0 B12R1.8 CNCCOCC1=CC=CC=C1 BBS-00024880 [0,0,0,0,0,0|3,0,0]=3 1 B12R1.8 N#CCCNCC1=CC=CC=C1 BBS-00027370 [0,0,0,0,0,0|2,0,1]=3 2 B12R1.8 NCCCNCC1=CC=CC=C1 BBS-00023740 [0,0,0,0,0,0|2,0,0]=2 3 B11R1.28 CNCCCC1=CC=CC=C1 BBS-00017109 [1,0,0,0,0,0|1,0,0]=2 4 B11R1.28 N#CCCNC1=CC=CC=C1 BBS-00027376 [1,0,0,0,0,0|2,0,1]=4 5 B11R1.28 N#CCCOC1=CC=CC=C1 BBS-00024104 [1,0,0,0,0,0|2,0,1]=4 6 B11R1.28 N#CCCSC1=CC=CC=C1 BBS-00024221 [1,0,0,0,0,0|2,0,1]=4 7 B11R1.28 NCCCOC1=CC=CC=C1 BBS-00007965 [1,0,0,0,0,0|2,0,0]=3 8 B11R1.28 NNCCOC1=CC=CC=C1 BBS-00003706 [1,0,0,0,0,0|3,0,0]=4 9 B13R1.9 CCCCCCC1=CC=C(N)C=C1 BBS-00039137 [0,1,0,0,0,0|1,0,0]=2 10 B13R1.42 CNCC(O)COC1=CC=CC=C1 BBS-00011091 [0,1,0,0,0,0|3,0,0]=4 11 B13R1.42 NCCC(=O)NCC1=CC=CC=C1 BBS-00013441 [0,1,0,0,0,0|2,0,1]=4 12 B13R1.44 CCCCC(=O)OC1=CC=CC=C1 BBS-00026411 [0,1,0,0,0,0|2,0,1]=4 13 B13R1.44 NCCCC(=O)NC1=CC=CC=C1 BBS-00025833 [0,1,0,0,0,0|2,0,1]=4 14 B13R1.44 OCCNC(=S)NC1=CC=CC=C1 BBS-00027771 [0,1,0,0,0,0|2,0,1]=4 15 B13R1.44 OCCN\C(S)=N/C1=CC=CC=C1 BBS-00038884 [0,1,0,0,0,0|2,0,1]=4 16 B13R1.337 O=C(O)CCCOC1=CC=CC=C1 BBS-00007709 [0,1,0,0,0,0|1,0,1]=3 17 B13R1.337 O=C(O)CC\C=C\C1=CC=CC=C1 BBS-00018164 [0,1,0,0,0,0|0,0,3]=4 18 B13R1.555 OCCCNCC1=CC=CC=C1F BBS-00025059 [0,1,0,0,0,0|1,0,0]=2 19 B13R1.718 CC(CN)COCC1=CC=CC=C1 BBS-00016657 [0,1,0,0,0,0|2,0,0]=3 20 B13R1.718 NCC(=O)NCCC1=CC=CC=C1 BBS-00013451 [0,1,0,0,0,0|2,0,1]=4 21 B13R1.718 NNC(=O)CCCC1=CC=CC=C1 BBS-00024128 [0,1,0,0,0,0|2,0,1]=4 22 B13R1.718 O=C(CCCC1=CC=CC=C1)NO BBS-00028474 [0,1,0,0,0,0|1,0,1]=3 23 B13R1.718 O=C(CCl)NCCC1=CC=CC=C1 BBS-00000816 [0,1,0,0,0,0|2,0,1]=4 24 B13R2.1 NCCC1=CCC2=CC=CC=C21 BBS-00020970 [0,0,0,1,0,0|1,0,2]=4 25 B13R2.3 C1=CC=C(C2CCNCC2)C=C1 BBS-00034720 [0,0,0,1,0,0|2,0,0]=3 26 B13R2.3 C1=CC=C(C2CNCCO2)C=C1 BBS-00030285 [0,0,0,1,0,0|1,0,0]=2 27 B13R2.3 C1=CC=C(C2CNCCO2)C=C1 BBS-00033425 [0,0,0,1,0,0|1,0,0]=2 28 