0 B10R1.20 C#CC1=C(C#N)C=CC=C1 BB32-1644 [0,0,0,0,0,0|2,0,2]=4 1 B10R1.20 C#CC1=C(CO)C=CC=C1 BB31-8444 [0,0,0,0,0,0|1,0,3]=4 2 B10R1.20 C#CC1=NC=CN=C1OC BB31-9718 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.20 CNC1=NC=CC=C1C=O BB52-1560 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.20 COC1=C(C#N)C=CC=N1 BB52-5808 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.20 COC1=C(C#N)N=CC=C1 BB31-7623 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.20 COC1=C(C=O)C=CN=C1 BB32-0612 [0,0,0,0,0,0|1,0,0]=1 7 B10R1.20 COC1=C(CO)N=CC=C1 BB32-2504 [0,0,0,0,0,0|1,0,2]=3 8 B10R1.20 COC1=NC=CN=C1NN BB31-4174 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.20 N#CC1=C(C=O)C=CC=N1 BB31-1904 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.20 N#CC1=C(CN)C=CC=C1 BB31-0354 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.20 N#CC1=C(CN)C=CC=C1 BB32-1359 [0,0,0,0,0,0|3,0,1]=4 12 B9R1.15 C=CC1=NC=CC=C1C BB32-1725 [1,0,0,0,0,0|2,0,0]=3 13 B9R1.15 CC1=C(CN)C=NC=C1 BB31-2786 [1,0,0,0,0,0|2,0,1]=4 14 B9R1.15 CC1=C(CO)C=CN=C1 BB32-1626 [1,0,0,0,0,0|1,0,2]=4 15 B9R1.15 CC1=C(NN)C=CN=C1 BB31-8932 [1,0,0,0,0,0|3,0,0]=4 16 B9R1.15 CC1=NC=CN=C1C=O BB32-1077 [1,0,0,0,0,0|2,0,0]=3 17 B9R1.15 CNC1=C(C)C=CN=C1 BB31-7097 [1,0,0,0,0,0|2,0,1]=4 18 B9R1.15 CNC1=C(N)C=CN=C1 BB32-0831 [1,0,0,0,0,0|3,0,0]=4 19 B9R1.15 CNC1=NC=CC=C1C BB32-0851 [1,0,0,0,0,0|2,0,1]=4 20 B9R1.15 COC1=C(F)C=NC=C1 BB31-8443 [1,0,0,0,0,0|2,0,0]=3 21 B9R1.15 COC1=C(N)C=CN=C1 BB32-2356 [1,0,0,0,0,0|2,0,0]=3 22 B9R1.15 COC1=C(O)C=NC=C1 BB31-8011 [1,0,0,0,0,0|1,0,1]=3 23 B9R1.15 COC1=CC=CN=C1O BB52-8591 [1,0,0,0,0,0|1,0,1]=3 24 B9R1.15 COC1=CCCCC1=O BB32-1133 [1,0,0,0,0,0|0,0,3]=4 25 B9R1.15 COC1=NC=CN=C1Br BB31-9027 [1,0,0,0,0,0|3,0,0]=4 26 B9R1.15 COC1=NC=NC=C1N BB31-2964 [1,0,0,0,0,0|3,0,0]=4 27 B9R1.15 COC1=NN=CC=C1N BB31-9986 [1,0,0,0,0,0|3,0,0]=4 28 B9R1.15 CSC1=C(Br)C=CC=N1 BB32-2292 [1,0,0,0,0,0|2,1,0]=4 29 B9R1.15 CSC1=C(N)N=CC=C1 BB32-0864 [1,0,0,0,0,0|2,1,0]=4 30 B9R1.15 N#CC1=C(O)C=NC=C1 BB31-6535 [1,0,0,0,0,0|2,0,1]=4 31 B9R1.15 NC1=CC=CN=C1C=O BB31-4893 [1,0,0,0,0,0|2,0,0]=3 32 B9R1.15 NC1=NC=CN=C1C=O BB31-5072 [1,0,0,0,0,0|3,0,0]=4 33 B9R1.15 NCC1=CC=CNC1=O BB31-8567 [1,0,0,0,0,0|3,0,0]=4 34 B9R1.15 NNC1=C(I)C=CC=C1 BB32-3554 [1,0,0,0,0,0|3,0,0]=4 35 B9R1.15 O=C1NC=CC=C1CO BB32-1653 [1,0,0,0,0,0|3,0,0]=4 36 B9R1.15 OCC1=C(O)C=NC=C1 BB32-1573 [1,0,0,0,0,0|1,0,2]=4 37 B11R1.37 C#CC1=C(C=O)C=CC(F)=C1 BB31-6867 [0,1,0,0,0,0|1,0,1]=3 38 B11R1.37 CCC1=C(CO)C=C(Br)C=C1 BB31-5271 [0,1,0,0,0,0|1,0,2]=4 39 B11R1.37 COC1=C(C#N)C=CC(Br)=N1 BB31-1243 [0,1,0,0,0,0|2,0,1]=4 40 B11R1.37 COC1=C(C#N)C=CC(F)=N1 BB31-9977 [0,1,0,0,0,0|2,0,1]=4 41 B11R1.37 COC1=C(CN)C=C(Cl)C=C1 BB32-2047 [0,1,0,0,0,0|1,0,1]=3 42 B11R1.37 COC1=C(CO)C=CC(Br)=N1 BB31-3492 [0,1,0,0,0,0|1,0,2]=4 43 B11R1.37 COC1=C(NN)C=CC(Cl)=C1 BB32-0755 [0,1,0,0,0,0|2,0,0]=3 44 B11R1.37 COC1=C(OC)N=C(I)C=C1 