0 B11R1.17 BrCCCC1=CC=CC=C1Br O28828 [0,0,0,1,0,0|2,0,1]=4 1 B11R1.17 CC1=CC=CC=C1CCCN P36201 [0,0,0,1,0,0|2,0,1]=4 2 B11R1.17 CNCCC1=CC=CC=C1Br Q66105 [0,0,0,1,0,0|2,0,1]=4 3 B11R1.17 CNCCC1=CC=CC=C1C P36240 [0,0,0,1,0,0|2,0,1]=4 4 B11R1.17 CNCCC1=CC=CC=C1Cl P37635 [0,0,0,1,0,0|2,0,1]=4 5 B11R1.17 CNCCC1=CC=CC=C1F P37905 [0,0,0,1,0,0|2,0,1]=4 6 B11R1.17 ClC1=CC=CC=C1CCCBr P37495 [0,0,0,1,0,0|2,0,1]=4 7 B11R1.17 FC1=CC=CC=C1CCCBr P41797 [0,0,0,1,0,0|2,0,1]=4 8 B11R1.17 NCCCC1=CC=CC=C1Br P36821 [0,0,0,1,0,0|2,0,1]=4 9 B11R1.17 NCCCC1=CC=CC=C1Cl P40265 [0,0,0,1,0,0|2,0,1]=4 10 B11R1.17 NCCCC1=CC=CC=C1F P35165 [0,0,0,1,0,0|2,0,1]=4 11 B11R1.17 NCCCN1C=CC=NC1=O S72631 [0,0,0,1,0,0|3,0,0]=4 12 B11R1.17 NCCCN1N=CC=CC1=O L20832 [0,0,0,1,0,0|3,0,0]=4 13 B11R1.17 OCCCC1=CC=CC=C1Cl P36965 [0,0,0,1,0,0|2,0,1]=4 14 B11R1.17 OCCCC1=CC=CC=C1F P36169 [0,0,0,1,0,0|2,0,1]=4 15 B11R1.28 BrCCCCC1=CC=CC=C1 P41514 [0,0,0,1,0,0|2,0,0]=3 16 B11R1.28 CCCNCC1=CC=CC=C1 P39958 [0,0,0,1,0,0|2,0,0]=3 17 B11R1.28 CNCCCC1=CC=CC=C1 P39485 [0,0,0,1,0,0|2,0,0]=3 18 B11R1.28 ClCCOCC1=CC=CC=C1 P40573 [0,0,0,1,0,0|3,0,0]=4 19 B11R1.28 ICCCCC1=CC=CC=C1 P36870 [0,0,0,1,0,0|2,0,0]=3 20 B11R1.28 ICCOCC1=CC=CC=C1 P37513 [0,0,0,1,0,0|3,0,0]=4 21 B11R1.28 NCCCOC1=CC=CC=C1 P36207 [0,0,0,1,0,0|3,0,0]=4 22 B11R1.28 NCCCSC1=CC=CC=N1 Q58262 [0,0,0,1,0,0|3,0,0]=4 23 B11R1.28 OCCCCC1=CC=CN=C1 P37114 [0,0,0,1,0,0|3,0,0]=4 24 B11R1.28 OCCCCC1=CC=NC=C1 P37629 [0,0,0,1,0,0|3,0,0]=4 25 B11R1.28 OCCCCC1=NC=CC=C1 P40417 [0,0,0,1,0,0|2,0,0]=3 26 B11R1.41 CCCC1=C(C=O)C=CC=N1 Q60346 [0,0,0,1,0,0|1,0,1]=3 27 B11R1.41 CCOC1=NC=CC=C1C=O Q66660 [0,0,0,1,0,0|2,0,1]=4 28 B10R1.17 CCCCC1=CC=NC=C1 O30545 [1,0,0,1,0,0|1,0,1]=4 29 B10R1.17 CNCCC1=CC=CC=C1 P37213 [1,0,0,1,0,0|1,0,1]=4 30 B10R1.17 CNCCC1=NC=CC=C1 P40087 [1,0,0,1,0,0|2,0,0]=4 31 B10R1.17 ICCCC1=CC=CC=C1 P38180 [1,0,0,1,0,0|1,0,1]=4 32 B10R1.17 OCCCC1=NC=CC=C1 P39056 [1,0,0,1,0,0|2,0,0]=4 33 B10R1.20 CCC1=CC=CC=C1C=O O31187 [1,0,0,1,0,0|0,0,2]=4 34 B10R1.21 CCCCCC1=NC=CN1 H-8123 [1,0,0,1,0,0|2,0,0]=4 35 