0 B10R1.10 CCCC1=CC=CC(Br)=C1 BB31-3877 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.10 CCCC1=CC=CC(F)=C1 BB31-4486 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.10 CCOC1=CC(Br)=NC=C1 BB32-0438 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.10 CCOC1=CC=CC(S)=C1 BB31-5788 [0,0,0,0,0,0|2,1,0]=3 4 B10R1.10 CCOC1=CN=CC(N)=C1 BB32-2544 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.10 CCOC1=NC=CC(Br)=C1 BB32-3242 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.10 COCC1=CC(Br)=NC=C1 BB31-1862 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.10 N#CCC1=CC=CC(Br)=N1 BB31-8916 [0,0,0,0,0,0|2,0,2]=4 8 B10R1.10 N#CCC1=NC=CC(Br)=C1 BB32-1067 [0,0,0,0,0,0|2,0,2]=4 9 B10R1.10 NOCC1=CC=CC(Cl)=C1 BB31-4564 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.10 NOCC1=CC=CC(F)=C1 BB32-2410 [0,0,0,0,0,0|2,0,0]=2 11 B9R1.2 C=CC1=CC=CC(N)=C1 BB31-5821 [1,0,0,0,0,0|1,0,2]=4 12 B9R1.2 CC1=CC(CN)=NC=C1 BB31-1290 [1,0,0,0,0,0|2,0,0]=3 13 B9R1.2 CC1=CC(CO)=NC=C1 BB32-1316 [1,0,0,0,0,0|3,0,0]=4 14 B9R1.2 CC1=CC=CC(CN)=N1 BB31-6651 [1,0,0,0,0,0|2,0,0]=3 15 B9R1.2 CC1=NC=CC(CN)=N1 BB55-8307 [1,0,0,0,0,0|3,0,0]=4 16 B9R1.2 CCC1=CC(Br)=CN=C1 BB31-9522 [1,0,0,0,0,0|2,0,0]=3 17 B9R1.2 CCC1=CC(Cl)=NC=C1 BB32-1661 [1,0,0,0,0,0|2,0,0]=3 18 B9R1.2 CCC1=CN=CC(N)=C1 BB31-9128 [1,0,0,0,0,0|2,0,0]=3 19 B9R1.2 CCC1=NC(C)=CN=C1 BB31-5678 [1,0,0,0,0,0|3,0,0]=4 20 B9R1.2 CCC1=NC=CC(N)=C1 BB32-2549 [1,0,0,0,0,0|2,0,0]=3 21 B9R1.2 CNC1=CC(Br)=CN=C1 BB31-5210 [1,0,0,0,0,0|3,0,0]=4 22 B9R1.2 CNC1=CC=CC(F)=N1 BB32-1917 [1,0,0,0,0,0|3,0,0]=4 23 B9R1.2 CNC1=CC=CC(I)=C1 BB32-3582 [1,0,0,0,0,0|2,0,0]=3 24 B9R1.2 CNC1=CC=CC(O)=C1 BB31-2612 [1,0,0,0,0,0|1,0,0]=2 25 B9R1.2 CNC1=NC=CC(Cl)=C1 BB32-3907 [1,0,0,0,0,0|3,0,0]=4 26 B9R1.2 COC1=CC(=O)NC=C1 BB32-2174 [1,0,0,0,0,0|2,0,1]=4 27 B9R1.2 COC1=CC(I)=CN=C1 BB31-5800 [1,0,0,0,0,0|3,0,0]=4 28 B9R1.2 FC1=NC=CC(CBr)=C1 BB32-3508 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.2 FC1=NC=CC(CCl)=C1 BB32-0849 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.2 NC1=NC=CC(CO)=C1 BB52-8583 [1,0,0,0,0,0|3,0,0]=4 31 B9R1.2 NCC1=CC(Br)=NC=C1 BB31-6738 [1,0,0,0,0,0|2,0,0]=3 32 B9R1.2 NCC1=CC(F)=CN=C1 BB31-4246 [1,0,0,0,0,0|2,0,0]=3 33 B9R1.2 NCC1=CC=CC(Cl)=N1 BB31-2965 [1,0,0,0,0,0|2,0,0]=3 34 B9R1.2 NCC1=CC=CC(Cl)=N1 BB32-0593 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.2 NCC1=CC=CC(F)=N1 BB31-1286 [1,0,0,0,0,0|2,0,0]=3 36 B9R1.2 NCC1=CC=CC(N)=N1 BB31-3343 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.2 NNC1=CC(Br)=CN=C1 BB31-9829 [1,0,0,0,0,0|3,0,0]=4 38 B9R1.2 O=CC1=CN=CC(O)=C1 BB31-6018 [1,0,0,0,0,0|2,0,1]=4 39 B9R1.2 OCC1=CC(Br)=CN=C1 BB31-7619 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.8 CCNC1=NC=CC=C1 BB31-5587 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.8 