BB32-1693 [0,1,0,0,0,0|3,0,0]=4 45 B11R1.37 COC1=CC(Cl)=NC=C1C#N BB31-4763 [0,1,0,0,0,0|2,0,1]=4 46 B11R1.37 COC1=CC(Cl)=NC=C1C=O BB32-0302 [0,1,0,0,0,0|1,0,0]=2 47 B11R1.37 COC1=NC=C(Cl)C=C1CO BB32-2149 [0,1,0,0,0,0|1,0,2]=4 48 B11R1.37 COC1=NC=C(F)C=C1CO BB31-8538 [0,1,0,0,0,0|1,0,2]=4 49 B11R1.37 N#CC1=C(C=O)C=CC(Br)=C1 BB32-2296 [0,1,0,0,0,0|2,0,0]=3 50 B11R1.37 O=CC1=C(C=O)C=C(Br)C=C1 BB31-1925 [0,1,0,0,0,0|2,0,0]=3 51 B11R1.41 C=CCC1=C(OC)C=CC=C1 BB31-5643 [0,1,0,0,0,0|1,0,0]=2 52 B11R1.41 CCC1=C(CC#N)C=CC=C1 BB31-6896 [0,1,0,0,0,0|2,0,1]=4 53 B11R1.41 CCOC1=C(C#N)C=CC=N1 BB52-5989 [0,1,0,0,0,0|2,0,1]=4 54 B11R1.41 CCOC1=C(C=O)C=CC=N1 BB31-6380 [0,1,0,0,0,0|1,0,0]=2 55 B11R1.41 CCOC1=C(C=O)C=NC=C1 BB31-2306 [0,1,0,0,0,0|1,0,0]=2 56 B11R1.41 CNCC1=C(CO)C=CC=C1 BB31-5635 [0,1,0,0,0,0|1,0,2]=4 57 B11R1.41 COC1=C(CC=O)C=CC=C1 BB31-5558 [0,1,0,0,0,0|0,0,0]=1 58 B11R1.41 COC1=C(CCBr)C=CC=C1 BB32-1701 [0,1,0,0,0,0|1,0,1]=3 59 B11R1.41 N#CC1=C(CCO)C=CC=C1 BB31-7734 [0,1,0,0,0,0|2,0,1]=4 60 B11R1.53 C#CC1=C(C(C)=O)C=CC=C1 BB31-9300 [0,1,0,0,0,0|1,0,1]=3 61 B11R1.53 C=CC1=C([N+](=O)[O-])C=CC=C1 BB32-3396 [0,1,0,0,0,0|2,0,1]=4 62 B11R1.53 CC(C)C1=C(C=O)C=CC=C1 BB31-4875 [0,1,0,0,0,0|1,0,0]=2 63 B11R1.53 CC(O)C1=C(C#N)C=CC=C1 BB31-3613 [0,1,0,0,0,0|2,0,1]=4 64 B11R1.53 CCC1=C(C(=O)O)C=CC=N1 BB31-5819 [0,1,0,0,0,0|2,0,0]=3 65 B11R1.53 CN(C)C1=C(CO)C=CC=C1 BB32-2780 [0,1,0,0,0,0|1,0,2]=4 66 B11R1.53 CNC1=C(C(C)=O)C=CC=C1 BB32-0506 [0,1,0,0,0,0|1,0,0]=2 67 B11R1.53 COC1=C(C(=N)N)C=CC=C1 BB32-0582 [0,1,0,0,0,0|1,0,0]=2 68 B11R1.53 COC1=C(C(N)=O)C=NC=C1 BB31-7215 [0,1,0,0,0,0|1,0,0]=2 69 B11R1.53 N#CC1=CC=CN=C1C(=O)O BB31-5787 [0,1,0,0,0,0|3,0,0]=4 70 B11R1.53 NCC1=C([N+](=O)[O-])C=CC=C1 BB31-3977 [0,1,0,0,0,0|3,0,0]=4 71 B11R1.53 O=CC1=C([N+](=O)[O-])C=CC=N1 BB31-0330 [0,1,0,0,0,0|3,0,0]=4 72 B11R1.53 O=CC1=C([N+](=O)[O-])C=NC=C1 BB32-0640 [0,1,0,0,0,0|3,0,0]=4 73 B11R1.265 COC1=C(Br)C=NC=C1C=O BB31-1859 [0,1,0,0,0,0|1,0,0]=2 74 B11R1.265 COC1=C(OC)C(Cl)=NC=C1 BB31-0230 [0,1,0,0,0,0|3,0,0]=4 75 B11R1.265 COC1=CC=CC(I)=C1C#N BB32-3792 [0,1,0,0,0,0|1,0,1]=3 76 B11R1.265 COC1=NC=CC(C)=C1C#N BB31-2868 [0,1,0,0,0,0|2,0,1]=4 77 B11R1.265 N#CC1=C(F)C=CC=C1C=O BB32-0052 [0,1,0,0,0,0|2,0,0]=3 78 B11R2.1 BrC1=COC2=CC=CN=C12 BB31-7324 [0,0,0,1,0,0|2,0,1]=4 79 B11R2.1 CC1=NOC2=C1C=CC=C2 BB31-4705 [0,0,0,1,0,0|2,0,0]=3 80 B11R2.1 ClC1=CNC2=C1C=CC=C2 BB31-3376 [0,0,0,1,0,0|2,0,1]=4 81 B11R2.1 NC1=CNC2=C1C=CC=C2 BB32-3019 [0,0,0,1,0,0|2,0,1]=4 82 B11R2.1 NC1=NOC2=C1C=CN=C2 BB31-0385 [0,0,0,1,0,0|3,0,0]=4 83 B11R2.1 NC1=NOC2=NC=CC=C12 BB52-5781 [0,0,0,1,0,0|3,0,0]=4 84 B11R2.1 O=C1CCC2=C1C=NC=C2 BB31-4897 [0,0,0,1,0,0|2,0,0]=3 85 B11R2.1 O=C1COC2=C1C=CN=C2 BB31-9000 [0,0,0,1,0,0|1,0,0]=2 86 B11R2.1 O=C1CSC2=C1C=CC=C2 BB31-1622 [0,0,0,1,0,0|0,1,0]=2 87 B11R2.1 O[C@@H]1CCC2=C1C=CC=C2 BB31-5413 [0,0,0,1,0,0|1,0,2]=4 88 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 