0 B11R1.24 CC1=CC(OCCCl)=CC=C1 BBS-00015685 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.24 CC1=CC(OCCN)=CC=C1 BBS-00009537 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.24 NC1=CC(OCCO)=CC=C1 BBS-00017859 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.24 NCCCC1=CC(Br)=CC=C1 BBS-00017173 [0,0,0,0,0,0|2,1,0]=3 4 B11R1.24 NCCCC1=CC(F)=CC=C1 BBS-00017093 [0,0,0,0,0,0|2,0,0]=2 5 B11R1.24 OCCCC1=CC(Br)=CC=C1 BBS-00017174 [0,0,0,0,0,0|2,1,0]=3 6 B10R1.10 CC1=CC=CC(CCN)=C1 BBS-00016386 [1,0,0,0,0,0|1,0,0]=2 7 B10R1.10 CSCC1=CC=CC(O)=C1 BBS-00036350 [1,0,0,0,0,0|2,0,0]=3 8 B10R1.10 FC1=CC=CC(N=C=S)=C1 BBS-00024261 [1,0,0,0,0,0|2,0,1]=4 9 B10R1.10 N#CCC1=CC=CC(Cl)=C1 BBS-00024225 [1,0,0,0,0,0|0,1,2]=4 10 B10R1.10 NCCC1=CC(Br)=CC=C1 BBS-00025843 [1,0,0,0,0,0|0,1,0]=2 11 B10R1.10 NCCC1=CC(F)=CC=C1 BBS-00017096 [1,0,0,0,0,0|0,0,0]=1 12 B10R1.10 NNCC1=CC(Cl)=CC=C1 BBS-00028635 [1,0,0,0,0,0|1,1,0]=3 13 B10R1.10 NNCC1=CC(F)=CC=C1 BBS-00030100 [1,0,0,0,0,0|1,0,0]=2 14 B10R1.10 [N-]=[N+]=NC1=CC(F)=CC=C1 BBS-00018796 [1,0,0,0,0,0|2,0,1]=4 15 B10R1.17 BrCCOC1=CC=CC=C1 BBS-00006631 [1,0,0,0,0,0|3,0,0]=4 16 B10R1.17 C(=O)NCC1=CC=CC=C1 BBS-00029337 [1,0,0,0,0,0|3,0,0]=4 17 B10R1.17 CNCCC1=NC=CC=C1 BBS-00002883 [1,0,0,0,0,0|1,0,0]=2 18 B10R1.17 N#CCCC1=CC=CC=C1 BBS-00024258 [1,0,0,0,0,0|2,0,0]=3 19 B10R1.17 N#CCOC1=CC=CC=C1 BBS-00009751 [1,0,0,0,0,0|3,0,0]=4 20 B10R1.17 N#CSCC1=CC=CC=C1 BBS-00015752 [1,0,0,0,0,0|3,0,0]=4 21 B10R1.17 NCCCC1=CC=CC=C1 BBS-00017110 [1,0,0,0,0,0|2,0,0]=3 22 B10R1.17 NCCCC1=NC=CC=C1 BBS-00021922 [1,0,0,0,0,0|3,0,0]=4 23 B10R1.17 NCCNC1=CC=CC=C1 BBS-00013712 [1,0,0,0,0,0|3,0,0]=4 24 B10R1.17 NCCOC1=CC=CC=C1 BBS-00026030 [1,0,0,0,0,0|3,0,0]=4 25 B10R1.17 NCCSC1=CC=CC=C1 BBS-00030833 [1,0,0,0,0,0|3,0,0]=4 26 B10R1.17 NCCSC1=CC=CC=C1 BBS-00034697 [1,0,0,0,0,0|3,0,0]=4 27 B10R1.17 O=CCCC1=CC=CC=C1 BBS-00032892 [1,0,0,0,0,0|2,0,0]=3 28 B10R1.17 OCCCC1=CC=CC=C1 BBS-00017111 [1,0,0,0,0,0|2,0,0]=3 29 B10R1.17 OCCOC1=CC=CC=C1 BBS-00038862 [1,0,0,0,0,0|3,0,0]=4 30 B10R1.17 S=C=NCC1=CC=CC=C1 BBS-00004442 [1,0,0,0,0,0|3,0,0]=4 31 B12R1.17 CNC[C@H](O)C1=CC(O)=CC=C1 BBS-00028827 [0,1,0,0,0,0|1,0,0]=2 32 B12R1.28 CC1=CC(NCCC#N)=CC=C1 BBS-00026548 [0,1,0,0,0,0|3,0,0]=4 33 B12R1.28 CNCCCC1=CC=CC(Br)=C1 BBS-00017172 [0,1,0,0,0,0|0,1,0]=2 34 B12R1.28 CNCCCC1=CC=CC(F)=C1 BBS-00017094 [0,1,0,0,0,0|0,0,0]=1 35 B12R1.50 COC(=O)CC1=CC=CC(N)=C1 BBS-00025194 [0,1,0,0,0,0|2,0,1]=4 36 B12R1.226 CC(C)OCC1=CC(N)=CC=C1 BBS-00036426 [0,1,0,0,0,0|3,0,0]=4 37 B12R1.226 CC(C)OCC1=CC=CC(O)=C1 BBS-00036414 [0,1,0,0,0,0|3,0,0]=4 38 B12R1.226 O=C(O)CCC1=CC(F)=CC=C1 BBS-00016728 [0,1,0,0,0,0|2,0,0]=3 39 B12R1.382 CCCOC1=CC=CC(C=O)=C1 BBS-00009669 [0,1,0,0,0,0|3,0,0]=4 40 B12R1.382 COC1=CC=CC(CCCN)=C1 BBS-00017169 [0,1,0,0,0,0|3,0,0]=4 41 B12R1.382 COC1=CC=CC(CCCO)=C1 BBS-00017170 [0,1,0,0,0,0|3,0,0]=4 42 B12R1.385 NCCCC1=CC=C(F)C(F)=C1 BBS-00017127 [0,1,0,0,0,0|2,0,0]=3 43 B12R2.24 NC1=NC2=C(C=N1)CNCC2 BBS-00021029 [0,0,0,1,0,0|3,0,0]=4 44 B12R2.80 NC1CC1C2=CC(Br)=CC=C2 BBS-00016704 [0,0,0,1,0,0|2,1,0]=4 45 B12R2.80 NC1CC1C2=CC(Cl)=CC=C2 BBS-00020992 [0,0,0,1,0,0|2,1,0]=4 46 B12R2.80 NC1CC1C2=CC(F)=CC=C2 BBS-00016666 [0,0,0,1,0,0|2,0,0]=3 47 B12R2.612 CC1=CC=C2C(=C1)CCC2N BBS-00022045 [0,0,0,1,0,0|3,0,0]=4 48 B12R2.612 CC1=CC=C2C(=O)CCC2=C1 BBS-00022035 [0,0,0,1,0,0|3,0,0]=4 49 B12R2.612 CN1C=CC2=CC(N)=CC=C21 BBS-00030473 [0,0,0,1,0,0|1,0,2]=4 50 B12R2.612 CN1C=NC2=C1C=CC(N)=C2 BBS-00038262 [0,0,0,1,0,0|2,0,1]=4 51 B12R2.612 CN1C=NC2=CC(O)=CC=C21 BBS-00030108 [0,0,0,1,0,0|2,0,1]=4 52 B12R2.612 NC1=CC2=C(C=C1)C(=O)CC2 BBS-00026145 [0,0,0,1,0,0|3,0,0]=4 53 B12R2.612 