B13R2.3 C1=CC=C(N2CCNCC2)C=C1 BBS-00003581 [0,0,0,1,0,0|3,0,0]=4 29 B13R2.3 C1=CN=CC([C@@H]2CCCCN2)=C1 BBS-00034702 [0,0,0,1,0,0|2,0,0]=3 30 B13R2.15 CN1CCCC1C2=CC=CN=C2 BBS-00039079 [0,0,0,1,0,0|3,0,0]=4 31 B13R2.25 CNCC1CC1C2=CC=CC=C2 BBS-00017108 [0,0,0,1,0,0|2,0,0]=3 32 B13R2.25 CNC[C@@H]1C[C@H]1C2=CC=CC=C2 BBS-00017205 [0,0,0,1,0,0|2,0,0]=3 33 B13R2.25 NCCC1CC1C2=CC=CC=C2 BBS-00035898 [0,0,0,1,0,0|1,0,0]=2 34 B13R2.1613 BrCC1CCCC2=CC=CC=C21 BBS-00022081 [0,0,0,1,0,0|1,0,0]=2 35 B13R2.1613 N#CC1OCCC2=CC=CC=C21 BBS-00036013 [0,0,0,1,0,0|2,0,1]=4 36 B10R1.17 BrCCOC1=CC=CC=C1 BBS-00006631 [2,0,0,0,0,0|2,0,0]=4 37 B10R1.17 CNCCC1=NC=CC=C1 BBS-00002883 [2,0,0,0,0,0|2,0,0]=4 38 B10R1.17 N#CCCC1=CC=CC=C1 BBS-00024258 [2,0,0,0,0,0|1,0,1]=4 39 B10R1.17 NCCCC1=CC=CC=C1 BBS-00017110 [2,0,0,0,0,0|1,0,0]=3 40 B10R1.17 NCCCC1=NC=CC=C1 BBS-00021922 [2,0,0,0,0,0|2,0,0]=4 41 B10R1.17 NCCNC1=CC=CC=C1 BBS-00013712 [2,0,0,0,0,0|2,0,0]=4 42 B10R1.17 NCCOC1=CC=CC=C1 BBS-00026030 [2,0,0,0,0,0|2,0,0]=4 43 B10R1.17 NCCSC1=CC=CC=C1 BBS-00030833 [2,0,0,0,0,0|2,0,0]=4 44 B10R1.17 NCCSC1=CC=CC=C1 BBS-00034697 [2,0,0,0,0,0|2,0,0]=4 45 B10R1.17 O=CCCC1=CC=CC=C1 BBS-00032892 [2,0,0,0,0,0|0,0,2]=4 46 B10R1.17 OCCCC1=CC=CC=C1 BBS-00017111 [2,0,0,0,0,0|0,0,0]=2 47 B10R1.17 OCCOC1=CC=CC=C1 BBS-00038862 [2,0,0,0,0,0|1,0,0]=3 48 B12R1.1 BrCCCOC1=CC=C(Br)C=C1 BBS-00022128 [1,1,0,0,0,0|2,0,0]=4 49 B12R1.1 CC1=CC=C(OCCCBr)C=C1 BBS-00022106 [1,1,0,0,0,0|2,0,0]=4 50 B12R1.1 CC1=CC=C(OCCCN)C=C1 BBS-00022102 [1,1,0,0,0,0|2,0,0]=4 51 B12R1.1 CC1=CC=C(OCCCO)C=C1 BBS-00022104 [1,1,0,0,0,0|1,0,0]=3 52 B12R1.1 CNCCCC1=CC=C(Cl)C=C1 BBS-00017098 [1,1,0,0,0,0|1,0,0]=3 53 B12R1.1 ClC1=CC=C(OCCCBr)C=C1 BBS-00022033 [1,1,0,0,0,0|2,0,0]=4 54 B12R1.1 FC1=CC=C(OCCCBr)C=C1 BBS-00022091 [1,1,0,0,0,0|2,0,0]=4 55 B12R1.1 NCCCOC1=CC=C(Br)C=C1 BBS-00022032 [1,1,0,0,0,0|2,0,0]=4 56 B12R1.1 NCCCOC1=CC=C(Cl)C=C1 