B12R1.8 CCNCCSC1=CC=CC=N1 Q58348 [0,1,0,1,0,0|2,0,0]=4 36 B12R1.8 CNCCCOC1=CC=CC=C1 P41683 [0,1,0,1,0,0|2,0,0]=4 37 B12R1.8 CNCCOCC1=CC=CC=C1 P36478 [0,1,0,1,0,0|2,0,0]=4 38 B12R1.8 CNCCOCC1=CC=CC=C1 P36772 [0,1,0,1,0,0|2,0,0]=4 39 B12R1.8 NCCCCCC1=CC=CC=C1 P40466 [0,1,0,1,0,0|1,0,0]=3 40 B12R1.8 NCCCCSC1=CC=CC=N1 Q58152 [0,1,0,1,0,0|2,0,0]=4 41 B12R1.8 NCCCOCC1=CC=CC=C1 P40697 [0,1,0,1,0,0|2,0,0]=4 42 B12R1.8 OCCCCOC1=CC=CC=C1 P40161 [0,1,0,1,0,0|2,0,0]=4 43 B12R1.8 OCCCNCC1=NC=CC=C1 P36562 [0,1,0,1,0,0|2,0,0]=4 44 B12R1.8 OCCOCCC1=CC=CC=C1 P36349 [0,1,0,1,0,0|2,0,0]=4 45 B12R1.267 BrC1=CC=CC=C1CCCCI M22797 [0,1,0,1,0,0|1,0,1]=4 46 B12R1.267 BrCCCCC1=CC=CC=C1Br M22738 [0,1,0,1,0,0|1,0,1]=4 47 B12R1.267 CC1=CC=CC=C1CCCCBr M22735 [0,1,0,1,0,0|1,0,1]=4 48 B12R1.267 CC1=CC=CC=C1CCCCN P40980 [0,1,0,1,0,0|1,0,1]=4 49 B12R1.267 CC1=CC=CC=C1CCCCO P40090 [0,1,0,1,0,0|1,0,1]=4 50 B12R1.267 CCCCOC1=CC=CC=C1Br N24203 [0,1,0,1,0,0|1,0,1]=4 51 B12R1.267 CCCNCC1=CC=CC=C1Br P35971 [0,1,0,1,0,0|1,0,1]=4 52 B12R1.267 CCCNCC1=CC=CC=C1C P35973 [0,1,0,1,0,0|1,0,1]=4 53 B12R1.267 CCCNCC1=CC=CC=C1Cl P35972 [0,1,0,1,0,0|1,0,1]=4 54 B12R1.267 CCCNCC1=CC=CC=C1F P36959 [0,1,0,1,0,0|1,0,1]=4 55 B12R1.267 ClC1=CC=CC=C1CCCCBr M22795 [0,1,0,1,0,0|1,0,1]=4 56 B12R1.267 FC1=CC=CC=C1CCCCBr M22739 [0,1,0,1,0,0|1,0,1]=4 57 B12R1.267 FC1=CC=CC=C1CCCCI M22995 [0,1,0,1,0,0|1,0,1]=4 58 B12R1.267 NCCCCC1=CC=CC=C1Br P40430 [0,1,0,1,0,0|1,0,1]=4 59 B12R1.267 NCCCCC1=CC=CC=C1Cl P37368 [0,1,0,1,0,0|1,0,1]=4 60 B12R1.267 NCCCCC1=CC=CC=C1F P43044 [0,1,0,1,0,0|1,0,1]=4 61 B12R1.267 OCCCCC1=CC=CC=C1Br P42135 [0,1,0,1,0,0|1,0,1]=4 62 B12R1.267 OCCCCC1=CC=CC=C1Cl P35217 [0,1,0,1,0,0|1,0,1]=4 63 B12R1.267 OCCCCC1=CC=CC=C1F P39372 [0,1,0,1,0,0|1,0,1]=4 64 B12R1.28 BrCCCCC1=CC=CC(Br)=C1 M22716 [0,1,0,1,0,0|2,0,0]=4 65 B12R1.28 CC1=CC(CCCCBr)=CC=C1 M22773 [0,1,0,1,0,0|2,0,0]=4 66 B12R1.28 CC1=CC(CCCCI)=CC=C1 M22749 [0,1,0,1,0,0|2,0,0]=4 67 B12R1.28 CC1=CC(CCCCN)=CC=C1 P41305 [0,1,0,1,0,0|2,0,0]=4 68 B12R1.28 CC1=CC(CCCCO)=CC=C1 P37676 [0,1,0,1,0,0|2,0,0]=4 