NC1CCC2=CC(Br)=CC=C21 BBS-00022042 [0,0,0,1,0,0|2,1,0]=4 54 B12R2.612 NC1CCC2=CC(F)=CC=C21 BBS-00022043 [0,0,0,1,0,0|2,0,0]=3 55 B12R2.612 O=C1CCC2=CC(Br)=CC=C12 BBS-00022028 [0,0,0,1,0,0|2,1,0]=4 56 B12R2.612 O=C1CCC2=CC(F)=CC=C12 BBS-00022029 [0,0,0,1,0,0|2,0,0]=3 57 B12R2.1081 ClC1=C2CCNCC2=CC=C1 BBS-00024884 [0,0,0,1,0,0|2,1,0]=4 58 B12R2.1081 NC1=C2NCCCC2=CC=C1 BBS-00008242 [0,0,0,1,0,0|3,0,0]=4 59 B12R2.1081 NC1=C2OCCCC2=CC=C1 BBS-00022067 [0,0,0,1,0,0|3,0,0]=4 60 B12R2.1081 OC1=C2NCCCC2=CC=C1 BBS-00001526 [0,0,0,1,0,0|3,0,0]=4 61 B9R1.2 BrCC1=CC(I)=CC=C1 BBS-00025584 [2,0,0,0,0,0|1,1,0]=4 62 B9R1.2 CC1=CC=CC(CCl)=C1 BBS-00004023 [2,0,0,0,0,0|2,0,0]=4 63 B9R1.2 CC1=CC=CC(CN)=N1 BBS-00023816 [2,0,0,0,0,0|2,0,0]=4 64 B9R1.2 CCC1=CC(N)=CC=C1 BBS-00028414 [2,0,0,0,0,0|1,0,0]=3 65 B9R1.2 COC1=CC(O)=CC=C1 BBS-00020883 [2,0,0,0,0,0|2,0,0]=4 66 B9R1.2 COC1=CC=CC(N)=C1 BBS-00003677 [2,0,0,0,0,0|2,0,0]=4 67 B9R1.2 ClCC1=CC(Cl)=CC=C1 BBS-00004024 [2,0,0,0,0,0|1,1,0]=4 68 B9R1.2 FC1=CC=CC(CCl)=C1 BBS-00003858 [2,0,0,0,0,0|1,0,0]=3 69 B9R1.2 N#CC1=CC=CC(F)=C1 BBS-00024245 [2,0,0,0,0,0|0,0,2]=4 70 B9R1.2 NC1=CC=CC(CCl)=C1 BBS-00024944 [2,0,0,0,0,0|2,0,0]=4 71 B9R1.2 NCC1=CC(I)=CC=C1 BBS-00025585 [2,0,0,0,0,0|0,1,0]=3 72 B9R1.2 NCC1=CC(O)=CC=C1 BBS-00003053 [2,0,0,0,0,0|1,0,0]=3 73 B9R1.2 NCC1=CC=CC(F)=C1 BBS-00033052 [2,0,0,0,0,0|0,0,0]=2 74 B9R1.2 NNC1=CC(F)=CC=C1 BBS-00006970 [2,0,0,0,0,0|1,0,0]=3 75 B9R1.2 O=CC1=CC(F)=CC=C1 BBS-00003262 [2,0,0,0,0,0|1,0,1]=4 76 B9R1.2 SCC1=CC(Br)=CC=C1 BBS-00037272 [2,0,0,0,0,0|1,1,0]=4 77 B9R1.8 BrCCC1=CC=CC=C1 BBS-00028228 [2,0,0,0,0,0|1,0,0]=3 78 B9R1.8 CNCC1=CC=NC=C1 BBS-00028317 [2,0,0,0,0,0|1,0,0]=3 79 B9R1.8 CNCC1=NC=CN=C1 BBS-00032926 [2,0,0,0,0,0|2,0,0]=4 80 B9R1.8 ClCCC1=CC=CC=C1 BBS-00027739 [2,0,0,0,0,0|1,0,0]=3 81 B9R1.8 N#CCC1=CC=CC=C1 