0,0]=4 304 B14R2.7150 NCCC1=CC=CC2=CC=CC=C21 SBB019200 [0,2,0,0,0,0|2,0,0]=4 305 B14R2.7150 OCCC1=CC=CC2=C1C=CC=C2 SBB088674 [0,2,0,0,0,0|2,0,0]=4 306 B14R2.31359 CC(=O)C1=C2C=CC=CC2=CC=C1 SBB060390 [0,2,0,0,0,0|2,0,0]=4 307 B14R2.31359 CC(=O)C1=CC=CC2=C1C=CC=C2 SBB040260 [0,2,0,0,0,0|2,0,0]=4 308 B14R2.31359 CC(O)C1=C2C=CC=CC2=CC=C1 SBB067060 [0,2,0,0,0,0|2,0,0]=4 309 B14R2.31359 C[C@@H](N)C1=CC=CC2=C1C=CC=C2 SBB006731 [0,2,0,0,0,0|2,0,0]=4 310 B14R2.31359 O=C(O)C1=C2C=CC=NC2=CC=C1 SBB027272 [0,2,0,0,0,0|1,0,1]=4 311 B14R2.31359 O=C(O)C1=C2N=CC=CC2=CC=C1 SBB041649 [0,2,0,0,0,0|1,0,1]=4 312 B14R2.31359 O=[N+]([O-])C1=CC=CC2=C1N=CC=C2 SBB066322 [0,2,0,0,0,0|2,0,0]=4 313 B14R2.31359 OB(O)C1=CC=CC2=CC=CN=C21 SBB003824 [0,2,0,0,0,0|2,0,0]=4 314 B12R2.2 C1=CC=C(C2=CC=CS2)N=C1 SBB087542 [0,0,1,1,0,0|2,0,0]=4 315 B12R2.2 C1=CN=CC(C2=CC=CS2)=C1 SBB087543 [0,0,1,1,0,0|2,0,0]=4 316 B12R2.32 O=CC1=NC2=C(C=CC=C2)N1 SBB000095 [0,0,1,1,0,0|2,0,0]=4 317 B12R2.32 O=CC1=NC2=CC=CC=C2S1 SBB052327 [0,0,1,1,0,0|2,0,0]=4 318 B14R3.164 C1=CC2=CC=CC3=C2C(=C1)CC3 SBB060402 [0,1,0,1,0,0|2,0,0]=4 319 B10R2.7 C1=CC2=C(C=C1)NN=N2 SBB060070 [1,0,0,0,1,0|1,0,1]=4 320 B10R2.7 C1=CC2=C(C=C1)OC=C2 SBB060607 [1,0,0,0,1,0|1,0,0]=3 321 B10R2.7 C1=CC2=C(C=C1)SC=N2 SBB058513 [1,0,0,0,1,0|1,0,0]=3 322 B10R2.7 C1=CC2=NC=CN2N=C1 SBB056402 [1,0,0,0,1,0|2,0,0]=4 323 B10R2.7 C1=CC2=NON=C2C=C1 SBB056284 [1,0,0,0,1,0|1,0,0]=3 324 B10R2.7 C1=CC2=NSN=C2C=C1 SBB083979 [1,0,0,0,1,0|1,0,0]=3 325 B10R2.7 C1=CC=C2CC=CC2=C1 SBB040862 [1,0,0,0,1,0|1,0,0]=3 326 B10R2.7 C1=CC=C2NC=CC2=C1 SBB055980 [1,0,0,0,1,0|0,0,1]=3 327 B10R2.7 C1=CC=C2NN=CC2=C1 SBB040063 [1,0,0,0,1,0|1,0,1]=4 328 B10R2.7 C1=CC=C2SC=CC2=C1 SBB055961 [1,0,0,0,1,0|1,0,0]=3 329 B10R2.7 C1=CC=C2[S+]=CSC2=C1 SBB099195 [1,0,0,0,1,0|2,0,0]=4 330 B10R2.7 C1=CN=C2SC=NC2=C1 SBB056308 [1,0,0,0,1,0|2,0,0]=4 331 B10R2.7 N1C=CC2=C1N=CC=C2 SBB004295 [1,0,0,0,1,0|1,0,1]=4 332 B10R2.7 N1C=NC2=C1C=CC=C2 SBB004294 [1,0,0,0,1,0|0,0,1]=3 333 B10R2.7 N1C=NC2=C1C=CC=N2 SBB004292 [1,0,0,0,1,0|1,0,1]=4