CNCC1=CC=NC=C1 BB52-3970 [1,0,0,0,0,0|3,0,0]=4 42 B9R1.8 NNCC1=NC=CC=C1 BB32-1215 [1,0,0,0,0,0|2,0,0]=3 43 B9R1.8 N\N=C\C1=CC=CC=C1 BB32-2520 [1,0,0,0,0,0|1,0,1]=3 44 B9R1.8 OCCC1=CN=CN=C1 BB31-8537 [1,0,0,0,0,0|3,0,0]=4 45 B11R1.13 CC1=C(I)C=CC=C1CC#N BB31-1517 [0,1,0,0,0,0|1,0,2]=4 46 B11R1.13 CCOC1=C(N)C(N)=CC=C1 BB31-4009 [0,1,0,0,0,0|3,0,0]=4 47 B11R1.23 CNC(=O)C1=CC(O)=CC=C1 BB31-3025 [0,1,0,0,0,0|2,0,1]=4 48 B11R1.23 NC(CO)C1=CC=CC(Cl)=C1 BB31-3734 [0,1,0,0,0,0|2,0,0]=3 49 B11R1.23 NCC(=O)C1=CC=CC(Br)=C1 BB31-5650 [0,1,0,0,0,0|1,0,1]=3 50 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 BB31-9590 [0,1,0,0,0,0|2,0,0]=3 51 B11R1.23 N[C@H](CO)C1=CC=CC(Br)=C1 BB31-4154 [0,1,0,0,0,0|2,0,0]=3 52 B11R1.23 N[C@H](CO)C1=CC=CC(F)=C1 BB32-0148 [0,1,0,0,0,0|2,0,0]=3 53 B11R1.23 N[C@H](CO)C1=CC=CC(F)=C1 BB32-1793 [0,1,0,0,0,0|2,0,0]=3 54 B11R1.24 CC1=CC=CC(NCCO)=C1 BB17-0632 [0,1,0,0,0,0|2,0,0]=3 55 B11R1.24 COCCC1=CC(O)=CC=C1 BB32-1678 [0,1,0,0,0,0|1,0,0]=2 56 B11R1.24 N#CCCC1=CC=CC(F)=C1 BB32-0937 [0,1,0,0,0,0|1,0,1]=3 57 B11R1.24 NCCCC1=CC=CC(Br)=C1 BB31-3431 [0,1,0,0,0,0|1,0,0]=2 58 B11R1.24 O=CCCC1=CC=CC(Br)=C1 BB31-4155 [0,1,0,0,0,0|2,0,0]=3 59 B11R1.24 OCCCC1=CC=CC(Br)=C1 BB32-3048 [0,1,0,0,0,0|2,0,0]=3 60 B11R1.24 OCCCC1=CC=CC(Cl)=C1 BB31-4195 [0,1,0,0,0,0|2,0,0]=3 61 B11R1.24 OCCCC1=CC=CC(F)=C1 BB31-2996 [0,1,0,0,0,0|2,0,0]=3 62 B11R1.34 CCCC1=CC(O)=CC(O)=C1 BB31-7608 [0,1,0,0,0,0|1,0,0]=2 63 B11R1.34 NNCC1=CC(F)=CC(F)=C1 BB32-0514 [0,1,0,0,0,0|2,0,0]=3 64 B11R1.157 CC(C)NC1=CC=CC(Cl)=C1 BB32-1278 [0,1,0,0,0,0|3,0,0]=4 65 B11R1.157 CC(C)NC1=CC=CC(F)=C1 BB31-8175 [0,1,0,0,0,0|3,0,0]=4 66 B11R1.157 CC1=CC=CC(NC(C)C)=C1 BB31-0290 [0,1,0,0,0,0|3,0,0]=4 67 B11R1.157 NC(=O)NC1=CC=CC(Br)=C1 BB31-5775 [0,1,0,0,0,0|2,0,1]=4 68 B11R1.182 CCOC1=C(O)C=CC(Br)=C1 BB32-1746 [0,1,0,0,0,0|3,0,0]=4 69 B11R1.182 CNCC1=C(O)C=CC(F)=C1 BB31-1974 [0,1,0,0,0,0|3,0,0]=4 70 B11R1.189 CCNC1=CC=CC(C#N)=C1 BB31-6524 [0,1,0,0,0,0|3,0,0]=4 71 B11R1.189 COC1=CC=CC(CC=O)=C1 BB32-3005 [0,1,0,0,0,0|1,0,1]=3 72 B11R1.189 COC1=CC=CC(CON)=C1 BB32-1643 [0,1,0,0,0,0|1,0,0]=2 73 B11R1.189 COC1=NC(CC#N)=CC=C1 BB31-0027 [0,1,0,0,0,0|1,0,2]=4 74 B11R1.189 COC1=NC=CC(CC#N)=C1 BB31-7192 [0,1,0,0,0,0|1,0,2]=4 75 B11R1.192 CCOC1=CC(N)=C(Br)C=C1 BB12-5194 [0,1,0,0,0,0|3,0,0]=4 76 B11R1.192 CCOC1=CC(N)=C(Cl)C=C1 BB12-5195 [0,1,0,0,0,0|3,0,0]=4 77 B11R1.192 CCOC1=CC(N)=C(I)C=C1 BB12-5193 [0,1,0,0,0,0|3,0,0]=4 78 B11R1.192 FC1=C(Cl)C=C(CCBr)C=C1 BB31-1487 [0,1,0,0,0,0|2,0,0]=3 79 B11R1.192 OCCC1=CC(F)=C(Cl)C=C1 BB31-4082 [0,1,0,0,0,0|2,0,0]=3 80 B11R2.35 BrC1=CN=CC(C2CC2)=C1 BB31-5006 [0,0,0,1,0,0|3,0,0]=4 81 B11R2.35 ClC1=CC([C@@H]2CO2)=CC=C1 BB31-5402 [0,0,0,1,0,0|2,0,0]=3 82 B11R2.35 NC1=CC(C2CC2)=NC=C1 BB32-2145 [0,0,0,1,0,0|3,0,0]=4 83 B11R2.35 OC1=CC(C2CC2)=CC=C1 