BBS-00024145 [2,0,0,0,0,0|0,0,2]=4 82 B9R1.8 NOCC1=CC=CC=C1 BBS-00029336 [2,0,0,0,0,0|1,0,0]=3 83 B9R1.8 OCCC1=CC=CC=C1 BBS-00004355 [2,0,0,0,0,0|1,0,0]=3 84 B9R1.8 OCCC1=NC=CC=C1 BBS-00028971 [2,0,0,0,0,0|2,0,0]=4 85 B11R1.13 OCCC1=CC=CC(Br)=C1F BBS-00037053 [1,1,0,0,0,0|1,1,0]=4 86 B11R1.23 CNC(=O)C1=CC=CC(N)=C1 BBS-00038294 [1,1,0,0,0,0|1,0,1]=4 87 B11R1.23 NNC(=O)C1=CC=CC(F)=C1 BBS-00024292 [1,1,0,0,0,0|1,0,1]=4 88 B11R1.157 CN(C)CC1=CC=CC(N)=C1 BBS-00025293 [1,1,0,0,0,0|1,0,0]=3 89 B11R1.157 NC(=O)CC1=CC(O)=CC=C1 BBS-00025615 [1,1,0,0,0,0|1,0,1]=4 90 B11R1.157 NC(=S)NC1=CC(F)=CC=C1 BBS-00018887 [1,1,0,0,0,0|1,0,1]=4 91 B11R1.182 CC1=CC(CNN)=C(C)C=C1 BBS-00030119 [1,1,0,0,0,0|2,0,0]=4 92 B11R1.189 CCOC1=CC=CC(C#N)=C1 BBS-00020868 [1,1,0,0,0,0|2,0,0]=4 93 B11R1.189 CCOC1=CC=CC(C=O)=C1 BBS-00009668 [1,1,0,0,0,0|2,0,0]=4 94 B11R1.189 CNCC1=CC(OC)=CC=C1 BBS-00021685 [1,1,0,0,0,0|1,0,0]=3 95 B11R1.192 CCNC1=CC(C)=C(C)C=C1 BBS-00017091 [1,1,0,0,0,0|2,0,0]=4 96 B11R1.192 NCCC1=CC(O)=C(O)C=C1 BBS-00034683 [1,1,0,0,0,0|1,0,0]=3 97 B11R1.192 NCCC1=CC=C(F)C(F)=C1 BBS-00017130 [1,1,0,0,0,0|0,0,0]=2 98 B11R1.192 NNCC1=CC=C(Cl)C(Cl)=C1 BBS-00030124 [1,1,0,0,0,0|1,1,0]=4 99 B11R1.1 CCCCC1=CC=C(N)C=C1 BBS-00003555 [1,1,0,0,0,0|1,0,0]=3 100 B11R1.1 NCCCC1=CC=C(Cl)C=C1 BBS-00017099 [1,1,0,0,0,0|2,0,0]=4 101 B11R1.1 OCCCC1=CC=C(Cl)C=C1 BBS-00017159 [1,1,0,0,0,0|2,0,0]=4 102 B11R1.16 COCC(N)C1=CC=CC=C1 BBS-00016624 [1,1,0,0,0,0|1,0,0]=3 103 B11R1.17 CC1=C(CCCN)C=CC=C1 BBS-00021926 [1,1,0,0,0,0|2,0,0]=4 104 B11R1.17 CCCOC1=CC=CC=C1O BBS-00006716 [1,1,0,0,0,0|2,0,0]=4 105 B11R1.17 NCCCC1=C(Br)C=CC=C1 BBS-00017118 [1,1,0,0,0,0|2,0,0]=4 106 B11R1.17 NCCCC1=C(Cl)C=CC=C1 BBS-00017152 [1,1,0,0,0,0|2,0,0]=4 107 B11R1.17 NNCCC1=CC=CC=C1F BBS-00012995 [1,1,0,0,0,0|1,0,0]=3 108 B11R1.17 OCCCC1=C(Br)C=CC=C1 