BB31-4659 [0,0,0,1,0,0|1,0,2]=4 89 B11R2.20 C1=CC=C2OCCNC2=C1 BB51-1682 [0,0,0,1,0,0|2,0,0]=3 90 B11R2.20 C1=CC=C2SCC=NC2=C1 BB52-7621 [0,0,0,1,0,0|2,1,0]=4 91 B11R2.20 C1=CN=C2OCCCC2=C1 BB31-4408 [0,0,0,1,0,0|2,0,1]=4 92 B11R2.20 C1=CN=C2OCCNC2=C1 BB31-8971 [0,0,0,1,0,0|3,0,0]=4 93 B9R1.14 CCN1C=CN=C1C=O BB52-0220 [0,0,0,0,1,0|3,0,0]=4 94 B9R1.14 COC1=C(C=O)OC=C1 BB32-1842 [0,0,0,0,1,0|1,0,0]=2 95 B8R1.2 COC1=CN=NC=C1 BB31-4095 [2,0,0,0,0,0|2,0,0]=4 96 B8R1.2 COC1=NC=CC=N1 BB31-5696 [2,0,0,0,0,0|2,0,0]=4 97 B8R1.2 O=CC1=NC=CC=N1 BB31-5137 [2,0,0,0,0,0|2,0,0]=4 98 B8R1.2 O=CC1=NC=NC=C1 BB31-4750 [2,0,0,0,0,0|2,0,0]=4 99 B8R1.2 O=CC1=NN=CC=C1 BB52-3335 [2,0,0,0,0,0|2,0,0]=4 100 B8R1.5 CC1=C(F)C=CN=C1 BB31-4475 [2,0,0,0,0,0|2,0,0]=4 101 B8R1.5 CC1=C(I)C=NC=C1 BB32-1776 [2,0,0,0,0,0|2,0,0]=4 102 B8R1.5 OC1=C(O)C=NC=C1 BB31-0244 [2,0,0,0,0,0|1,0,1]=4 103 B10R1.2 CC1=C(Br)C=NC=C1C=O BB32-1804 [1,1,0,0,0,0|1,0,0]=3 104 B10R1.2 CC1=C(C=O)C=CN=C1Cl BB31-6909 [1,1,0,0,0,0|1,0,0]=3 105 B10R1.2 CNC1=CC=CC(Br)=C1N BB31-0621 [1,1,0,0,0,0|2,0,0]=4 106 B10R1.2 COC1=C(C)C(Br)=NC=C1 BB31-0875 [1,1,0,0,0,0|1,0,1]=4 107 B10R1.2 COC1=C(C)C(N)=CN=C1 BB31-6858 [1,1,0,0,0,0|1,0,1]=4 108 B10R1.2 COC1=C(Cl)C(N)=CC=C1 BB31-6645 [1,1,0,0,0,0|1,0,0]=3 109 B10R1.2 COC1=C(F)C(N)=CC=N1 BB31-0911 [1,1,0,0,0,0|2,0,0]=4 110 B10R1.2 COC1=C(I)C(N)=CC=N1 BB31-1325 [1,1,0,0,0,0|2,0,0]=4 111 B10R1.2 COC1=C(N)C(Br)=NC=C1 BB31-8404 [1,1,0,0,0,0|2,0,0]=4 112 B10R1.2 COC1=C(N)C(O)=CC=C1 BB31-4933 [1,1,0,0,0,0|1,0,0]=3 113 B10R1.2 COC1=CC=CC(F)=C1C BB31-8931 [1,1,0,0,0,0|0,0,1]=3 114 B10R1.2 COC1=CC=CC(F)=C1Cl BB32-2640 [1,1,0,0,0,0|1,0,0]=3 115 B10R1.2 COC1=CC=CC(I)=C1Br BB31-8698 [1,1,0,0,0,0|1,0,0]=3 116 B10R1.2 NC1=C(C=O)C=CC=C1O BB31-0088 [1,1,0,0,0,0|1,0,0]=3 117 B10R1.2 O=CC1=CC=CC(I)=C1O BB31-4248 [1,1,0,0,0,0|0,0,0]=2 118 B10R1.2 O=CC1=CC=NC(F)=C1Cl BB31-0592 [1,1,0,0,0,0|2,0,0]=4 119 B10R1.4 CC1=C(CON)C=CC=C1 BB31-8696 [1,1,0,0,0,0|0,0,2]=4 120 B10R1.4 CCNC1=C(O)C=CC=C1 BB31-4887 [1,1,0,0,0,0|1,0,1]=4 121 B10R1.4 CCOC1=CC=CN=C1Br BB31-6362 [1,1,0,0,0,0|2,0,0]=4 122 B10R1.4 CNCC1=C(O)C=CC=C1 BB31-5689 [1,1,0,0,0,0|1,0,1]=4 123 B10R1.4 NOCC1=C(Cl)C=CC=C1 BB32-2623 [1,1,0,0,0,0|2,0,0]=4 124 B10R1.4 OCCC1=C(I)C=CC=C1 BB31-4375 [1,1,0,0,0,0|2,0,0]=4 125 B10R1.4 O\N=C\C1=C(F)C=CC=C1 BB31-4287 [1,1,0,0,0,0|1,0,1]=4 126 B10R1.25 CC1=C(C=O)C=CC(F)=N1 BB31-6533 [1,1,0,0,0,0|1,0,0]=3 127 B10R1.25 CC1=C(NN)C=CC(Cl)=C1 BB12-5162 [1,1,0,0,0,0|2,0,0]=4 128 B10R1.25 CC1=CC(C)=C(C=O)C=N1 BB31-0486 [1,1,0,0,0,0|1,0,0]=3 129 B10R1.25 CCC1=C(F)C=C(Br)C=C1 BB32-3524 [1,1,0,0,0,0|2,0,0]=4 130 B10R1.25 CCC1=C(N)C=C(Br)C=C1 BB31-2864 [1,1,0,0,0,0|2,0,0]=4 131 B10R1.25 CNC1=C(Cl)C=C(F)C=C1 BB31-6776 [1,1,0,0,0,0|2,0,0]=4 132 B10R1.25 CNC1=C(F)C=C(Br)C=C1 BB32-1250 [1,1,0,0,0,0|2,0,0]=4 133 B10R1.25 CNC1=C(N)C=C(C)C=C1 BB32-2054 [1,1,0,0,0,0|2,0,0]=4 134 B10R1.25 COC1=C(Br)C=C(C)N=C1 