BB31-4514 [0,0,0,1,0,0|1,0,0]=2 84 B11R2.36 BrC1=CC2=C(C=C1)CCC2 BB32-3362 [0,0,0,1,0,0|2,0,0]=3 85 B11R2.36 BrC1=CC2=C(C=C1)COC2 BB32-1135 [0,0,0,1,0,0|3,0,0]=4 86 B11R2.36 BrC1=CC2=C(C=CC2)C=C1 BB31-4988 [0,0,0,1,0,0|2,0,1]=4 87 B11R2.36 CC1=CC2=C(C=C1)CCN2 BB31-6620 [0,0,0,1,0,0|3,0,0]=4 88 B11R2.36 CC1=CC=C2NN=CC2=C1 BB51-3313 [0,0,0,1,0,0|2,0,1]=4 89 B11R2.36 ClC1=CC2=C(C=C1)CCN2 BB31-6044 [0,0,0,1,0,0|3,0,0]=4 90 B11R2.36 ClC1=CC2=C(C=C1)CCO2 BB31-4520 [0,0,0,1,0,0|3,0,0]=4 91 B11R2.36 ClC1=CC=C2NN=CC2=C1 BB51-3314 [0,0,0,1,0,0|2,0,1]=4 92 B11R2.36 ClC1=NC=C2NCCC2=C1 BB31-1364 [0,0,0,1,0,0|2,0,0]=3 93 B11R2.36 IC1=CC2=C(C=C1)CCN2 BB31-0658 [0,0,0,1,0,0|3,0,0]=4 94 B11R2.36 NC1=CC2=C(C=C1)CCO2 BB32-3369 [0,0,0,1,0,0|3,0,0]=4 95 B11R2.36 NC1=CC2=C(C=C1)OCO2 BB31-4396 [0,0,0,1,0,0|3,0,0]=4 96 B11R2.36 OC1=CC2=C(C=C1)C=NO2 BB52-6184 [0,0,0,1,0,0|3,0,0]=4 97 B11R2.36 OC1=CC2=C(C=C1)CCN2 BB32-2364 [0,0,0,1,0,0|2,0,0]=3 98 B11R2.36 OC1=CC2=C(C=C1)CCO2 BB31-4258 [0,0,0,1,0,0|2,0,0]=3 99 B11R2.36 OC1=CC2=C(C=C1)OC=N2 BB32-0783 [0,0,0,1,0,0|2,0,1]=4 100 B11R2.36 OC1=CC2=C(C=C1)SC=C2 BB32-0598 [0,0,0,1,0,0|1,0,2]=4 101 B11R2.36 OC1=CC2=C(C=C1)SC=N2 BB31-4836 [0,0,0,1,0,0|2,0,1]=4 102 B11R2.36 OC1=CC2=C(C=CO2)C=C1 BB31-1913 [0,0,0,1,0,0|2,0,1]=4 103 B11R2.106 BrC1=C2CCCC2=CC=C1 BB31-5049 [0,0,0,1,0,0|2,0,0]=3 104 B11R2.106 BrC1=C2NCCC2=CC=C1 BB32-3116 [0,0,0,1,0,0|1,0,0]=2 105 B11R2.106 CC1=CC=CC2=C1CCN2 BB31-5953 [0,0,0,1,0,0|3,0,0]=4 106 B11R2.106 CC1=CC=CC2=C1NC=N2 BB31-2558 [0,0,0,1,0,0|2,0,1]=4 107 B11R2.106 ClC1=C2NC=NC2=CC=C1 BB52-4226 [0,0,0,1,0,0|2,0,1]=4 108 B11R2.106 ClC1=CC=CC2=C1NN=N2 BB52-5333 [0,0,0,1,0,0|3,0,0]=4 109 B11R2.106 FC1=C2NCCC2=CC=C1 BB31-6939 [0,0,0,1,0,0|1,0,0]=2 110 B11R2.106 IC1=C2OCOC2=CC=C1 BB31-8623 [0,0,0,1,0,0|3,0,0]=4 111 B11R2.106 NC1=CC=CC2=C1CCN2 BB32-2884 [0,0,0,1,0,0|3,0,0]=4 112 B11R2.106 NC1=CC=CC2=C1COC2 BB31-5886 [0,0,0,1,0,0|3,0,0]=4 113 B11R2.106 OC1=C2CCNC2=NC=C1 BB31-3599 [0,0,0,1,0,0|3,0,0]=4 114 B11R2.106 OC1=C2N=NNC2=CC=C1 BB31-5942 [0,0,0,1,0,0|2,0,1]=4 115 B11R2.106 OC1=C2OC=CC2=CC=C1 BB32-2267 [0,0,0,1,0,0|1,0,2]=4 116 B11R2.106 OC1=CC=CC2=C1CCO2 BB31-2818 [0,0,0,1,0,0|2,0,0]=3 117 B11R2.106 OC1=CC=CC2=C1N=CO2 BB31-8021 [0,0,0,1,0,0|1,0,2]=4 118 B9R1.7 CC1=CC(CCN)=CS1 BB51-2715 [0,0,0,0,1,0|2,0,0]=3 119 B9R1.7 CC1=CN(CCN)N=C1 BB52-9452 [0,0,0,0,1,0|3,0,0]=4 120 B9R1.7 CC1=CN=C(CCN)S1 BB55-8357 [0,0,0,0,1,0|3,0,0]=4 121 B9R1.33 CC1=CSC=C1CCN BB51-2716 [0,0,0,0,1,0|2,0,0]=3 122 B8R1.2 NCC1=CC=NC=C1 BB32-3106 [2,0,0,0,0,0|1,0,0]=3 123 B8R1.2 NCC1=CN=NC=C1 BB31-7658 [2,0,0,0,0,0|2,0,0]=4 124 B8R1.2 NNC1=NC=CC=C1 BB52-0908 [2,0,0,0,0,0|2,0,0]=4 125 B8R1.4 CC1=NC=CC(F)=C1 BB31-5027 [2,0,0,0,0,0|2,0,0]=4 126 B8R1.4 NC1=CC(I)=CN=C1 BB31-6019 [2,0,0,0,0,0|2,0,0]=4 127 B10R1.2 