BBS-00017119 [1,1,0,0,0,0|2,0,0]=4 109 B11R1.17 OCCCC1=C(Cl)C=CC=C1 BBS-00017151 [1,1,0,0,0,0|2,0,0]=4 110 B11R1.28 CNCCCC1=CC=CC=C1 BBS-00017109 [1,1,0,0,0,0|0,0,0]=2 111 B11R1.28 N#CCCNC1=CC=CC=C1 BBS-00027376 [1,1,0,0,0,0|2,0,0]=4 112 B11R1.28 N#CCCOC1=CC=CC=C1 BBS-00024104 [1,1,0,0,0,0|2,0,0]=4 113 B11R1.28 N#CCCSC1=CC=CC=C1 BBS-00024221 [1,1,0,0,0,0|2,0,0]=4 114 B11R1.28 NCCCOC1=CC=CC=C1 BBS-00007965 [1,1,0,0,0,0|2,0,0]=4 115 B11R1.28 NNCCOC1=CC=CC=C1 BBS-00003706 [1,1,0,0,0,0|1,0,0]=3 116 B11R1.40 COC(=N)CC1=CC=CC=C1 BBS-00020999 [1,1,0,0,0,0|1,0,1]=4 117 B11R1.40 N#CC(Cl)CC1=CC=CC=C1 BBS-00016743 [1,1,0,0,0,0|2,0,0]=4 118 B11R1.40 NNC(=O)CC1=CC=CC=C1 BBS-00027958 [1,1,0,0,0,0|1,0,1]=4 119 B11R1.91 CC(N)COC1=CC=CC=C1 BBS-00016720 [1,1,0,0,0,0|2,0,0]=4 120 B11R1.91 O=C(O)CCC1=CC=CC=C1 BBS-00022951 [1,1,0,0,0,0|2,0,0]=4 121 B13R1.2 CNCC(OC)C1=CC(Cl)=CC=C1 BBS-00020984 [0,2,0,0,0,0|0,1,0]=3 122 B13R1.466 CNCC(O)C1=CC(O)=C(O)C=C1 BBS-00029291 [0,2,0,0,0,0|1,0,0]=3 123 B13R1.666 CNCCCC1=CC=CC(OC)=C1 BBS-00017168 [0,2,0,0,0,0|1,0,0]=3 124 B13R1.669 CNCCCC1=CC(F)=C(F)C=C1 BBS-00017129 [0,2,0,0,0,0|0,0,0]=2 125 B13R1.148 NC(CC1=CC(F)=CC=C1)C(=O)O BBS-00034069 [0,2,0,0,0,0|2,0,0]=4 126 B11R2.35 FC1=CC(C2CO2)=CC=C1 BBS-00032883 [1,0,0,1,0,0|1,0,0]=3 127 B11R2.36 CC1=CC=C2CNCC2=C1 BBS-00026114 [1,0,0,1,0,0|1,0,0]=3 128 B11R2.36 NC1=CC2=C(C=C1)NCS2 BBS-00000785 [1,0,0,1,0,0|2,0,0]=4 129 B11R2.106 ClC1=C2NCCC2=CC=C1 BBS-00016632 [1,0,0,1,0,0|0,1,0]=3 130 B11R2.106 FC1=C2NCCC2=CC=C1 BBS-00022069 [1,0,0,1,0,0|0,0,0]=2 131 B11R2.1 SC1CCC2=CC=CC=C21 BBS-00028756 [1,0,0,1,0,0|2,0,0]=4 132 B11R2.4 NC1CC1C2=CC=CC=C2 BBS-00016659 [1,0,0,1,0,0|2,0,0]=4 133 B11R2.4 N[C@H]1CC1C2=CC=CC=C2 BBS-00032397 [1,0,0,1,0,0|2,0,0]=4 134 B11R2.20 C1=CC2=C(CNCC2)N=C1 BBS-00013162 [1,0,0,1,0,0|1,0,0]=3 135 