BB31-1248 [1,1,0,0,0,0|2,0,0]=4 135 B10R1.25 COC1=C(Br)C=C(Cl)N=C1 BB31-0268 [1,1,0,0,0,0|2,0,0]=4 136 B10R1.25 COC1=C(Cl)C=C(C)C=N1 BB31-0873 [1,1,0,0,0,0|2,0,0]=4 137 B10R1.25 COC1=C(F)C=C(N)C=N1 BB31-6433 [1,1,0,0,0,0|2,0,0]=4 138 B10R1.25 COC1=C(F)C=C(S)C=C1 BB31-6341 [1,1,0,0,0,0|1,0,0]=3 139 B10R1.25 COC1=C(I)C=C(Cl)N=C1 BB31-9337 [1,1,0,0,0,0|2,0,0]=4 140 B10R1.25 COC1=CC=C(C)N=C1Cl BB31-3805 [1,1,0,0,0,0|2,0,0]=4 141 B10R1.25 COC1=CC=C(Cl)N=C1Br BB31-1256 [1,1,0,0,0,0|2,0,0]=4 142 B10R1.25 COC1=CN=C(Br)C=C1Cl BB31-1253 [1,1,0,0,0,0|2,0,0]=4 143 B10R1.25 COC1=CN=C(Br)C=C1N BB31-2723 [1,1,0,0,0,0|2,0,0]=4 144 B10R1.25 COC1=CN=C(Br)C=C1O BB31-7686 [1,1,0,0,0,0|1,0,1]=4 145 B10R1.25 COC1=CN=C(Cl)C=C1N BB31-0868 [1,1,0,0,0,0|2,0,0]=4 146 B10R1.25 COC1=NC=C(Br)C=C1O BB31-9713 [1,1,0,0,0,0|1,0,1]=4 147 B10R1.25 CSC1=C(Br)C=C(F)C=C1 BB31-5668 [1,1,0,0,0,0|1,1,0]=4 148 B10R1.25 N#CC1=C(O)C=C(N)C=C1 BB31-5029 [1,1,0,0,0,0|1,0,1]=4 149 B10R1.25 NC1=C(C=O)C=CC(Cl)=N1 BB32-2980 [1,1,0,0,0,0|2,0,0]=4 150 B10R1.25 NC1=CC(Br)=CN=C1C=O BB31-1858 [1,1,0,0,0,0|2,0,0]=4 151 B10R1.25 NCC1=C(O)C=C(Br)C=C1 BB31-9160 [1,1,0,0,0,0|1,0,1]=4 152 B10R1.25 O=CC1=C(Cl)C=C(F)N=C1 BB31-1261 [1,1,0,0,0,0|2,0,0]=4 153 B10R1.25 O=CC1=C(F)N=C(Cl)C=C1 BB31-5262 [1,1,0,0,0,0|2,0,0]=4 154 B10R1.25 O=CC1=CC=C(F)N=C1Cl BB31-0855 [1,1,0,0,0,0|2,0,0]=4 155 B10R1.25 O=CC1=NC=C(Br)C=C1Cl BB31-6419 [1,1,0,0,0,0|2,0,0]=4 156 B10R1.25 O=CC1=NC=C(Br)C=C1F BB31-4775 [1,1,0,0,0,0|2,0,0]=4 157 B10R1.30 CC1=CC(C=O)=C(N)N=C1 BB31-0313 [1,1,0,0,0,0|2,0,0]=4 158 B10R1.30 CC1=CC=C(O)C(C=O)=N1 BB32-3694 [1,1,0,0,0,0|1,0,0]=3 159 B10R1.30 CC1=NC=C(Cl)C=C1C=O BB31-8278 [1,1,0,0,0,0|1,0,0]=3 160 B10R1.30 CCC1=C(Br)C=CC(I)=C1 BB31-0423 [1,1,0,0,0,0|2,0,0]=4 161 B10R1.30 CCC1=C(O)C=CC(Br)=C1 BB31-3966 [1,1,0,0,0,0|1,0,1]=4 162 B10R1.30 COC1=C(Br)C=CC(Cl)=N1 BB31-8374 [1,1,0,0,0,0|2,0,0]=4 163 B10R1.30 COC1=C(C)C=CC(I)=C1 BB32-1094 [1,1,0,0,0,0|0,0,1]=3 164 B10R1.30 COC1=C(C)C=CC(O)=C1 BB31-4015 [1,1,0,0,0,0|0,0,1]=3 165 B10R1.30 COC1=C(Cl)C=CC(Br)=N1 BB31-9814 [1,1,0,0,0,0|2,0,0]=4 166 B10R1.30 COC1=C(Cl)C=CC(Cl)=N1 BB31-2165 [1,1,0,0,0,0|2,0,0]=4 167 B10R1.30 COC1=C(Cl)C=CC(N)=N1 BB31-6925 [1,1,0,0,0,0|2,0,0]=4 168 B10R1.30 COC1=C(I)C=CC(Br)=N1 BB32-0202 [1,1,0,0,0,0|2,0,0]=4 169 B10R1.30 COC1=C(I)C=CC(C)=C1 BB31-7787 [1,1,0,0,0,0|1,0,0]=3 170 B10R1.30 COC1=C(I)C=CC(N)=C1 BB31-9407 [1,1,0,0,0,0|1,0,0]=3 171 B10R1.30 COC1=C(I)C=NC(Cl)=C1 BB31-0823 [1,1,0,0,0,0|2,0,0]=4 172 B10R1.30 COC1=C(N)C=CC(O)=C1 BB31-5893 [1,1,0,0,0,0|1,0,0]=3 173 B10R1.30 COC1=C(N)C=CC(O)=C1 BB31-5894 [1,1,0,0,0,0|1,0,0]=3 174 B10R1.30 COC1=CC(=N)NC=C1Cl BB31-4727 [1,1,0,0,0,0|2,0,0]=4 175 B10R1.30 COC1=CC(Br)=CN=C1C BB31-0618 [1,1,0,0,0,0|1,0,1]=4 176 B10R1.30 COC1=CC(Br)=CNC1=O BB31-4970 [1,1,0,0,0,0|1,0,0]=3 177 B10R1.30 COC1=CC(F)=CN=C1Br BB31-9508 [1,1,0,0,0,0|2,0,0]=4 178 B10R1.30 COC1=CC(N)=CN=C1Br BB31-0270 [1,1,0,0,0,0|2,0,0]=4 179 B10R1.30 NC1=NC=C(Cl)C=C1C=O BB32-2393 [1,1,0,0,0,0|2,0,0]=4 180 B10R1.30 O=CC1=C(Br)C=CC(Br)=N1 BB32-0053 [1,1,0,0,0,0|2,0,0]=4 181 B10R1.30 O=CC1=CC(=O)NC=C1Br BB31-0856 [1,1,0,0,0,0|2,0,0]=4 182 B10R1.30 O=CC1=CC(Br)=CN=C1Br BB31-6637 [1,1,0,0,0,0|2,0,0]=4 183 B10R1.30 O=CC1=CC(Cl)=NC=C1O BB31-9241 [1,1,0,0,0,0|1,0,0]=3 184 B10R1.30 OCC1=C(O)C=CC(I)=C1 BB31-9654 [1,1,0,0,0,0|0,0,2]=4 185 B10R1.61 CC(=O)C1=C(Br)C=NC=C1 BB31-7884 [1,1,0,0,0,0|2,0,0]=4 186 B10R1.61 CC(=O)C1=C(O)C=NC=C1 BB32-1019 [1,1,0,0,0,0|1,0,0]=3 187 B10R1.61 CC(=O)C1=CC=CN=C1Br BB31-6615 [1,1,0,0,0,0|2,0,0]=4 188 B10R1.61 CC(N)C1=C(Br)C=CC=C1 BB31-0378 [1,1,0,0,0,0|2,0,0]=4 189 B10R1.61 CC1=C(C(=N)N)C=CC=C1 BB31-5703 [1,1,0,0,0,0|1,0,0]=3 190 B10R1.61 CN(C)C1=C(F)C=CC=C1 BB32-1594 [1,1,0,0,0,0|2,0,0]=4 191 B10R1.61 C[C@@H](N)C1=C(Cl)C=CC=C1 BB31-0478 [1,1,0,0,0,0|2,0,0]=4 192 B10R1.61 C[C@@H](N)C1=C(F)C=CC=C1 BB31-0488 [1,1,0,0,0,0|2,0,0]=4 193 B10R1.61 C[C@@H](N)C1=C(F)C=CC=C1 BB31-7807 [1,1,0,0,0,0|2,0,0]=4 194 B10R1.61 C[C@@H](N)C1=C(O)C=CC=C1 BB31-1004 [1,1,0,0,0,0|1,0,1]=4 195 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 BB31-2127 [1,1,0,0,0,0|2,0,0]=4 196 B10R1.61 C[C@H](N)C1=C(O)C=CC=C1 BB31-8099 [1,1,0,0,0,0|1,0,1]=4 197 B10R1.61 NC(=O)C1=C(F)C=NC=C1 BB32-0426 [1,1,0,0,0,0|2,0,0]=4 198 B10R1.61 NC(=O)C1=C(O)C=NC=C1 BB31-0185 [1,1,0,0,0,0|1,0,0]=3 199 B10R1.61 NC(=O)C1=CC=CN=C1S BB32-2901 [1,1,0,0,0,0|1,1,0]=4 200 B10R1.61 O=[N+]([O-])C1=C(O)C=NC=C1 BB31-9668 [1,1,0,0,0,0|2,0,0]=4 201 B10R1.245 C=CC1=C(C)C=CC=C1C BB31-3794 [1,1,0,0,0,0|1,0,0]=3 202 B10R1.245 CC1=CC=CC(Br)=C1C=O BB31-3622 [1,1,0,0,0,0|0,0,0]=2 203 B10R1.245 CNC1=C(Br)C=CC=C1N BB31-0597 [1,1,0,0,0,0|2,0,0]=4 204 B10R1.245 COC1=C(Br)C=CN=C1C BB31-0874 [1,1,0,0,0,0|1,0,1]=4 205 B10R1.245 NC1=CC=CC(F)=C1C=O BB32-0753 [1,1,0,0,0,0|1,0,0]=3 206 B10R1.245 O=CC1=C(Br)C=CN=C1F BB31-1818 [1,1,0,0,0,0|2,0,0]=4 207 B10R1.245 O=CC1=C(Cl)C=CN=C1F BB31-0935 [1,1,0,0,0,0|2,0,0]=4 208 B10R1.245 O=CC1=C(F)C=NC=C1F BB31-6509 [1,1,0,0,0,0|2,0,0]=4 209 B12R1.46 CC1=CC(B(O)O)=C(C=O)C=C1 BB31-5684 [0,2,0,0,0,0|2,0,0]=4 210 B12R1.46 CCC1=C([N+](=O)[O-])C=C(Br)C=C1 BB31-8471 [0,2,0,0,0,0|2,0,0]=4 211 B12R1.46 CNC1=C([N+](=O)[O-])C=C(Cl)C=C1 BB31-3080 [0,2,0,0,0,0|2,0,0]=4 212 B12R1.46 COC1=C(C(=N)N)C=C(Cl)C=C1 BB31-3251 [0,2,0,0,0,0|1,0,0]=3 213 B12R1.46 COC1=C(C(=O)O)C=C(O)C=C1 BB32-3553 [0,2,0,0,0,0|0,0,0]=2 214 B12R1.46 COC1=C(C(=O)O)N=C(Br)C=C1 BB31-1255 [0,2,0,0,0,0|1,0,0]=3 215 B12R1.46 COC1=C(C(C)C)C=C(C)C=C1 BB31-8018 [0,2,0,0,0,0|1,0,1]=4 216 B12R1.46 COC1=C(C(C)C)C=C(N)C=C1 BB31-7417 [0,2,0,0,0,0|1,0,1]=4 217 B12R1.46 COC1=C(C(C)N)C=C(Cl)C=C1 BB32-2037 [0,2,0,0,0,0|1,0,1]=4 218 B12R1.46 COC1=NC=C(Br)C=C1C(C)=O BB31-1252 [0,2,0,0,0,0|1,0,0]=3 219 B12R1.57 CNC1=C(C(=O)O)C=CC(F)=C1 BB31-1863 [0,2,0,0,0,0|1,0,0]=3 220 B12R1.57 COC1=C(B(O)O)C=CC(Br)=C1 BB31-8504 [0,2,0,0,0,0|1,0,1]=4 