69 B12R1.28 CCCNCC1=CC(Br)=CC=C1 N24121 [0,1,0,1,0,0|2,0,0]=4 70 B12R1.28 CCCNCC1=CC=CC(C)=C1 P40841 [0,1,0,1,0,0|2,0,0]=4 71 B12R1.28 CCCNCC1=CC=CC(Cl)=C1 P38354 [0,1,0,1,0,0|2,0,0]=4 72 B12R1.28 CCCNCC1=CC=CC(F)=C1 P35256 [0,1,0,1,0,0|2,0,0]=4 73 B12R1.28 ClC1=CC(CCCCBr)=CC=C1 M22733 [0,1,0,1,0,0|2,0,0]=4 74 B12R1.28 FC1=CC(CCCCBr)=CC=C1 M22740 [0,1,0,1,0,0|2,0,0]=4 75 B12R1.28 NCCCCC1=CC=CC(Cl)=C1 P40368 [0,1,0,1,0,0|2,0,0]=4 76 B12R1.28 NCCCCC1=CC=CC(F)=C1 P41608 [0,1,0,1,0,0|2,0,0]=4 77 B12R1.28 OCCCCC1=CC=CC(Br)=C1 P39680 [0,1,0,1,0,0|2,0,0]=4 78 B12R1.28 OCCCCC1=CC=CC(Cl)=C1 P36219 [0,1,0,1,0,0|2,0,0]=4 79 B12R1.28 OCCCCC1=CC=CC(F)=C1 P36220 [0,1,0,1,0,0|2,0,0]=4 80 B12R1.69 COCCN1C=CC(N)=CC1=O L21748 [0,1,0,1,0,0|2,0,0]=4 81 B12R1.69 COCCN1C=CC(N)=CC1=O Q54922 [0,1,0,1,0,0|2,0,0]=4 82 B12R1.1 BrC1=CC=C(CCCCI)C=C1 M23180 [0,1,0,1,0,0|2,0,0]=4 83 B12R1.1 BrCCCCC1=CC=C(Br)C=C1 P35349 [0,1,0,1,0,0|2,0,0]=4 84 B12R1.1 CC1=CC=C(CCCCBr)C=C1 P34730 [0,1,0,1,0,0|2,0,0]=4 85 B12R1.1 CC1=CC=C(CCCCI)C=C1 M23181 [0,1,0,1,0,0|2,0,0]=4 86 B12R1.1 CC1=CC=C(CCCCN)C=C1 P40979 [0,1,0,1,0,0|2,0,0]=4 87 B12R1.1 CC1=CC=C(CCCCO)C=C1 P37587 [0,1,0,1,0,0|2,0,0]=4 88 B12R1.1 CCCCNC1=NC=C(Br)C=C1 P39094 [0,1,0,1,0,0|2,0,0]=4 89 B12R1.1 CCCNCC1=CC=C(Br)C=C1 P41052 [0,1,0,1,0,0|2,0,0]=4 90 B12R1.1 CCCNCC1=CC=C(C)C=C1 P38355 [0,1,0,1,0,0|2,0,0]=4 91 B12R1.1 CCCNCC1=CC=C(Cl)C=C1 P37471 [0,1,0,1,0,0|2,0,0]=4 92 B12R1.1 CCCNCC1=CC=C(F)C=C1 P36342 [0,1,0,1,0,0|2,0,0]=4 93 B12R1.1 CNCCCC1=CC=C(Br)C=C1 P35409 [0,1,0,1,0,0|2,0,0]=4 94 B12R1.1 CNCCCC1=CC=C(F)C=C1 P37997 [0,1,0,1,0,0|2,0,0]=4 95 B12R1.1 ClC1=CC=C(CCCCBr)C=C1 M22750 [0,1,0,1,0,0|2,0,0]=4 96 B12R1.1 ClC1=CC=C(CCCCI)C=C1 M22752 [0,1,0,1,0,0|2,0,0]=4 97 B12R1.1 FC1=CC=C(CCCCBr)C=C1 M22793 [0,1,0,1,0,0|2,0,0]=4 98 B12R1.1 FC1=CC=C(CCCCI)C=C1 M22744 [0,1,0,1,0,0|2,0,0]=4 99 B12R1.1 NCCCCC1=CC=C(Br)C=C1 P42241 [0,1,0,1,0,0|2,0,0]=4 100 B12R1.1 NCCCCC1=CC=C(F)C=C1 P41110 [0,1,0,1,0,0|2,0,0]=4 101 B12R1.1 NCCCCC1=CC=C(I)C=C1 P41122 [0,1,0,1,0,0|2,0,0]=4 102 