BBS-00021992 [1,1,0,0,0,0|2,0,0]=4 57 B12R1.1 NCCCOC1=CC=C(F)C=C1 BBS-00022087 [1,1,0,0,0,0|2,0,0]=4 58 B12R1.1 OCCCOC1=CC=C(Br)C=C1 BBS-00022097 [1,1,0,0,0,0|1,0,0]=3 59 B12R1.1 OCCCOC1=CC=C(Cl)C=C1 BBS-00022014 [1,1,0,0,0,0|1,0,0]=3 60 B12R1.1 OCCCOC1=CC=C(F)C=C1 BBS-00022089 [1,1,0,0,0,0|1,0,0]=3 61 B12R1.27 NCC(O)COC1=CC=CC=C1 BBS-00010678 [1,1,0,0,0,0|2,0,0]=4 62 B12R1.27 N\C(CCC1=CC=CC=C1)=N\O BBS-00028931 [1,1,0,0,0,0|1,0,1]=4 63 B12R1.28 CNCCCC1=CC=CC(Br)=C1 BBS-00017172 [1,1,0,0,0,0|1,0,0]=3 64 B12R1.28 CNCCCC1=CC=CC(F)=C1 BBS-00017094 [1,1,0,0,0,0|1,0,0]=3 65 B12R1.252 CN(C)CCNC1=CC=CC=C1 BBS-00011085 [1,1,0,0,0,0|2,0,0]=4 66 B12R1.252 O=C(O)CCCC1=CC=CC=C1 BBS-00003749 [1,1,0,0,0,0|0,0,1]=3 67 B12R1.252 O=C(O)CCOC1=CC=CC=C1 BBS-00006237 [1,1,0,0,0,0|1,0,1]=4 68 B12R1.252 O=C(O)CCSC1=CC=CC=C1 BBS-00024101 [1,1,0,0,0,0|1,0,1]=4 69 B12R1.252 O=C(O)COCC1=CC=CC=C1 BBS-00025332 [1,1,0,0,0,0|1,0,1]=4 70 B12R1.252 O=C(O)CSCC1=CC=CC=C1 BBS-00006580 [1,1,0,0,0,0|1,0,1]=4 71 B12R1.267 BrCCCOC1=CC=CC=C1Br BBS-00022145 [1,1,0,0,0,0|2,0,0]=4 72 B12R1.267 CC1=CC=CC=C1OCCCBr BBS-00022158 [1,1,0,0,0,0|2,0,0]=4 73 B12R1.267 CC1=CC=CC=C1OCCCN BBS-00022154 [1,1,0,0,0,0|2,0,0]=4 74 B12R1.267 CC1=CC=CC=C1OCCCO BBS-00022156 [1,1,0,0,0,0|1,0,0]=3 75 B12R1.267 CNCCCC1=C(Br)C=CC=C1 BBS-00017117 [1,1,0,0,0,0|1,0,0]=3 76 B12R1.267 CNCCCC1=C(Cl)C=CC=C1 BBS-00017153 [1,1,0,0,0,0|1,0,0]=3 77 B12R1.267 ClC1=CC=CC=C1OCCCBr BBS-00022133 [1,1,0,0,0,0|2,0,0]=4 78 B12R1.267 FC1=CC=CC=C1OCCCBr BBS-00022121 [1,1,0,0,0,0|2,0,0]=4 79 B12R1.267 NCCCOC1=CC=CC=C1Br BBS-00022141 [1,1,0,0,0,0|2,0,0]=4 80 B12R1.267 NCCCOC1=CC=CC=C1Cl BBS-00022129 [1,1,0,0,0,0|2,0,0]=4 81 B12R1.267 NCCCOC1=CC=CC=C1F BBS-00022116 [1,1,0,0,0,0|2,0,0]=4 82 B12R1.267 OCCCOC1=CC=CC=C1Br BBS-00022143 [1,1,0,0,0,0|1,0,0]=3 83 B12R1.267 OCCCOC1=CC=CC=C1Cl BBS-00022131 [1,1,0,0,0,0|1,0,0]=3 84 B12R1.267 OCCCOC1=CC=CC=C1F