221 B12R1.57 COC1=C(C(=O)O)C=CC(Br)=N1 BB31-9317 [0,2,0,0,0,0|1,0,0]=3 222 B12R1.57 COC1=C(C(=O)O)C=CC(N)=N1 BB31-8765 [0,2,0,0,0,0|1,0,0]=3 223 B12R1.57 COC1=C([C@@H](C)N)C=CC(F)=C1 BB32-0149 [0,2,0,0,0,0|1,0,1]=4 224 B12R1.57 COC1=CC(Br)=CN=C1C(=O)O BB31-0395 [0,2,0,0,0,0|1,0,0]=3 225 B12R1.57 O=CC1=C(C(=O)O)C=CC(Br)=C1 BB31-4782 [0,2,0,0,0,0|2,0,0]=4 226 B12R1.78 CCC1=CC(OC)=C(OC)C=C1 BB32-3124 [0,2,0,0,0,0|2,0,0]=4 227 B12R1.78 COC1=C(C#N)C=CC(C=O)=C1 BB32-1172 [0,2,0,0,0,0|1,0,1]=4 228 B12R1.78 COC1=C(OC)C=C(NN)C=C1 BB31-5061 [0,2,0,0,0,0|2,0,0]=4 229 B12R1.234 COC1=CC(Br)=CC(F)=C1C#N BB32-2650 [0,2,0,0,0,0|1,0,1]=4 230 B12R1.448 COC1=C(OC)C=C(N)C(N)=C1 BB31-4466 [0,2,0,0,0,0|2,0,0]=4 231 B12R1.652 COC1=C(C=O)C(F)=C(Br)C=C1 BB31-0426 [0,2,0,0,0,0|0,0,0]=2 232 B12R1.75 C#CC1=C(OC(F)F)C=CC=C1 BB31-9842 [0,2,0,0,0,0|1,0,1]=4 233 B12R1.75 C=CC1=C(OC(C)C)C=CC=C1 BB31-7090 [0,2,0,0,0,0|1,0,0]=3 234 B12R1.75 CC(C)OC1=C(CN)C=CC=C1 BB31-5356 [0,2,0,0,0,0|1,0,1]=4 235 B12R1.77 COC(=O)C1=C(NN)C=CC=C1 BB32-0966 [0,2,0,0,0,0|2,0,0]=4 236 B12R1.121 COC1=C(CCCO)C=CC=C1 BB31-8466 [0,2,0,0,0,0|0,0,2]=4 237 B12R1.283 CCOC1=NC=CC=C1C(=O)O BB52-2370 [0,2,0,0,0,0|1,0,0]=3 238 B12R1.283 COCC1=C(C(=O)O)C=CC=C1 BB31-6470 [0,2,0,0,0,0|0,0,0]=2 239 B12R1.283 NCCC1=C(C(=O)O)C=CC=C1 BB31-8485 [0,2,0,0,0,0|1,0,0]=3 240 B12R1.283 O=[N+]([O-])C1=C(CCBr)C=CC=C1 BB31-3352 [0,2,0,0,0,0|2,0,0]=4 241 B12R1.1112 C=CCC1=C(C=O)C=CC=C1O BB31-6831 [0,2,0,0,0,0|1,0,1]=4 242 B12R1.87 CCC1=C(Br)C=CC=C1C(=O)O BB31-5768 [0,2,0,0,0,0|1,0,0]=3 243 B12R1.87 CNC1=C(Br)C=CC=C1[N+](=O)[O-] BB31-9432 [0,2,0,0,0,0|2,0,0]=4 244 B12R1.87 COC1=C(C)C=CC=C1B(O)O BB31-4778 [0,2,0,0,0,0|1,0,1]=4 245 B12R1.261 CC(=O)C1=C(N(C)C)C=CC=C1 BB31-9433 [0,2,0,0,0,0|1,0,0]=3 246 B12R1.261 CC(=O)C1=CC=CN=C1C(=O)O BB32-3805 [0,2,0,0,0,0|2,0,0]=4 247 B12R1.261 C[C@H](N)C1=C([N+](=O)[O-])C=CC=C1 BB31-8228 [0,2,0,0,0,0|2,0,0]=4 248 B12R1.437 CC1=CC=CC(C=O)=C1[N+](=O)[O-] BB32-3393 [0,2,0,0,0,0|2,0,0]=4 249 B12R1.437 CNC1=CC=CC(Br)=C1[N+](=O)[O-] BB31-0622 [0,2,0,0,0,0|2,0,0]=4 250 B12R1.437 COC1=C(B(O)O)C(F)=CC=C1 BB54-4574 [0,2,0,0,0,0|1,0,1]=4 251 B12R1.437 COC1=C(C(=O)O)C(F)=NC=C1 BB31-0737 [0,2,0,0,0,0|1,0,0]=3 252 B12R1.437 COC1=C(C(=O)O)C(N)=CN=C1 BB31-6803 [0,2,0,0,0,0|1,0,0]=3 253 B12R1.437 COC1=C(C(C)=O)C(C)=CC=C1 BB31-5048 [0,2,0,0,0,0|0,0,0]=2 254 B12R1.437 COC1=C([N+](=O)[O-])C(O)=CC=C1 BB32-1163 [0,2,0,0,0,0|1,0,0]=3 255 B12R1.437 O=CC1=CC=CC(O)=C1[N+](=O)[O-] BB32-1825 [0,2,0,0,0,0|2,0,0]=4 256 B12R1.741 COC1=C(Br)C=CC(F)=C1C=O BB31-7709 [0,2,0,0,0,0|0,0,0]=2 257 B12R1.1879 C#CC1=C(OC)C=CC=C1OC BB31-1590 [0,2,0,0,0,0|1,0,1]=4 258 B12R1.1879 C=CC1=C(OC)C(OC)=NC=C1 BB31-7376 [0,2,0,0,0,0|2,0,0]=4 259 B10R1.15 C=C(CC)C1=CC=CC=C1 BB31-3793 [0,0,1,1,0,0|2,0,0]=4 260 B10R1.15 COC(=N)C1=CC=CC=C1 BB31-6235 [0,0,1,1,0,0|2,0,0]=4 261 B10R1.176 COC1=CC(O)=C(Cl)C=C1 BB31-3552 [0,0,1,1,0,0|1,0,1]=4 