0 B11R1.17 CC1=C(OCCN)C=CC=C1 BB54-2356 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.17 CC1=CC=CC=C1CNC#N BB12-1086 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.17 ClC1=C(OCCBr)C=CC=C1 BB17-1653 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.17 N#CCCN1C=CC=CC1=O BB57-6512 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.17 N#CNCC1=CC=CC=C1Cl BB12-1084 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.17 N#CNCC1=CC=CC=C1F BB12-1082 [0,0,0,0,0,0|3,1,0]=4 6 B11R1.17 NC1=CC=CC=C1OCCO BB05-3292 [0,0,0,0,0,0|4,0,0]=4 7 B11R1.17 NCCCC1=C(Cl)C=CC=C1 BB58-0571 [0,0,0,0,0,0|2,0,0]=2 8 B11R1.17 NCCCN1C=CC=CC1=O BB57-6517 [0,0,0,0,0,0|4,0,0]=4 9 B11R1.17 NCCOC1=C(F)C=CC=C1 BB55-4836 [0,0,0,0,0,0|3,1,0]=4 10 B11R1.17 NCCOC1=CC=CC=C1Cl BB55-4833 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.4 CC1=CC=CC=C1CCN BB12-2271 [1,0,0,0,0,0|1,0,0]=2 12 B10R1.4 CC1=CC=CC=C1CNN BB55-6543 [1,0,0,0,0,0|2,0,0]=3 13 B10R1.4 CCNC1=CC=CC=C1N BB12-3022 [1,0,0,0,0,0|2,0,0]=3 14 B10R1.4 CCOC1=C(N)N=CC=C1 BB54-3639 [1,0,0,0,0,0|3,0,0]=4 15 B10R1.4 CCOC1=NC=CC=C1N BB32-2785 [1,0,0,0,0,0|3,0,0]=4 16 B10R1.4 NNCC1=C(F)C=CC=C1 BB57-4010 [1,0,0,0,0,0|1,1,0]=3 17 B10R1.4 NNCC1=CC=CC=C1Cl BB57-1614 [1,0,0,0,0,0|1,0,0]=2 18 B10R1.4 S=C=NC1=CC=CC=C1Cl BB01-6617 [1,0,0,0,0,0|2,0,1]=4 19 B10R1.17 BrCCCC1=CN=CC=C1 BB54-3595 [1,0,0,0,0,0|3,0,0]=4 20 B10R1.17 BrCCOC1=CC=CC=C1 BB17-1654 [1,0,0,0,0,0|3,0,0]=4 21 B10R1.17 ClCCCC1=CC=NC=C1 BB57-3431 [1,0,0,0,0,0|3,0,0]=4 22 B10R1.17 N#CCCC1=NC=CC=C1 BB12-1756 [1,0,0,0,0,0|3,0,0]=4 23 B10R1.17 NCCCC1=CC=CC=N1 BB54-0788 [1,0,0,0,0,0|3,0,0]=4 24 B10R1.17 NCCCC1=CC=NC=C1 BB57-3430 [1,0,0,0,0,0|3,0,0]=4 25 B10R1.17 OCCCC1=CC=NC=C1 BB57-6720 [1,0,0,0,0,0|3,0,0]=4 26 B10R1.17 [C-]#[N+]CCC1=CC=NC=C1 BB56-1803 [1,0,0,0,0,0|1,0,2]=4 27 B12R1.69 CCCNC1=CC=C(C)C=C1Cl BB01-7301 [0,1,0,0,0,0|2,0,0]=3 28 B12R1.121 CCCOC1=CC=CC=C1C=O BB54-0099 [0,1,0,0,0,0|3,0,0]=4 29 B12R1.125 N=C(N)SCC1=C(Cl)C=CC=C1 BB57-4436 [0,1,0,0,0,0|3,0,0]=4 30 B12R1.125 O=C(Cl)COC1=C(Cl)C=CC=C1 BB55-5589 [0,1,0,0,0,0|3,0,0]=4 31 B12R1.125 O=C(O)CNC1=C(Cl)C=CC=C1 BB58-0801 [0,1,0,0,0,0|3,0,0]=4 32 B12R1.267 CC1=CC=CC=C1CNCCN BB01-5347 [0,1,0,0,0,0|3,0,0]=4 33 B12R1.267 CCCCOC1=C(N)C=CC=C1 BB54-0086 [0,1,0,0,0,0|2,0,0]=3 34 B12R1.267 CNCCNC1=C(C)C=CC=C1 BB12-1636 [0,1,0,0,0,0|1,0,0]=2 35 B12R1.267 NCCNCC1=C(Cl)C=CC=C1 BB01-5345 [0,1,0,0,0,0|2,0,0]=3 36 B12R1.267 NCCNCC1=C(F)C=CC=C1 BB01-5328 [0,1,0,0,0,0|2,1,0]=4 37 B12R1.267 NCCOCC1=CC=CC=C1Cl BB55-4846 [0,1,0,0,0,0|2,0,0]=3 38 B12R1.267 NCCSCC1=CC=CC=C1F BB58-0587 [0,1,0,0,0,0|2,1,0]=4 39 B12R1.308 N#CCC(=O)C1=CC=CC=C1Cl BB54-4371 [0,1,0,0,0,0|2,0,1]=4 40 B12R1.371 N\C(CC1=C(Cl)C=CC=C1)=N/O BB01-3932 [0,1,0,0,0,0|1,0,2]=4 41 B12R1.374 CC1=CC(OCCN)=C(Cl)C=C1 BB55-4946 [0,1,0,0,0,0|3,0,0]=4 42 B12R1.374 CCCNC1=CC(F)=CC=C1F BB01-7300 [0,1,0,0,0,0|2,1,0]=4 43 B12R1.374 NCCOC1=C(Cl)C=CC(Cl)=C1 BB55-4931 [0,1,0,0,0,0|3,0,0]=4 44 B12R1.1631 CC1=C(OCCN)C(Cl)=CC=C1 BB57-5119 [0,1,0,0,0,0|3,0,0]=4 45 B12R1.1631 CCCNC1=C(C)C=CC=C1C BB01-8205 [0,1,0,0,0,0|3,0,0]=4 46 B12R2.24 NC1CCC2=C(C=CC=C2)C1 BB57-6610 [0,0,0,1,0,0|3,0,0]=4 47 B12R2.32 CNC1CC2=CC=CC=C2C1 BB53-1624 [0,0,0,1,0,0|1,0,0]=2 48 B12R2.32 NCC1CC2=CC=CC=C2O1 BB54-1902 [0,0,0,1,0,0|3,0,0]=4 49 B12R2.32 OCC1CC2=C(C=CC=C2)N1 BB31-2427 [0,0,0,1,0,0|3,0,0]=4 50 B12R2.41 C1=CC2=C(C=C1)OCCCO2 BB53-1823 [0,0,0,1,0,0|3,0,0]=4 51 B12R2.196 CN1C=CC2=C(N)C=CC=C21 BB26-0150 [0,0,0,1,0,0|1,0,2]=4 52 B12R2.196 ON1N=NC2=C1C=CC=C2Cl BB12-2042 [0,0,0,1,0,0|3,0,0]=4 53 B12R2.225 NC1=C(NC2CC2)C=CC=C1 BB31-9144 [0,0,0,1,0,0|3,0,0]=4 54 B12R2.1081 CC1=CC=CC2=C1NCCC2 BB05-1497 [0,0,0,1,0,0|3,0,0]=4 55 B12R2.1081 NC1=C2NCCCC2=CC=C1 BB32-2229 [0,0,0,1,0,0|3,0,0]=4 56 B12R2.1081 NC1=CC=CC2=C1CCCC2 BB54-1965 [0,0,0,1,0,0|2,0,0]=3 57 B12R2.1081 NC1=CC=CC2=C1CCNC2 BB31-0700 [0,0,0,1,0,0|1,0,0]=2 58 B12R2.1081 OC1=C2CCNCC2=CC=C1 BB58-2121 [0,0,0,1,0,0|1,0,0]=2 59 B12R2.1081 OC1=CC=CC2=C1NCCC2 BB54-2937 [0,0,0,1,0,0|3,0,0]=4 60 B9R1.8 BrCCC1=NC=CC=C1 BB54-3597 [2,0,0,0,0,0|2,0,0]=4 61 B9R1.8 CCNC1=CC=CN=C1 BB58-1378 [2,0,0,0,0,0|2,0,0]=4 