BBS-00022119 [1,1,0,0,0,0|1,0,0]=3 85 B12R1.267 OCCNCC1=C(F)C=CC=C1 BBS-00036727 [1,1,0,0,0,0|1,0,0]=3 86 B14R1.148 CC1=CC(OCCCC(=O)O)=CC=C1 BBS-00007780 [0,2,0,0,0,0|1,0,1]=4 87 B14R1.677 CC1=CC=C(OCCCC(=O)O)C=C1 BBS-00007817 [0,2,0,0,0,0|1,0,1]=4 88 B14R1.677 NC1=CC=C(NCCCC(=O)O)C=C1 BBS-00021034 [0,2,0,0,0,0|1,0,1]=4 89 B14R1.677 O=C(O)CCCOC1=CC=C(Cl)C=C1 BBS-00009663 [0,2,0,0,0,0|1,0,1]=4 90 B14R1.776 CCCCCOC1=CC=C(C=O)C=C1 BBS-00003277 [0,2,0,0,0,0|2,0,0]=4 91 B14R1.38 COCCCNC(C)C1=CC=CC=C1 BBS-00032146 [0,2,0,0,0,0|1,0,0]=3 92 B14R1.420 CN(CCCC(=O)O)C1=CC=CC=C1 BBS-00021695 [0,2,0,0,0,0|1,0,1]=4 93 B14R1.420 NC(CCCC(=O)O)C1=NC=CC=C1 BBS-00026983 [0,2,0,0,0,0|1,0,1]=4 94 B14R1.422 O=C(O)CCCCCC1=NC=CC=C1 BBS-00000411 [0,2,0,0,0,0|1,0,0]=3 95 B14R1.520 NCCC(=O)NCCC1=CC=CC=C1 BBS-00013445 [0,2,0,0,0,0|1,0,1]=4 96 B14R1.716 COC(=O)CCCCC1=NC=CC=C1 BBS-00026994 [0,2,0,0,0,0|1,0,1]=4 97 B14R1.716 COC(=O)CCNCC1=CC=CC=C1 BBS-00023850 [0,2,0,0,0,0|1,0,1]=4 98 B14R1.716 COC(=O)CCNCC1=CC=CC=C1 BBS-00033427 [0,2,0,0,0,0|1,0,1]=4 99 B14R1.716 N\C(CCNCC1=CC=CC=C1)=N/O BBS-00027393 [0,2,0,0,0,0|1,0,1]=4 100 B14R1.716 O=C(CCl)NCCCC1=CC=CC=C1 BBS-00006446 [0,2,0,0,0,0|1,0,1]=4 101 B14R1.159 CC1=C(OCCCC(=O)O)C=CC=C1 BBS-00008803 [0,2,0,0,0,0|1,0,1]=4 102 B14R1.159 O=C(O)CCCOC1=C(Cl)C=CC=C1 BBS-00009661 [0,2,0,0,0,0|1,0,1]=4 103 B14R1.3331 FC(F)(F)CNCCC1=CC=CC=C1 BBS-00021690 [0,2,0,0,0,0|2,0,0]=4 104 B14R1.6449 NC(CCCC1=CC=CC=C1)C(=O)O BBS-00026980 [0,2,0,0,0,0|0,0,1]=3 105 B12R2.27 CNC1CC1C2=CC=CC=C2 BBS-00021925 [1,0,0,1,0,0|1,0,0]=3 106 B12R2.27 NCC1CC1C2=CC=CC=C2 BBS-00017107 [1,0,0,1,0,0|1,0,0]=3 107 B12R2.27 NCC1CC1C2=CC=CC=C2 BBS-00034995 [1,0,0,1,0,0|1,0,0]=3 108 B12R2.27 NC[C@@H]1C[C@H]1C2=CC=CC=C2 BBS-00017196 [1,0,0,1,0,0|1,0,0]=3 109 B12R2.27 O=CC1CC1C2=CC=CC=C2 BBS-00020955 [1,0,0,1,0,0|0,0,2]=4 110 B12R2.27 OCC1CC1C2=CC=CC=C2 BBS-00017106 [1,0,0,1,0,0|0,0,0]=2 