262 B10R1.176 COC1=CC(O)=C(O)C=C1 BB32-1848 [0,0,1,1,0,0|1,0,1]=4 263 B10R2.7 C1=CC2=C(C=C1)SCS2 BB32-1488 [1,0,0,1,0,0|0,2,0]=4 264 B10R2.32 O=C1CCC2=C1C=CS2 BB32-3136 [0,0,0,1,1,0|2,0,0]=4 265 B10R2.32 O=C1CCC2=CNC=C12 BB31-7130 [0,0,0,1,1,0|2,0,0]=4 266 B12R2.24 BrC1=CC2=C(C=C1)CCCO2 BB31-5223 [0,1,0,1,0,0|1,0,1]=4 267 B12R2.24 BrC1=CC=C2OCCNC2=C1 BB51-1687 [0,1,0,1,0,0|2,0,0]=4 268 B12R2.24 CC1=CC2=C(C=C1)NCCO2 BB32-3795 [0,1,0,1,0,0|2,0,0]=4 269 B12R2.24 CC1=CC2=C(C=C1)OCCN2 BB31-6981 [0,1,0,1,0,0|2,0,0]=4 270 B12R2.24 CC1=CC=C2OCCNC2=C1 BB51-1683 [0,1,0,1,0,0|2,0,0]=4 271 B12R2.24 CC1=NC2=CC=CC=C2SC1 BB52-7622 [0,1,0,1,0,0|1,1,0]=4 272 B12R2.24 CC1COC2=C(C=CC=C2)N1 BB32-1397 [0,1,0,1,0,0|1,0,1]=4 273 B12R2.24 ClC1=CC2=C(C=C1)OCCN2 BB31-7329 [0,1,0,1,0,0|2,0,0]=4 274 B12R2.24 ClC1=NC2=CC=CC=C2SC1 BB52-6511 [0,1,0,1,0,0|1,1,0]=4 275 B12R2.24 NC1COC2=C(C=CC=C2)C1 BB31-4949 [0,1,0,1,0,0|1,0,1]=4 276 B12R2.24 O=C1COC2=C(C=NC=C2)N1 BB31-0297 [0,1,0,1,0,0|1,0,0]=3 277 B12R2.24 OC1=CC2=C(C=C1)NCCO2 BB31-9145 [0,1,0,1,0,0|2,0,0]=4 278 B12R2.24 OC1=CC2=C(C=C1)OCCC2 BB31-6047 [0,1,0,1,0,0|1,0,1]=4 279 B12R2.132 CC1=NOC2=C1C=C(N)C=C2 BB31-6723 [0,1,0,1,0,0|2,0,0]=4 280 B12R2.132 CN1C=CC2=C1C=C(N)C=C2 BB31-6035 [0,1,0,1,0,0|2,0,0]=4 281 B12R2.132 CN1N=CC2=C1C=C(F)C=C2 BB31-7761 [0,1,0,1,0,0|2,0,0]=4 282 B12R2.132 CN1N=CC2=C1C=C(O)C=C2 BB31-8890 [0,1,0,1,0,0|2,0,0]=4 283 B12R2.132 ClC1=NOC2=C1C=C(Br)C=C2 BB32-1945 [0,1,0,1,0,0|2,0,0]=4 284 B12R2.132 NC1=CC2=C(C=C1)ONC2=O BB31-6927 [0,1,0,1,0,0|1,0,0]=3 285 B12R2.132 NC1=NOC2=C1C=C(F)C=C2 BB31-6648 [0,1,0,1,0,0|2,0,0]=4 286 B12R2.132 NC1COC2=C1C=C(Cl)C=C2 BB31-6960 [0,1,0,1,0,0|1,0,1]=4 287 B12R2.132 O=C1CCC2=C1N=C(Cl)C=C2 BB31-0617 [0,1,0,1,0,0|2,0,0]=4 288 B12R2.132 O=C1CCC2=NC=C(Br)C=C12 BB31-1351 [0,1,0,1,0,0|2,0,0]=4 289 B12R2.132 O=C1N=CC2=C1C=C(I)C=C2 BB31-7444 [0,1,0,1,0,0|2,0,0]=4 290 B12R2.132 O=C1NOC2=C1C=C(Br)C=C2 BB32-3739 [0,1,0,1,0,0|1,0,0]=3 291 B12R2.612 CC1=CC2=C(C=C1)C(=O)OC2 BB32-2730 [0,1,0,1,0,0|2,0,0]=4 292 B12R2.612 CC1=COC2=C1C=CC(Br)=C2 BB32-1861 [0,1,0,1,0,0|1,0,1]=4 293 B12R2.612 CC1=NOC2=C1C=CC(Br)=C2 BB31-4871 [0,1,0,1,0,0|2,0,0]=4 294 B12R2.612 CN1C=CC2=C1C=CC(O)=C2 BB31-8353 [0,1,0,1,0,0|2,0,0]=4 295 B12R2.612 CN1N=CC2=C1C=CC(I)=C2 BB31-7872 [0,1,0,1,0,0|2,0,0]=4 296 B12R2.612 CN1N=CC2=C1C=CC(O)=C2 BB31-5255 [0,1,0,1,0,0|2,0,0]=4 297 B12R2.612 ClC1=NOC2=C1C=CC(Br)=C2 BB31-1043 [0,1,0,1,0,0|2,0,0]=4 298 B12R2.612 NC1COC2=C1C=CC(Br)=C2 BB31-2188 [0,1,0,1,0,0|1,0,1]=4 299 B12R2.612 NC1COC2=C1C=CC(Br)=C2 BB31-7379 [0,1,0,1,0,0|1,0,1]=4 300 B12R2.612 O=C1CCC2=C1C=CC(Cl)=N2 BB31-9320 [0,1,0,1,0,0|2,0,0]=4 301 B12R2.612 O=C1COC2=C1C=CC(F)=C2 BB31-6050 [0,1,0,1,0,0|0,0,0]=2 302 B12R2.612 O=C1NNC2=C1C=CC(F)=C2 BB31-6674 [0,1,0,1,0,0|2,0,0]=4 303 B12R2.612 O=C1NOC2=C1C=CC(F)=C2 BB31-6322 [0,1,0,1,0,0|1,0,0]=3 304 B12R2.1 BrCC1=NOC2=C1C=CC=C2 BB51-1493 [0,1,0,1,0,0|2,0,0]=4 