CN1C=CC=C(CN)C1=O BB20-0053 [1,1,0,0,0,0|2,0,0]=4 128 B10R1.2 CNC1=CC=CC(Br)=C1N BB31-0621 [1,1,0,0,0,0|2,0,0]=4 129 B10R1.2 COC1=C(Cl)C(N)=CC=C1 BB31-6645 [1,1,0,0,0,0|2,0,0]=4 130 B10R1.2 COC1=C(N)C(O)=CC=C1 BB31-4933 [1,1,0,0,0,0|1,0,0]=3 131 B10R1.2 COC1=CC=CC(F)=C1C BB31-8931 [1,1,0,0,0,0|2,0,0]=4 132 B10R1.2 COC1=CC=CC(F)=C1Cl BB32-2640 [1,1,0,0,0,0|2,0,0]=4 133 B10R1.2 COC1=CC=CC(I)=C1Br BB31-8698 [1,1,0,0,0,0|2,0,0]=4 134 B10R1.2 N#CC1=CC=CC(O)=C1Br BB31-4854 [1,1,0,0,0,0|0,0,2]=4 135 B10R1.2 N#CC1=CC=CC(O)=C1F BB31-0003 [1,1,0,0,0,0|0,0,2]=4 136 B10R1.2 N#CC1=CC=CC(O)=C1N BB31-4177 [1,1,0,0,0,0|0,0,2]=4 137 B10R1.2 NC1=C(Br)C=CC=C1CO BB32-1974 [1,1,0,0,0,0|2,0,0]=4 138 B10R1.2 NC1=C(C=O)C=CC=C1O BB31-0088 [1,1,0,0,0,0|1,0,1]=4 139 B10R1.2 NCC1=CC=CC(Br)=C1F BB31-4390 [1,1,0,0,0,0|1,0,0]=3 140 B10R1.2 OCC1=CC=CC(F)=C1Br BB31-8992 [1,1,0,0,0,0|2,0,0]=4 141 B10R1.2 OCC1=CC=CC(F)=C1I BB31-1529 [1,1,0,0,0,0|2,0,0]=4 142 B10R1.8 CC1=CC(Br)=CC(CO)=C1 BB32-3429 [1,1,0,0,0,0|2,0,0]=4 143 B10R1.8 CC1=CC(C=O)=CC(O)=C1 BB32-3309 [1,1,0,0,0,0|1,0,1]=4 144 B10R1.8 CC1=CC(O)=CC(C#N)=C1 BB31-7221 [1,1,0,0,0,0|0,0,2]=4 145 B10R1.8 CCC1=CC(O)=NC(N)=N1 BB52-6048 [1,1,0,0,0,0|2,0,0]=4 146 B10R1.8 NCC1=CC(Br)=CC(Br)=C1 BB32-0894 [1,1,0,0,0,0|1,0,0]=3 147 B10R1.8 NCC1=CC(Cl)=NC(Cl)=C1 BB31-8530 [1,1,0,0,0,0|2,0,0]=4 148 B10R1.8 OCC1=CC(I)=CC(Br)=C1 BB31-4060 [1,1,0,0,0,0|2,0,0]=4 149 B10R1.30 BrCC1=C(I)C=CC(Br)=C1 BB31-7669 [1,1,0,0,0,0|2,0,0]=4 150 B10R1.30 CC1=CC(CO)=C(Br)C=C1 BB32-3813 [1,1,0,0,0,0|2,0,0]=4 151 B10R1.30 CC1=CC(NN)=C(F)C=C1 BB32-1967 [1,1,0,0,0,0|2,0,0]=4 152 B10R1.30 CCC1=C(Br)C=CC(I)=C1 BB31-0423 [1,1,0,0,0,0|1,0,0]=3 153 B10R1.30 CCC1=C(O)C=CC(Br)=C1 BB31-3966 [1,1,0,0,0,0|1,0,0]=3 154 B10R1.30 COC1=C(C)C=CC(I)=C1 BB32-1094 [1,1,0,0,0,0|2,0,0]=4 155 B10R1.30 COC1=C(C)C=CC(O)=C1 BB31-4015 [1,1,0,0,0,0|1,0,0]=3 156 B10R1.30 COC1=C(I)C=CC(C)=C1 BB31-7787 [1,1,0,0,0,0|2,0,0]=4 157 B10R1.30 COC1=C(I)C=CC(N)=C1 BB31-9407 [1,1,0,0,0,0|2,0,0]=4 158 B10R1.30 COC1=C(N)C=CC(O)=C1 BB31-5893 [1,1,0,0,0,0|1,0,0]=3 159 B10R1.30 COC1=C(N)C=CC(O)=C1 BB31-5894 [1,1,0,0,0,0|1,0,0]=3 160 B10R1.30 N#CC1=C(N)C=CC(O)=C1 BB31-0452 [1,1,0,0,0,0|0,0,2]=4 161 B10R1.30 NCC1=C(N)C=CC(Br)=C1 BB31-8668 [1,1,0,0,0,0|1,0,0]=3 162 B10R1.30 OCC1=C(O)C=CC(I)=C1 BB31-9654 [1,1,0,0,0,0|2,0,0]=4 163 B10R1.113 CC(C)C1=CN=CC(N)=C1 BB31-1267 [1,1,0,0,0,0|2,0,0]=4 164 B10R1.113 CC(C)C1=NC=CC(Cl)=C1 BB31-7554 [1,1,0,0,0,0|2,0,0]=4 165 B10R1.113 CC(C)C1=NC=CC(N)=C1 BB32-2144 [1,1,0,0,0,0|2,0,0]=4 166 B10R1.113 CC(O)C1=CC=CC(Br)=N1 BB31-9694 [1,1,0,0,0,0|2,0,0]=4 167 B10R1.113 CC1=CC=CC([C@@H](C)N)=C1 BB31-0480 [1,1,0,0,0,0|1,0,0]=3 168 B10R1.113 CC1=CC=CC([C@@H](C)O)=C1 BB32-1902 [1,1,0,0,0,0|1,0,0]=3 169 B10R1.113 CC1=CC=CC([C@H](C)O)=C1 BB32-2691 [1,1,0,0,0,0|1,0,0]=3 