B11R2.20 C1=CC=C2CNCCC2=C1 BBS-00021795 [1,0,0,1,0,0|0,0,0]=2 136 B11R2.20 C1=CC=C2NCCCC2=C1 BBS-00003596 [1,0,0,1,0,0|2,0,0]=4 137 B11R2.20 C1=CN=C2CCNCC2=C1 BBS-00013724 [1,0,0,1,0,0|1,0,0]=3 138 B13R2.136 CC1=CC(C2CC2CN)=CC=C1 BBS-00016844 [0,1,0,1,0,0|2,0,0]=4 139 B13R2.136 NCC1CC1C2=CC(Br)=CC=C2 BBS-00017087 [0,1,0,1,0,0|1,1,0]=4 140 B13R2.136 NCC1CC1C2=CC=CC(Cl)=C2 BBS-00016838 [0,1,0,1,0,0|1,1,0]=4 141 B13R2.136 NCC1CC1C2=CC=CC(F)=C2 BBS-00016840 [0,1,0,1,0,0|1,0,0]=3 142 B13R2.136 OCC1CC1C2=CC(Br)=CC=C2 BBS-00017086 [0,1,0,1,0,0|1,1,0]=4 143 B13R2.136 OCC1CC1C2=CC(F)=CC=C2 BBS-00017095 [0,1,0,1,0,0|1,0,0]=3 144 B13R2.162 NC1CCOC2=C1C=C(F)C=C2 BBS-00022096 [0,1,0,1,0,0|2,0,0]=4 145 B13R2.342 NC1CCOC2=C1C=CC=C2F BBS-00022123 [0,1,0,1,0,0|2,0,0]=4 146 B13R2.3021 BrC1=CC(NC2COC2)=CC=C1 BBS-00037187 [0,1,0,1,0,0|1,1,0]=4 147 B13R2.3021 CC1=CC(CC2CNC2)=CC=C1 BBS-00016609 [0,1,0,1,0,0|1,0,0]=3 148 B13R2.3021 IC1=CC(NC2COC2)=CC=C1 BBS-00037186 [0,1,0,1,0,0|1,1,0]=4 149 B13R2.3021 NC1=CC(NC2COC2)=CC=C1 BBS-00037185 [0,1,0,1,0,0|2,0,0]=4 150 B13R2.5179 O=C1CC2=CC=CC(Br)=C2CN1 BBS-00036710 [0,1,0,1,0,0|0,1,1]=4 151 B13R2.155 O=C1CC2=CC(Br)=CC=C2CN1 BBS-00036711 [0,1,0,1,0,0|0,1,1]=4 152 B13R2.5190 CN1C(=O)CC2=CC(O)=CC=C21 BBS-00036137 [0,1,0,1,0,0|1,0,1]=4 153 B13R2.3127 NC1CC1C2=C(F)C=CC(F)=C2 BBS-00020979 [0,1,0,1,0,0|2,0,0]=4 154 B13R2.57 CCC1=CC=C2CCCCC2=C1 BBS-00029459 [0,1,0,1,0,0|2,0,0]=4 155 B13R2.369 OC1=C(O)C=C2CNCCC2=C1 BBS-00035609 [0,1,0,1,0,0|1,0,0]=3 156 B13R2.522 NC1CC1C2=CC=C(F)C(F)=C2 BBS-00017128 [0,1,0,1,0,0|2,0,0]=4 157 B9R1.7 CNCC1=CC(Cl)=CO1 BBS-00036626 [1,0,0,0,1,0|1,1,0]=4 158 B9R1.7 CNCC1=CC(Cl)=CS1 BBS-00036592 [1,0,0,0,1,0|1,1,0]=4 159 B9R1.7 CNCC1=CC=C(C)O1 BBS-00032704 [1,0,0,0,1,0|2,0,0]=4 160 B9R1.7 NCCC1=CC(Cl)=CS1 BBS-00035995 [1,0,0,0,1,0|1,1,0]=4