111 B12R2.41 C1=CC=C2SCCCNC2=C1 BBS-00006297 [1,0,0,1,0,0|1,1,0]=4 112 B12R2.1081 ClC1CCCC2=C1C=CC=C2 BBS-00032692 [1,0,0,1,0,0|1,0,0]=3 113 B12R2.1081 ClC1CCOC2=CC=CC=C21 BBS-00025168 [1,0,0,1,0,0|2,0,0]=4 114 B12R2.1081 NC1CCCC2=CC=CC=C21 BBS-00003619 [1,0,0,1,0,0|1,0,0]=3 115 B12R2.1081 NC1CCOC2=CC=CC=C21 BBS-00006847 [1,0,0,1,0,0|2,0,0]=4 116 B12R2.1081 O=C1CCCC2=CC=CC=C12 BBS-00028238 [1,0,0,1,0,0|0,0,2]=4 117 B12R2.2058 C1=CC=C(CC2CNC2)C=C1 BBS-00016613 [1,0,0,1,0,0|1,0,0]=3 118 B12R2.2058 C1=CC=C(NC2COC2)C=C1 BBS-00037184 [1,0,0,1,0,0|2,0,0]=4 119 B12R2.2383 C1=COC(COCC2CO2)=C1 BBS-00032729 [0,0,0,1,1,0|2,0,0]=4 120 B12R2.2383 C1=CSC(COCC2CO2)=C1 BBS-00032969 [0,0,0,1,1,0|2,0,0]=4 121 B14R2.21 CN1CCNC(C2=CC=CC=C2)C1 BBS-00035018 [0,1,0,1,0,0|2,0,0]=4 122 B14R2.32 CNCC1CC1C2=CC(Br)=CC=C2 BBS-00017171 [0,1,0,1,0,0|2,0,0]=4 123 B14R2.32 CNCC1CC1C2=CC=CC(C)=C2 BBS-00016876 [0,1,0,1,0,0|2,0,0]=4 124 B14R2.32 CNCC1CC1C2=CC=CC(Cl)=C2 BBS-00016870 [0,1,0,1,0,0|2,0,0]=4 125 B14R2.32 CNCC1CC1C2=CC=CC(F)=C2 BBS-00016872 [0,1,0,1,0,0|2,0,0]=4 126 B14R2.4475 BrC1=CC(OCC2CCC2)=CC=C1 BBS-00025075 [0,1,0,1,0,0|2,0,0]=4 127 B14R2.4475 NC1=CC(OCC2CCC2)=CC=C1 BBS-00035814 [0,1,0,1,0,0|2,0,0]=4 128 B14R2.43 CNCC1CC1C2=CC=C(Br)C=C2 BBS-00016878 [0,1,0,1,0,0|2,0,0]=4 129 B14R2.43 CNCC1CC1C2=CC=C(C)C=C2 BBS-00016874 [0,1,0,1,0,0|2,0,0]=4 130 B14R2.43 CNCC1CC1C2=CC=C(Cl)C=C2 BBS-00016862 [0,1,0,1,0,0|2,0,0]=4 131 B14R2.43 CNCC1CC1C2=CC=C(F)C=C2 BBS-00016865 [0,1,0,1,0,0|2,0,0]=4 132 B14R2.68 O=C1COC(C2=CC=CC=C2)CN1 BBS-00026023 [0,1,0,1,0,0|1,0,1]=4 133 B14R2.5637 CC1=CC2=C(C=C1)OCCCC2N BBS-00022115 [0,1,0,1,0,0|2,0,0]=4 134 B14R2.5637 NC1CCCOC2=C1C=C(Br)C=C2 BBS-00021971 [0,1,0,1,0,0|2,0,0]=4 135 B14R2.5637 NC1CCCOC2=C1C=C(Cl)C=C2 BBS-00022084 [0,1,0,1,0,0|2,0,0]=4 136 B14R2.5637 NC1CCCOC2=C1C=C(F)C=C2 BBS-00022100 [0,1,0,1,0,0|2,0,0]=4 137 B14R2.10626 NC1=CC=C(OCC2CCC2)C=C1 