170 B10R1.113 CN(C)C1=CC=CC(F)=C1 BB31-4166 [1,1,0,0,0,0|2,0,0]=4 171 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=C1 BB32-0142 [1,1,0,0,0,0|1,0,0]=3 172 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 BB31-7991 [1,1,0,0,0,0|1,0,0]=3 173 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 BB31-5432 [1,1,0,0,0,0|1,0,0]=3 174 B10R1.113 NC(=O)C1=CN=CC(O)=C1 BB31-0206 [1,1,0,0,0,0|1,0,1]=4 175 B10R1.113 NC(=S)C1=CC(N)=CC=C1 BB31-6919 [1,1,0,0,0,0|1,0,1]=4 176 B10R1.113 NC1=CC=CC(C(F)F)=C1 BB31-3122 [1,1,0,0,0,0|2,0,0]=4 177 B10R1.113 OC1=CC=CC(C(F)F)=C1 BB32-2098 [1,1,0,0,0,0|1,0,0]=3 178 B10R1.172 C#CC1=CC=CC(CN)=C1 BB32-3370 [1,1,0,0,0,0|1,0,0]=3 179 B10R1.172 C#CC1=CC=CC(SC)=C1 BB31-4172 [1,1,0,0,0,0|2,0,0]=4 180 B10R1.172 CCC1=CC=CC(CO)=N1 BB31-3213 [1,1,0,0,0,0|1,0,0]=3 181 B10R1.172 COC1=CC(CN)=NC=C1 BB31-9683 [1,1,0,0,0,0|1,0,0]=3 182 B10R1.172 COC1=CC=CC(CBr)=N1 BB31-2973 [1,1,0,0,0,0|2,0,0]=4 183 B10R1.172 COC1=CN=CC(CN)=C1 BB31-8845 [1,1,0,0,0,0|1,0,0]=3 184 B10R1.172 COC1=NC=CC(CCl)=C1 BB31-8195 [1,1,0,0,0,0|2,0,0]=4 185 B10R1.172 CSC1=CC(C=O)=CC=C1 BB31-7190 [1,1,0,0,0,0|1,0,1]=4 186 B10R1.172 O=CC1=CC(CO)=CC=C1 BB32-2221 [1,1,0,0,0,0|1,0,1]=4 187 B10R1.176 CC1=C(Cl)C=CC(CO)=C1 BB31-1720 [1,1,0,0,0,0|2,0,0]=4 188 B10R1.176 CC1=C(Cl)C=CC(NN)=C1 BB31-5250 [1,1,0,0,0,0|2,0,0]=4 189 B10R1.176 CCC1=CC(C)=C(C)C=C1 BB31-7435 [1,1,0,0,0,0|1,0,0]=3 190 B10R1.176 CCC1=CC(C)=C(N)C=C1 BB31-7084 [1,1,0,0,0,0|1,0,0]=3 191 B10R1.176 CCC1=CC(F)=C(Br)C=C1 BB31-7483 [1,1,0,0,0,0|1,0,0]=3 192 B10R1.176 CN1C=C(CN)C=CC1=O BB20-0050 [1,1,0,0,0,0|2,0,0]=4 193 B10R1.176 CNC1=CC(Cl)=C(C)C=C1 BB32-2051 [1,1,0,0,0,0|2,0,0]=4 194 B10R1.176 COC1=CC(O)=C(Cl)C=C1 BB31-3552 [1,1,0,0,0,0|1,0,0]=3 195 B10R1.176 COC1=CC(O)=C(O)C=C1 BB32-1848 [1,1,0,0,0,0|1,0,0]=3 196 B10R1.176 N#CC1=CC(O)=C(N)C=C1 BB31-4709 [1,1,0,0,0,0|0,0,2]=4 197 B10R1.176 NC1=C(O)C=CC(CO)=C1 BB32-2829 [1,1,0,0,0,0|2,0,0]=4 198 B10R1.176 NCC1=CC=C(Cl)C(Cl)=N1 BB31-1272 [1,1,0,0,0,0|2,0,0]=4 199 B10R1.176 OCC1=CC(O)=C(O)C=C1 BB31-5748 [1,1,0,0,0,0|1,0,0]=3 200 B10R1.1 C=CCC1=CC=C(O)C=C1 BB31-5055 [1,1,0,0,0,0|1,0,1]=4 201 B10R1.1 CC1=CC=C(SCCl)C=C1 BB31-6111 [1,1,0,0,0,0|2,0,0]=4 202 B10R1.1 CC1=NC=C(CCO)C=C1 BB31-0061 [1,1,0,0,0,0|2,0,0]=4 203 B10R1.1 CSCC1=CC=C(F)C=C1 BB32-3225 [1,1,0,0,0,0|2,0,0]=4 204 B10R1.1 OCCC1=CN=C(Cl)C=C1 BB31-8395 [1,1,0,0,0,0|2,0,0]=4 205 B10R1.1 OCCC1=NC=C(Br)C=C1 BB31-8160 [1,1,0,0,0,0|2,0,0]=4 206 B10R1.4 CC1=C(CON)C=CC=C1 BB31-8696 [1,1,0,0,0,0|1,0,0]=3 207 B10R1.4 CCNC1=C(O)C=CC=C1 BB31-4887 [1,1,0,0,0,0|2,0,0]=4 208 B10R1.4 CNCC1=C(O)C=CC=C1 BB31-5689 [1,1,0,0,0,0|2,0,0]=4 209 B10R1.4 NOCC1=C(Cl)C=CC=C1 BB32-2623 [1,1,0,0,0,0|1,0,0]=3 210 B10R1.4 OCCC1=C(I)C=CC=C1 BB31-4375 [1,1,0,0,0,0|1,0,0]=3 211 B10R1.15 C=C(CC)C1=CC=CC=C1 