305 B12R2.1 CCN1C=CC2=C1C=CC=C2 BB31-8973 [0,1,0,1,0,0|2,0,0]=4 306 B12R2.18 CC1=C(C)C2=C(C=CC=C2)O1 BB32-1322 [0,1,0,1,0,0|1,0,0]=3 307 B12R2.18 CN1C(=O)CC2=C1N=CC=C2 BB31-2974 [0,1,0,1,0,0|2,0,0]=4 308 B12R2.18 O=C1SC2=C(C=CC=C2)C1=O BB31-7685 [0,1,0,1,0,0|0,1,1]=4 309 B12R2.315 CCC1=C2NC=CC2=CC=C1 BB31-6072 [0,1,0,1,0,0|2,0,0]=4 310 B12R2.315 COC1=C2C=NNC2=CC=C1 BB51-3311 [0,1,0,1,0,0|1,0,0]=3 311 B12R2.315 COC1=C2CCNC2=CC=C1 BB31-7002 [0,1,0,1,0,0|1,0,1]=4 312 B12R2.315 COC1=C2CCNC2=CC=C1 BB31-7398 [0,1,0,1,0,0|1,0,1]=4 313 B12R2.315 COC1=C2NC=CC2=NC=C1 BB31-7716 [0,1,0,1,0,0|2,0,0]=4 314 B12R2.315 COC1=C2NN=CC2=CC=C1 BB31-6075 [0,1,0,1,0,0|2,0,0]=4 315 B12R2.315 COC1=C2OC=CC2=CC=C1 BB31-4762 [0,1,0,1,0,0|1,0,0]=3 316 B12R2.315 NCC1=C2OCOC2=CC=C1 BB31-3606 [0,1,0,1,0,0|1,0,1]=4 317 B12R2.315 O=CC1=C2CCCC2=CC=C1 BB32-2800 [0,1,0,1,0,0|1,0,0]=3 318 B12R2.315 O=CC1=C2CCOC2=CC=C1 BB31-4137 [0,1,0,1,0,0|1,0,0]=3 319 B12R2.315 O=CC1=C2SC=NC2=CC=C1 BB31-2819 [0,1,0,1,0,0|0,1,1]=4 320 B12R2.315 O=CC1=CC=CC2=C1C=CS2 BB31-0190 [0,1,0,1,0,0|1,0,1]=4 321 B12R2.1081 BrC1=C2OCCCC2=CC=C1 BB32-2036 [0,1,0,1,0,0|1,0,1]=4 322 B12R2.1081 BrC1=C2OCCNC2=CC=C1 BB31-6078 [0,1,0,1,0,0|2,0,0]=4 323 B12R2.1081 CC1=NC=NC2=CC=CC=C21 BB31-7295 [0,1,0,1,0,0|2,0,0]=4 324 B12R2.1081 NC1=CC=CC2=C1CCCO2 BB32-2814 [0,1,0,1,0,0|1,0,1]=4 325 B12R2.1081 NC1=CC=CC2=C1OCCN2 BB31-7343 [0,1,0,1,0,0|2,0,0]=4 326 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 BB31-4049 [0,1,0,1,0,0|1,0,1]=4 327 B12R2.1081 O=C1CCCC2=C1C=CN=C2 BB31-7974 [0,1,0,1,0,0|2,0,0]=4 328 B12R2.1081 O=C1CCOC2=C1C=NC=C2 BB31-7283 [0,1,0,1,0,0|1,0,0]=3 329 B12R2.1081 O=C1CCOC2=CC=CN=C12 BB31-7810 [0,1,0,1,0,0|1,0,0]=3 330 B12R2.1081 O=C1COCC2=C1C=CC=C2 BB31-4135 [0,1,0,1,0,0|0,0,0]=2 331 B12R2.1081 OC1COCC2=C1C=CC=C2 BB31-4134 [0,1,0,1,0,0|0,0,2]=4 332 B12R2.2048 O=CC1=C(C2CC2)C=CC=C1 BB32-0977 [0,1,0,1,0,0|1,0,0]=3 333 B12R2.2028 NC1CC(=O)C2=C1C=CC=C2 BB32-0444 [0,1,0,1,0,0|1,0,0]=3 334 B12R2.196 CC1=CC=CC2=C1OCC2=O BB31-6076 [0,1,0,1,0,0|0,0,0]=2 335 B12R2.196 NC1=NOC2=C(Br)C=CC=C12 BB31-1498 [0,1,0,1,0,0|2,0,0]=4 336 B12R2.196 O=C1COC2=C(Br)C=CC=C12 BB31-4960 [0,1,0,1,0,0|0,0,0]=2 337 B12R2.196 OC1COC2=C(Br)C=CC=C21 BB31-2504 [0,1,0,1,0,0|0,0,2]=4 338 B12R2.203 CN1N=CC2=CC=CC(F)=C21 BB31-6073 [0,1,0,1,0,0|2,0,0]=4 339 B12R2.203 NC1=C2C(=O)CCC2=CC=C1 BB32-3302 [0,1,0,1,0,0|1,0,0]=3 340 B12R2.203 NC1=C2C(=O)NCC2=CC=C1 BB31-3386 [0,1,0,1,0,0|2,0,0]=4 341 B12R2.203 N[C@@H]1COC2=CC=CC(F)=C21 BB32-0139 [0,1,0,1,0,0|1,0,1]=4 342 B12R2.203 O=C1NNC2=CC=CC(Br)=C12 BB31-5904 [0,1,0,1,0,0|2,0,0]=4 343 B12R2.203 O=C1NOC2=CC=CC(F)=C12 BB31-3688 [0,1,0,1,0,0|1,0,0]=3 344 B12R2.203 O=C1OCC2=CC=CC(F)=C12 BB32-1211 [0,1,0,1,0,0|2,0,0]=4 345 B8R1.11 C(=O)C1=C(C)C=NN1 BB05-4543 [1,0,0,0,1,0|2,0,0]=4 346 B8R1.11 CC1=CSC=C1C=O BB32-4004 [1,0,0,0,1,0|1,0,0]=3 347 B8R1.11 CN1C=CN=C1C=O BB52-0221 [1,0,0,0,1,0|2,0,0]=4