B12R1.1 NCCCCC1=CC=C(O)C=C1 P39592 [0,1,0,1,0,0|2,0,0]=4 103 B12R1.1 OCCCCC1=CC=C(Br)C=C1 P36218 [0,1,0,1,0,0|2,0,0]=4 104 B12R1.1 OCCCCC1=CC=C(Cl)C=C1 P40038 [0,1,0,1,0,0|2,0,0]=4 105 B12R1.1 OCCCCC1=CC=C(F)C=C1 P38247 [0,1,0,1,0,0|2,0,0]=4 106 B12R1.7 CCCCCCC1=CC=C(Br)S1 Q68060 [0,1,0,1,0,0|0,1,1]=4 107 B12R1.30 CCCCC(N)C1=CC=CC=N1 Q58402 [0,1,0,1,0,0|1,0,0]=3 108 B12R1.30 COCCC(N)C1=CC=CC=C1 P38104 [0,1,0,1,0,0|2,0,0]=4 109 B12R1.30 NC(CCCO)C1=CC=CC=C1 Q65498 [0,1,0,1,0,0|2,0,0]=4 110 B12R1.252 CC(O)CNCC1=CC=CC=C1 Q66161 [0,1,0,1,0,0|2,0,0]=4 111 B12R1.252 C[C@@H](O)CNCC1=CC=CC=C1 Q66162 [0,1,0,1,0,0|2,0,0]=4 112 B12R1.252 C[C@H](O)CNCC1=CC=CC=C1 Q66163 [0,1,0,1,0,0|2,0,0]=4 113 B12R1.252 O=C(O)\C=C\CN1CCCCC1 K12318 [0,1,0,1,0,0|1,0,1]=4 114 B12R2.2 C1=CC=C(C2CCCN2)C=C1 Q55561 [0,0,0,2,0,0|2,0,0]=4 115 B12R2.2 C1=CC=C(C2CCCO2)C=C1 G-5955 [0,0,0,2,0,0|2,0,0]=4 116 B12R2.2 C1=CC=C(C2CCNC2)C=C1 L13987 [0,0,0,2,0,0|2,0,0]=4 117 B12R2.2 C1=CC=C(C2CCNC2)C=C1 P44791 [0,0,0,2,0,0|2,0,0]=4 118 B12R2.2 C1=CC=C([C@@H]2CCNC2)C=C1 L14895 [0,0,0,2,0,0|2,0,0]=4 119 B12R2.2 C1=CC=C([C@H]2CCCN2)C=C1 10698 [0,0,0,2,0,0|2,0,0]=4 120 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 L22374 [0,0,0,2,0,0|2,0,0]=4 121 B12R2.2 C1=CN=C(C2CCCN2)C=C1 M22660 [0,0,0,2,0,0|2,0,0]=4 122 B12R2.2 C1=CN=C(C2CCNC2)C=C1 A-560 [0,0,0,2,0,0|2,0,0]=4 123 B12R2.2 C1=CN=C(C2CCNC2)C=C1 A-562 [0,0,0,2,0,0|2,0,0]=4 124 B12R2.41 C1=CC2=C(CCNCC2)N=C1 L14612 [0,0,0,2,0,0|2,0,0]=4 125 B12R2.41 C1=CC=C2CCNCCC2=C1 G-5674 [0,0,0,2,0,0|2,0,0]=4 126 B12R2.1081 NC1CCCC2=NC=CC=C21 C-3503 [0,0,0,2,0,0|2,0,0]=4 127 B12R2.1081 O=C1CCCC2=NC=CC=C12 C-3495 [0,0,0,2,0,0|1,0,1]=4 128 B12R2.27 NCC1CC1C2=CC=CC=C2 L19913 [0,0,0,2,0,0|2,0,0]=4 129 B12R2.27 OCC1CC1C2=CC=CC=C2 P51570 [0,0,0,2,0,0|2,0,0]=4 130 B12R2.2057 C1=CC=C(CNC2CC2)C=C1 P41656 [0,0,0,2,0,0|2,0,0]=4 131 B12R2.2058 C1=CC=C(CC2CNC2)C=C1 M22647 [0,0,0,2,0,0|2,0,0]=4 132 B12R2.2058 C1=CC=C(CN2CCC2)C=C1 P45197 [0,0,0,2,0,0|2,0,0]=4 133 B12R2.2048 O=CC1=CC=CC=C1C2CC2 N25228 [0,0,0,2,0,0|0,0,2]=4