BB31-3793 [1,1,0,0,0,0|1,0,1]=4 212 B10R1.15 CCC(N)C1=CC=CN=C1 BB31-0914 [1,1,0,0,0,0|2,0,0]=4 213 B10R1.15 C[C@@H](CO)C1=CC=CC=C1 BB31-4000 [1,1,0,0,0,0|1,0,0]=3 214 B10R1.15 C[C@H](CO)C1=CC=CC=C1 BB31-5425 [1,1,0,0,0,0|1,0,0]=3 215 B10R1.15 NC(CO)C1=NC=CC=C1 BB31-5647 [1,1,0,0,0,0|2,0,0]=4 216 B10R1.17 CCCCC1=CC=CN=C1 BB31-4701 [1,1,0,0,0,0|2,0,0]=4 217 B10R1.17 ClCCSC1=NC=CC=C1 BB52-9581 [1,1,0,0,0,0|2,0,0]=4 218 B10R1.17 NCCCC1=CC=CN=C1 BB31-5719 [1,1,0,0,0,0|1,0,0]=3 219 B10R1.17 NCCNC1=NC=CC=C1 BB52-8028 [1,1,0,0,0,0|1,0,0]=3 220 B10R1.17 NCCOC1=CC=NC=C1 BB32-2674 [1,1,0,0,0,0|1,0,0]=3 221 B10R1.17 NCCOC1=NC=CC=C1 BB31-4550 [1,1,0,0,0,0|1,0,0]=3 222 B10R1.17 NCCSC1=NC=CC=C1 BB52-8924 [1,1,0,0,0,0|1,0,0]=3 223 B10R1.17 OCCSC1=NC=CC=C1 BB52-9072 [1,1,0,0,0,0|2,0,0]=4 224 B10R1.18 CC(C)CC1=NC=CC=C1 BB31-5691 [1,1,0,0,0,0|2,0,0]=4 225 B10R1.18 N=C(N)CC1=CC=CN=C1 BB52-5807 [1,1,0,0,0,0|1,0,1]=4 226 B10R1.18 N=C(N)CC1=NC=CC=C1 BB52-5801 [1,1,0,0,0,0|1,0,1]=4 227 B10R1.16 CC1=CC=C(CCCN)S1 BB31-0033 [0,1,0,0,1,0|2,0,0]=4 228 B12R1.225 CC(C)[C@@H](N)C1=CC=CC(Cl)=C1 BB31-9733 [0,2,0,0,0,0|2,0,0]=4 229 B12R1.367 NC(CO)C1=CC(Cl)=C(Cl)C=C1 BB32-0657 [0,2,0,0,0,0|2,0,0]=4 230 B12R1.367 N[C@H](CO)C1=CC(F)=C(F)C=C1 BB32-0133 [0,2,0,0,0,0|2,0,0]=4 231 B12R1.367 OC(CCl)C1=CC(F)=C(F)C=C1 BB32-2905 [0,2,0,0,0,0|2,0,0]=4 232 B12R1.367 OC[C@H](O)C1=CC(F)=C(Cl)C=C1 BB32-0387 [0,2,0,0,0,0|2,0,0]=4 233 B12R1.435 COC1=CC=CC(C(=O)CN)=C1 BB31-7626 [0,2,0,0,0,0|0,0,1]=3 234 B12R1.28 NCCCOC1=CC=CC(Cl)=C1 BB31-0484 [0,2,0,0,0,0|1,0,0]=3 235 B12R1.28 NCCCOC1=CC=CC(F)=C1 BB31-0485 [0,2,0,0,0,0|1,0,0]=3 236 B12R1.382 N#CC1=CC=CC(OCCBr)=C1 BB32-1251 [0,2,0,0,0,0|2,0,0]=4 237 B12R1.41 COC1=CC(CC#N)=CC(Br)=C1 BB31-9810 [0,2,0,0,0,0|0,0,2]=4 238 B12R1.279 O=C(O)C1=CC(CCO)=CC=C1 BB32-1360 [0,2,0,0,0,0|1,0,0]=3 239 B12R1.279 O=C(O)C1=NC=CC(CCO)=C1 BB32-2791 [0,2,0,0,0,0|2,0,0]=4 240 B12R1.279 OCCC1=CC(B(O)O)=CC=C1 BB32-3034 [0,2,0,0,0,0|1,0,0]=3 241 B10R1.21 NCCNCC1=CC=CO1 BB52-9675 [0,0,1,1,0,0|1,0,1]=4 242 B10R2.7 C1=CC2=C(C=C1)SCS2 BB32-1488 [1,0,0,1,0,0|2,0,0]=4 243 B10R2.7 C1=CC2=C(C=N1)CCN2 BB31-4247 [1,0,0,1,0,0|1,0,0]=3 244 B10R2.7 C1=CC2=C(C=N1)CCN2 BB32-3376 [1,0,0,1,0,0|1,0,0]=3 245 B10R2.7 C1=CC2=C(C=N1)NCC2 BB31-4675 [1,0,0,1,0,0|1,0,0]=3 246 B10R2.7 C1=CN=C2CCNC2=C1 BB31-9759 [1,0,0,1,0,0|1,0,0]=3 247 B10R2.7 C1=CN=C2CCNC2=C1 BB32-0564 [1,0,0,1,0,0|1,0,0]=3 248 B12R2.202 CC1CC2=CC=CC(N)=C2O1 BB31-4399 [0,1,0,1,0,0|2,0,0]=4 249 B12R2.202 OC1=CC=CC2=C1NC(=S)O2 BB31-5941 [0,1,0,1,0,0|1,0,1]=4 250 B12R2.1081 BrC1=C2CCCCC2=CC=C1 BB32-3385 [0,1,0,1,0,0|2,0,0]=4 251 B12R2.1081 BrC1=C2OCCCC2=CC=C1 BB32-2036 [0,1,0,1,0,0|2,0,0]=4 252 B12R2.1081 BrC1=C2OCCNC2=CC=C1 BB31-6078 [0,1,0,1,0,0|2,0,0]=4 253 B12R2.1081 ClC1=C2CCCNC2=CC=C1 BB31-5042 [0,1,0,1,0,0|2,0,0]=4 