62 B9R1.8 CNCC1=NC=CC=C1 BB55-7031 [2,0,0,0,0,0|1,0,0]=3 63 B9R1.8 CNCC1=NC=CN=C1 BB54-5692 [2,0,0,0,0,0|2,0,0]=4 64 B9R1.8 CNCC1=NC=NC=C1 BB57-2309 [2,0,0,0,0,0|2,0,0]=4 65 B9R1.8 ClCCC1=NC=CC=C1 BB54-3546 [2,0,0,0,0,0|2,0,0]=4 66 B9R1.8 NCCC1=NC=CN=C1 BB55-7667 [2,0,0,0,0,0|2,0,0]=4 67 B9R1.8 NOCC1=CC=CC=C1 BB05-2313 [2,0,0,0,0,0|1,0,0]=3 68 B9R1.8 OCCC1=NC=CC=C1 BB01-4800 [2,0,0,0,0,0|2,0,0]=4 69 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 BB56-0588 [2,0,0,0,0,0|0,0,2]=4 70 B9R1.15 CNC1=C(C)C=CC=C1 BB01-7286 [2,0,0,0,0,0|1,0,0]=3 71 B9R1.15 CNC1=CC=CC=C1N BB12-2750 [2,0,0,0,0,0|1,0,0]=3 72 B9R1.15 CNC1=CC=CN=C1N BB12-1643 [2,0,0,0,0,0|2,0,0]=4 73 B9R1.15 CNC1=NC=CC=C1Cl BB12-1745 [2,0,0,0,0,0|1,0,0]=3 74 B9R1.15 CNC1=NC=CN=C1Cl BB12-1107 [2,0,0,0,0,0|2,0,0]=4 75 B9R1.15 NCC1=CC=CN=C1Cl BB57-4137 [2,0,0,0,0,0|1,0,0]=3 76 B9R1.15 NCC1=CC=CN=C1N BB12-1525 [2,0,0,0,0,0|2,0,0]=4 77 B9R1.15 NNC1=CC=CC=C1I BB56-0829 [2,0,0,0,0,0|1,1,0]=4 78 B9R1.15 NNC1=CC=CN=C1Cl BB10-0530 [2,0,0,0,0,0|2,0,0]=4 79 B9R1.15 OCC1=CC=CN=C1Cl BB12-3681 [2,0,0,0,0,0|2,0,0]=4 80 B11R1.13 CCOC1=CC=CC(F)=C1Br BB31-2088 [1,1,0,0,0,0|1,1,0]=4 81 B11R1.41 CCOC1=C(NC)C=CC=C1 BB01-7289 [1,1,0,0,0,0|2,0,0]=4 82 B11R1.41 CCOC1=CC=CC=C1NN BB01-6125 [1,1,0,0,0,0|2,0,0]=4 83 B11R1.41 CCOC1=CC=CC=C1NN BB56-0057 [1,1,0,0,0,0|2,0,0]=4 84 B11R1.81 CCNC1=CC=C(F)C=C1Cl BB01-7294 [1,1,0,0,0,0|1,0,0]=3 85 B11R1.81 CCOC1=C(N)C=C(C)C=C1 BB17-1893 [1,1,0,0,0,0|2,0,0]=4 86 B11R1.81 CCOC1=C(N)C=C(Cl)C=C1 BB17-1894 [1,1,0,0,0,0|2,0,0]=4 87 B11R1.81 CCOC1=CC=C(F)C=C1N BB05-4827 [1,1,0,0,0,0|2,0,0]=4 88 B11R1.81 CCSC1=C(N)C=C(Cl)C=C1 BB54-1777 [1,1,0,0,0,0|2,0,0]=4 89 B11R1.81 N#CCC1=C(Cl)C=C(Br)C=C1 BB58-3393 [1,1,0,0,0,0|0,0,2]=4 90 B11R1.81 NNCC1=C(Cl)C=C(Cl)C=C1 BB57-4066 [1,1,0,0,0,0|1,0,0]=3 91 B11R1.86 CC(C)NC1=C(N)C=CC=C1 BB32-3847 [1,1,0,0,0,0|2,0,0]=4 92 B11R1.86 CC(C)OC1=CC=CC=C1N BB57-2916 [1,1,0,0,0,0|2,0,0]=4 93 B11R1.86 CC1=CC=CN=C1CC(C)O BB55-7546 [1,1,0,0,0,0|2,0,0]=4 94 B11R1.86 CN(C)CC1=C(Br)C=CC=C1 BB58-0486 [1,1,0,0,0,0|0,1,0]=3 95 B11R1.182 CC1=CC(CNN)=C(C)C=C1 BB57-4018 [1,1,0,0,0,0|2,0,0]=4 96 B11R1.182 CCNC1=C(O)C=CC(C)=C1 BB57-5463 [1,1,0,0,0,0|2,0,0]=4 97 B11R1.182 CCNC1=CC(C)=CC=C1C BB01-7293 [1,1,0,0,0,0|2,0,0]=4 98 B11R1.222 C#CC(O)C1=C(Cl)C=CC=C1 BB31-3996 [1,1,0,0,0,0|0,0,2]=4 99 B11R1.222 CCC(N)C1=CC=CC=C1C BB58-0612 [1,1,0,0,0,0|1,0,0]=3 100 B11R1.222 CNC(=O)C1=CC=CN=C1Cl BB57-1154 [1,1,0,0,0,0|1,0,1]=4 101 B11R1.222 NC(CO)C1=CC=CC=C1F BB56-2224 [1,1,0,0,0,0|1,1,0]=4 102 B11R1.222 NCC(O)C1=C(F)C=CC=C1 BB31-5644 [1,1,0,0,0,0|0,1,0]=3 103 B11R1.605 CC1=CC=CC(C)=C1CCN BB58-3404 [1,1,0,0,0,0|1,0,0]=3 104 B11R1.605 CCNC1=C(C)C=CC=C1C BB01-8195 [1,1,0,0,0,0|2,0,0]=4 105 B11R1.605 FC1=CC=CC(F)=C1CCBr BB31-1480 [1,1,0,0,0,0|1,1,0]=4 106 B11R1.605 NC1=C(CCO)C(Cl)=CC=C1 BB55-4852 [1,1,0,0,0,0|1,0,0]=3 107 B11R1.605 NNCC1=C(Cl)C=CC=C1Cl BB57-4067 [1,1,0,0,0,0|1,0,0]=3 108 B11R1.1 CC1=CC=C(CCCN)C=C1 BB58-0569 [1,1,0,0,0,0|2,0,0]=4 109 B11R1.1 CC1=CC=C(CCCO)C=C1 BB32-2521 [1,1,0,0,0,0|2,0,0]=4 110 B11R1.1 NCCCC1=CC=C(Cl)C=C1 BB54-2040 [1,1,0,0,0,0|2,0,0]=4 111 B11R1.1 NCCCC1=CC=C(F)C=C1 BB58-0570 [1,1,0,0,0,0|2,0,0]=4 112 B11R1.16 CNCC(O)C1=CC=CC=C1 BB12-2195 [1,1,0,0,0,0|0,0,0]=2 113 B11R1.16 OC(CCCl)C1=CC=CC=C1 BB12-1401 [1,1,0,0,0,0|2,0,0]=4 114 B11R1.24 CC1=CC=CC(CCCN)=C1 BB58-0568 [1,1,0,0,0,0|2,0,0]=4 115 B11R1.24 CC1=CC=CC(CCCO)=C1 BB31-8239 [1,1,0,0,0,0|2,0,0]=4 116 B11R1.24 ClC1=CC=CC(CCCBr)=C1 BB31-7544 [1,1,0,0,0,0|2,0,0]=4 117 B11R1.24 N#CCCC1=CC=CC(Br)=C1 BB32-1657 [1,1,0,0,0,0|2,0,0]=4 118 B11R1.28 C=CCCNC1=CC=CC=C1 BB58-4953 [1,1,0,0,0,0|1,0,1]=4 119 B11R1.28 C=CCNCC1=CC=CC=C1 BB20-4594 [1,1,0,0,0,0|1,0,1]=4 120 B11R1.28 NCCCCC1=NC=CC=C1 BB54-4080 [1,1,0,0,0,0|2,0,0]=4 121 B11R1.28 NCCOCC1=CC=CC=C1 BB55-4803 [1,1,0,0,0,0|2,0,0]=4 122 B11R1.28 NCCSCC1=CC=CC=C1 BB53-1385 [1,1,0,0,0,0|2,0,0]=4 123 B11R1.28 OCCNCC1=CC=CC=C1 BB17-0809 [1,1,0,0,0,0|2,0,0]=4 124 B11R1.28 S=C=NCCC1=CC=CC=C1 BB54-2698 [1,1,0,0,0,0|0,0,2]=4 125 B11R1.40 CCC(N)CC1=CC=CC=C1 BB17-0798 [1,1,0,0,0,0|1,0,0]=3 126 B11R1.40 