BBS-00035851 [0,1,0,1,0,0|2,0,0]=4 138 B14R2.8 ClCC1CNC(C2=CC=CC=C2)O1 BBS-00028217 [0,1,0,1,0,0|2,0,0]=4 139 B14R2.114 NC(C1=CC=CC=C1)C2CCCC2 BBS-00029834 [0,1,0,1,0,0|1,0,0]=3 140 B14R2.792 O=C(OCC1CO1)C2=CC=CC=C2 BBS-00012609 [0,1,0,1,0,0|1,0,1]=4 141 B14R2.6 C1=CC=C(CC2CCCCN2)C=C1 BBS-00026326 [0,1,0,1,0,0|1,0,0]=3 142 B14R2.6 C1=CC=C(CC2CCNCC2)C=C1 BBS-00003617 [0,1,0,1,0,0|1,0,0]=3 143 B14R2.6 C1=CC=C(CN2CCCNC2)C=C1 BBS-00012295 [0,1,0,1,0,0|2,0,0]=4 144 B14R2.6 C1=CC=C(CN2CCNCC2)C=C1 BBS-00033017 [0,1,0,1,0,0|2,0,0]=4 145 B14R2.24 NC1=C(N2CCCCC2)C=CC=C1 BBS-00006462 [0,1,0,1,0,0|2,0,0]=4 146 B14R2.24 NC1CCCCC1C2=CC=CC=C2 BBS-00021893 [0,1,0,1,0,0|1,0,0]=3 147 B14R2.24 OC1CCCCC1C2=NC=CC=C2 BBS-00000091 [0,1,0,1,0,0|1,0,0]=3 148 B14R2.101 C1=CC(CNC2CCCC2)=CC=N1 BBS-00038434 [0,1,0,1,0,0|2,0,0]=4 149 B14R2.101 C1=CC=C(COC2CCNC2)C=C1 BBS-00024809 [0,1,0,1,0,0|2,0,0]=4 150 B14R2.112 ClCCN1CCC2=CC=CC=C2C1 BBS-00025309 [0,1,0,1,0,0|2,0,0]=4 151 B14R2.2899 CC(NCC1=CC=CC=C1)C2CC2 BBS-00034042 [0,1,0,1,0,0|2,0,0]=4 152 B14R2.479 CNCC1CC1C2=CC=CC=C2Br BBS-00016877 [0,1,0,1,0,0|2,0,0]=4 153 B14R2.479 CNCC1CC1C2=CC=CC=C2C BBS-00016875 [0,1,0,1,0,0|2,0,0]=4 154 B14R2.479 CNCC1CC1C2=CC=CC=C2Cl BBS-00016863 [0,1,0,1,0,0|2,0,0]=4 155 B14R2.479 CNCC1CC1C2=CC=CC=C2F BBS-00016871 [0,1,0,1,0,0|2,0,0]=4 156 B14R2.685 CC1=CC=CC2=C1OCCCC2N BBS-00021935 [0,1,0,1,0,0|2,0,0]=4 157 B14R2.685 NC1CCCOC2=C1C=CC=C2Br BBS-00022152 [0,1,0,1,0,0|2,0,0]=4 158 B14R2.685 NC1CCCOC2=C1C=CC=C2Cl BBS-00022139 [0,1,0,1,0,0|2,0,0]=4 159 B14R2.685 NC1CCCOC2=C1C=CC=C2F BBS-00022126 [0,1,0,1,0,0|2,0,0]=4 160 B14R2.958 C\C(=N\O)C1CC1C2=CC=CC=C2 BBS-00032072 [0,1,0,1,0,0|1,0,1]=4 161 B14R3.2936 C1=CC=C(C23CNCC2C3)C=C1 BBS-00024560 [0,0,0,2,0,0|2,0,0]=4 162 B14R3.3058 C1=CC=C2C(=C1)CNCC23CC3 BBS-00024854 [0,0,0,2,0,0|2,0,0]=4 163 B10R1.21 CCCCCC1=CC=CS1 BBS-00035979 [1,0,0,0,1,0|1,0,0]=3