254 B12R2.1081 ClC1=C2CCNCC2=CC=C1 BB32-3696 [0,1,0,1,0,0|2,0,0]=4 255 B12R2.1081 ClC1=C2CCNCC2=CC=C1 BB32-3914 [0,1,0,1,0,0|2,0,0]=4 256 B12R2.1081 ClC1=C2CNCCC2=CC=C1 BB32-3999 [0,1,0,1,0,0|1,0,0]=3 257 B12R2.1081 ClC1=NC=CC2=C1NCCO2 BB31-1390 [0,1,0,1,0,0|2,0,0]=4 258 B12R2.1081 FC1=C2CCNCC2=CC=C1 BB31-6943 [0,1,0,1,0,0|2,0,0]=4 259 B12R2.1081 NC1=CC=CC2=C1CCCO2 BB32-2814 [0,1,0,1,0,0|2,0,0]=4 260 B12R2.1081 NC1=CC=CC2=C1OCCN2 BB31-7343 [0,1,0,1,0,0|2,0,0]=4 261 B12R2.1081 OC1=C2CCNCC2=CC=C1 BB31-9142 [0,1,0,1,0,0|1,0,0]=3 262 B12R2.1081 OC1=C2CNCCC2=CC=C1 BB32-1666 [0,1,0,1,0,0|0,0,0]=2 263 B12R2.132 CC1=CNC2=C1C=C(O)C=C2 BB31-7869 [0,1,0,1,0,0|0,0,2]=4 264 B12R2.132 NC1CCC2=C1C=C(Cl)C=C2 BB32-3775 [0,1,0,1,0,0|2,0,0]=4 265 B12R2.132 NC1CCC2=C1C=C(F)C=C2 BB31-0781 [0,1,0,1,0,0|2,0,0]=4 266 B12R2.132 NC1COC2=C1C=C(Cl)C=C2 BB31-6960 [0,1,0,1,0,0|2,0,0]=4 267 B12R2.132 N[C@H]1CCC2=C1C=C(Br)C=C2 BB31-9837 [0,1,0,1,0,0|2,0,0]=4 268 B12R2.196 CC1=CC=CC2=C1CCC2O BB32-3812 [0,1,0,1,0,0|2,0,0]=4 269 B12R2.196 N[C@@H]1CCC2=C(Br)C=CC=C21 BB31-0904 [0,1,0,1,0,0|2,0,0]=4 270 B12R2.196 N[C@H]1CCC2=C(Br)C=CC=C21 BB31-0902 [0,1,0,1,0,0|2,0,0]=4 271 B12R2.196 N[C@H]1CCC2=C(Br)C=CC=C21 BB31-1669 [0,1,0,1,0,0|2,0,0]=4 272 B12R2.196 OC1COC2=C(Br)C=CC=C21 BB31-2504 [0,1,0,1,0,0|2,0,0]=4 273 B12R2.2313 BrC1=CC(C2COC2)=CC=C1 BB31-9459 [0,1,0,1,0,0|2,0,0]=4 274 B12R2.24 BrC1=CC2=C(C=C1)CCCO2 BB31-5223 [0,1,0,1,0,0|2,0,0]=4 275 B12R2.24 BrC1=CC2=C(C=C1)CCOC2 BB31-2894 [0,1,0,1,0,0|2,0,0]=4 276 B12R2.24 BrC1=CC=C2OCCNC2=C1 BB51-1687 [0,1,0,1,0,0|2,0,0]=4 277 B12R2.24 BrC1=NC2=C(C=C1)NCCC2 BB31-2296 [0,1,0,1,0,0|2,0,0]=4 278 B12R2.24 CC1=CC2=C(C=C1)CCNC2 BB31-4100 [0,1,0,1,0,0|2,0,0]=4 279 B12R2.24 CC1=CC2=C(C=C1)CNCC2 BB32-1895 [0,1,0,1,0,0|1,0,0]=3 280 B12R2.24 CC1=CC2=C(C=C1)NCCO2 BB32-3795 [0,1,0,1,0,0|1,0,0]=3 281 B12R2.24 CC1=CC2=C(C=C1)OCCN2 BB31-6981 [0,1,0,1,0,0|2,0,0]=4 282 B12R2.24 CC1=CC=C2OCCNC2=C1 BB51-1683 [0,1,0,1,0,0|2,0,0]=4 283 B12R2.24 ClC1=CC2=C(C=C1)CNCC2 BB31-7944 [0,1,0,1,0,0|1,0,0]=3 284 B12R2.24 ClC1=CC2=C(C=C1)OCCN2 BB31-7329 [0,1,0,1,0,0|2,0,0]=4 285 B12R2.24 ClC1=NC2=C(C=C1)CNCC2 BB31-4162 [0,1,0,1,0,0|2,0,0]=4 286 B12R2.24 NC1=CC2=C(C=C1)CNCC2 BB31-3465 [0,1,0,1,0,0|1,0,0]=3 287 B12R2.24 OC1=CC2=C(C=C1)CNCC2 BB32-3087 [0,1,0,1,0,0|0,0,0]=2 288 B12R2.24 OC1=CC2=C(C=C1)NCCO2 BB31-9145 [0,1,0,1,0,0|0,0,0]=2 289 B12R2.24 OC1=CC2=C(C=C1)OCCC2 BB31-6047 [0,1,0,1,0,0|1,0,0]=3 290 B12R2.24 OC1=CN=C2CCCCC2=C1 BB32-3495 [0,1,0,1,0,0|2,0,0]=4 291 B12R2.203 NC1=C2C(=O)CCC2=CC=C1 BB32-3302 [0,1,0,1,0,0|2,0,0]=4 292 B12R2.203 NC1CCC2=CC=CC(Br)=C21 BB31-9389 [0,1,0,1,0,0|1,0,0]=3 293 B12R2.203 N[C@@H]1COC2=CC=CC(F)=C21 BB32-0139 [0,1,0,1,0,0|1,0,0]=3 294 B12R2.612 CN1C=CC2=C1C=CC(O)=C2 BB31-8353 [0,1,0,1,0,0|0,0,2]=4 295 B12R2.612 