CNC(C)CC1=NC=CN=C1 BB55-6192 [1,1,0,0,0,0|2,0,0]=4 127 B11R1.40 NC(CO)CC1=CC=CC=C1 BB01-6619 [1,1,0,0,0,0|2,0,0]=4 128 B11R1.91 CC(N)COC1=CC=CC=C1 BB58-0599 [1,1,0,0,0,0|2,0,0]=4 129 B11R1.91 N=C(N)CCC1=CC=CC=C1 BB57-1742 [1,1,0,0,0,0|2,0,0]=4 130 B13R1.164 CC(C)CNC1=CC=C(F)C=C1Cl BB01-7302 [0,2,0,0,0,0|2,0,0]=4 131 B13R1.369 COCCNC1=C(Cl)C=C(N)C=C1 BB17-2678 [0,2,0,0,0,0|1,0,0]=3 132 B13R1.157 CS(=O)(=O)NCC1=CC=CC=C1Cl BB17-1511 [0,2,0,0,0,0|2,0,0]=4 133 B13R1.528 O=C(CCl)NCC1=CC=CC=C1Cl BB01-5139 [0,2,0,0,0,0|2,0,0]=4 134 B13R1.158 CN(C)CCOC1=C(N)C=CC=C1 BB58-3955 [0,2,0,0,0,0|1,0,0]=3 135 B13R1.555 CC1=CC=CC=C1CNCCCN BB01-5582 [0,2,0,0,0,0|2,0,0]=4 136 B13R1.555 NCCCNCC1=CC=CC=C1Cl BB01-5370 [0,2,0,0,0,0|1,0,0]=3 137 B13R1.8919 NCCSCC1=C(Cl)C=CC=C1Cl BB58-0593 [0,2,0,0,0,0|2,0,0]=4 138 B13R1.2872 CC(CN)CC1=C(Cl)C=CC(Cl)=C1 BB57-6431 [0,2,0,0,0,0|2,0,0]=4 139 B11R2.20 C1=CC2=C(C=N1)CNCC2 BB32-2671 [1,0,0,1,0,0|2,0,0]=4 140 B11R2.55 ClC1=C(C2CO2)C=CC=C1 BB32-3052 [1,0,0,1,0,0|1,0,0]=3 141 B11R2.106 ClC1=NC=NC2=C1CCC2 BB57-1749 [1,0,0,1,0,0|2,0,0]=4 142 B11R2.238 C1=CC=C(NC2CC2)C=C1 BB32-1778 [1,0,0,1,0,0|2,0,0]=4 143 B13R2.1 CNCC1=COC2=CC=CC=C12 BB58-3693 [0,1,0,1,0,0|1,0,1]=4 144 B13R2.435 CN(C)C1CC2=CC=CC=C2C1 BB53-1352 [0,1,0,1,0,0|1,0,0]=3 145 B13R2.3587 OC1=C(CNC2CC2)C=CC=C1 BB05-3907 [0,1,0,1,0,0|2,0,0]=4 146 B13R2.18 BrC1=CC=CC=C1C2CCCN2 BB56-2503 [0,1,0,1,0,0|1,1,0]=4 147 B13R2.18 CC1=C(C2CCCN2)C=CC=C1 BB05-3778 [0,1,0,1,0,0|2,0,0]=4 148 B13R2.18 ClC1=C(C2CCCN2)C=CC=C1 BB55-3982 [0,1,0,1,0,0|1,0,0]=3 149 B13R2.18 FC1=CC=CC=C1C2CCNC2 BB58-3626 [0,1,0,1,0,0|0,1,0]=3 150 B13R2.26 CCNC1CC2=CC=CC=C2C1 BB53-1619 [0,1,0,1,0,0|1,0,0]=3 151 B13R2.26 CNCC1=CC2=CC=CC=C2S1 BB55-8324 [0,1,0,1,0,0|1,0,1]=4 152 B13R2.26 CNCC1=NC2=CC=CC=C2S1 BB55-8321 [0,1,0,1,0,0|1,0,1]=4 153 B13R2.217 NC1(CC2=CC=CC=C2Cl)CC1 BB57-1440 [0,1,0,1,0,0|1,0,0]=3 154 B9R1.33 CNCC1=CC=CN1C BB55-8233 [1,0,0,0,1,0|2,0,0]=4 155 B9R1.12 CNCCC1=CC=CS1 BB55-8320 [1,0,0,0,1,0|1,0,0]=3 156 B9R1.12 CNCCC1=CNN=C1 BB01-4435 [1,0,0,0,1,0|2,0,0]=4