CN1CCC2=C1C=CC(N)=C2 BB31-1016 [0,1,0,1,0,0|1,0,0]=3 296 B12R2.612 CN1N=CC2=C1C=CC(O)=C2 BB31-5255 [0,1,0,1,0,0|1,0,1]=4 297 B12R2.612 NC1CCC2=C1C=CC(Br)=C2 BB31-9391 [0,1,0,1,0,0|1,0,0]=3 298 B12R2.612 NC1CCC2=C1C=CC(Cl)=C2 BB31-7488 [0,1,0,1,0,0|1,0,0]=3 299 B12R2.612 NC1CCC2=C1C=CC(F)=C2 BB31-2856 [0,1,0,1,0,0|1,0,0]=3 300 B12R2.612 NC1COC2=C1C=CC(Br)=C2 BB31-2188 [0,1,0,1,0,0|1,0,0]=3 301 B12R2.612 NC1COC2=C1C=CC(Br)=C2 BB31-7379 [0,1,0,1,0,0|1,0,0]=3 302 B12R2.612 N[C@@H]1CCC2=C1C=CC(Br)=C2 BB31-2788 [0,1,0,1,0,0|1,0,0]=3 303 B12R2.612 N[C@H]1CCC2=C1C=CC(Br)=C2 BB31-7436 [0,1,0,1,0,0|1,0,0]=3 304 B12R2.246 CC1=C2NN=CC2=CC(O)=C1 BB31-6017 [0,1,0,1,0,0|1,0,1]=4 305 B12R2.246 CC1=CC(C)=C2NCCC2=C1 BB32-3872 [0,1,0,1,0,0|1,0,0]=3 306 B12R2.246 OC1=CC(Br)=C2NN=CC2=C1 BB31-2938 [0,1,0,1,0,0|1,0,1]=4 307 B12R2.606 CC1CC2=C(C=CC(F)=C2)N1 BB31-6748 [0,1,0,1,0,0|1,0,0]=3 308 B12R2.606 CC1CC2=C(C=CC(N)=C2)O1 BB31-4398 [0,1,0,1,0,0|2,0,0]=4 309 B12R2.606 NC1=NC2=C(C=CC(O)=C2)S1 BB31-8871 [0,1,0,1,0,0|1,0,1]=4 310 B12R2.221 CC1=C2CCCC2=C(O)C=C1 BB31-5940 [0,1,0,1,0,0|1,0,0]=3 311 B12R2.43 COC1=CC=CC(C2CO2)=C1 BB32-1900 [0,1,0,1,0,0|1,0,0]=3 312 B12R2.44 C#CC1=CC2=C(C=C1)CCC2 BB31-9563 [0,1,0,1,0,0|2,0,0]=4 313 B12R2.44 COC1=CC2=C(C=C1)CNC2 BB31-1763 [0,1,0,1,0,0|2,0,0]=4 314 B12R2.44 N#CC1=CC2=C(C=C1)NCC2 BB31-3048 [0,1,0,1,0,0|1,0,0]=3 315 B12R2.44 NCC1=CC2=C(C=C1)CCC2 BB31-1915 [0,1,0,1,0,0|2,0,0]=4 316 B12R2.44 O=CC1=CC2=C(C=C1)CCC2 BB31-8032 [0,1,0,1,0,0|1,0,1]=4 317 B12R2.44 OCC1=CC2=C(C=C1)NC=C2 BB52-5879 [0,1,0,1,0,0|0,0,2]=4 318 B12R2.315 COC1=C2CCNC2=CC=C1 BB31-7002 [0,1,0,1,0,0|2,0,0]=4 319 B12R2.315 COC1=C2CCNC2=CC=C1 BB31-7398 [0,1,0,1,0,0|2,0,0]=4 320 B12R2.315 COC1=C2NN=CC2=CC=C1 BB31-6075 [0,1,0,1,0,0|1,0,1]=4 321 B12R2.315 N#CC1=C2NCCC2=CC=C1 BB31-0655 [0,1,0,1,0,0|1,0,0]=3 322 B12R2.315 O=CC1=C2CCCC2=CC=C1 BB32-2800 [0,1,0,1,0,0|1,0,1]=4 323 B12R2.100 OC1=C(Br)C=C2CCCC2=C1 BB32-2046 [0,1,0,1,0,0|1,0,0]=3 324 B12R2.100 OC1=C(Cl)C=C2NC=CC2=C1 BB32-0824 [0,1,0,1,0,0|0,0,2]=4 325 B12R2.291 ClC1=C(Cl)C=C(C2CO2)C=C1 BB32-2241 [0,1,0,1,0,0|2,0,0]=4 326 B8R1.1 CCN1C=C(O)C=N1 BB31-6891 [1,0,0,0,1,0|2,0,0]=4 327 B8R1.1 NCC1=CC=C(Br)O1 BB95-5747 [1,0,0,0,1,0|2,0,0]=4 328 B8R1.11 CCN1N=CC=C1O BB31-7938 [1,0,0,0,1,0|2,0,0]=4 329 B8R1.11 CN1C=CC=C1CN BB51-0595 [1,0,0,0,1,0|2,0,0]=4 330 B8R1.11 NCC1=C(Br)C=CS1 BB31-6843 [1,0,0,0,1,0|2,0,0]=4 331 B8R1.11 NCC1=C(Cl)C=CS1 BB32-1217 [1,0,0,0,1,0|2,0,0]=4 332 B8R1.8 BrCCN1C=CC=C1 BB31-5450 [1,0,0,0,1,0|2,0,0]=4 333 B8R1.8 NCCC1=NC=CS1 BB52-6118 [1,0,0,0,1,0|2,0,0]=4 334 B8R1.8 NCCN1C=CC=N1 BB53-0567 [1,0,0,0,1,0|2,0,0]=4 335 B8R1.8 NCCN1C=CN=C1 BB32-0624 [1,0,0,0,1,0|2,0,0]=4 336 B8R1.8 NCCN1C=CN=C1 BB52-8954 [1,0,0,0,1,0|2,0,0]=4 337 B8R1.8 OCCC1=COC=C1 BB31-4913 [1,0,0,0,1,0|2,0,0]=4