0 B10R1.1 CC1=CC=C(C=C1)/C=N/O Z49568558 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.1 CC1=CC=C(C=C1)CC#N Z285131444 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.1 CC1=CC=C(C=C1)CC=O Z993017610 [0,0,0,0,0,0|2,0,1]=3 3 B10R1.1 CC1=CC=C(C=C1)CCN Z1268153218 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.1 CC1=CC=C(C=C1)CCO Z397587076 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.1 CC1=NC=C(C=C1)CCN Z600584220 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.1 CC1=NC=C(N=C1)CCO Z1504684184 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.1 CCCC1=CC=C(C=C1)Br Z299596168 [0,0,0,0,0,0|1,0,0]=1 8 B10R1.1 CCCC1=CC=C(C=C1)N Z104492166 [0,0,0,0,0,0|1,0,0]=1 9 B10R1.1 CCNC1=CC=C(C=C1)Br Z286365048 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.1 CCNC1=CC=C(C=C1)Cl Z2902298062 [0,0,0,0,0,0|2,0,0]=2 11 B10R1.1 CCNC1=CC=C(C=C1)F Z89270849 [0,0,0,0,0,0|2,0,0]=2 12 B10R1.1 CCNC1=CC=C(C=C1)N Z359511474 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.1 CCNC1=CC=C(C=C1)O Z1823256830 [0,0,0,0,0,0|1,0,0]=1 14 B10R1.1 CCNC1=CNC(=O)C=C1 Z5871830340 [0,0,0,0,0,0|2,0,1]=3 15 B10R1.1 CCNC1=NC=C(C=C1)Br Z359297778 [0,0,0,0,0,0|3,0,0]=3 16 B10R1.1 CCNC1=NC=C(C=C1)I Z2233927789 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.1 CCNC1=NN=C(C=C1)C Z802821712 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.1 CCOC1=CC=C(C=C1)C Z53834228 [0,0,0,0,0,0|2,0,0]=2 19 B10R1.1 CCOC1=CC=C(C=C1)N Z57127438 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.1 CCOC1=CC=C(C=C1)S Z166646982 [0,0,0,0,0,0|1,1,0]=2 21 B10R1.1 CCOC1=NC=C(C=C1)N Z240084310 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.1 CCOC1=NC=C(C=N1)Cl Z1222423631 [0,0,0,0,0,0|4,0,0]=4 23 B10R1.1 CCOC1=NN=C(C=C1)Cl Z291235530 [0,0,0,0,0,0|4,0,0]=4 24 B10R1.1 CCSC1=NC=C(C=C1)Br Z742922262 [0,0,0,0,0,0|3,0,0]=3 25 B10R1.1 CCSC1=NC=C(C=C1)N Z332377604 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.1 CNCC1=CC=C(C=C1)Br Z56175269 [0,0,0,0,0,0|2,0,0]=2 27 B10R1.1 CNCC1=CC=C(C=C1)C Z56944115 [0,0,0,0,0,0|2,0,0]=2 28 B10R1.1 CNCC1=CC=C(C=C1)Cl Z56956070 [0,0,0,0,0,0|2,0,0]=2 29 B10R1.1 CNCC1=CC=C(C=C1)F Z56963340 [0,0,0,0,0,0|2,0,0]=2 30 B10R1.1 CNCC1=CC=C(C=C1)I Z4242747560 [0,0,0,0,0,0|2,0,0]=2 31 B10R1.1 CNCC1=CN=C(C=C1)Cl Z265498862 [0,0,0,0,0,0|3,0,0]=3 32 B10R1.1 CNCC1=CN=C(C=C1)F Z1745074466 [0,0,0,0,0,0|3,0,0]=3 33 B10R1.1 CNCC1=CN=C(C=C1)N Z1255388567 [0,0,0,0,0,0|3,0,0]=3 34 B10R1.1 CNCC1=NC=C(C=C1)Br Z5436471179 [0,0,0,0,0,0|3,0,0]=3 35 B10R1.1 CNCC1=NC=C(C=C1)C Z1255425232 [0,0,0,0,0,0|3,0,0]=3 36 B10R1.1 CNCC1=NC=C(C=N1)Br Z2865349750 [0,0,0,0,0,0|4,0,0]=4 37 B10R1.1 CNCC1=NC=C(N=C1)C Z2310677427 [0,0,0,0,0,0|4,0,0]=4 38 B10R1.1 COCC1=CC=C(C=C1)N Z240084568 [0,0,0,0,0,0|2,0,0]=2 39 B10R1.1 COCC1=NC=C(C=N1)N Z825741952 [0,0,0,0,0,0|4,0,0]=4 40 B10R1.1 CSCC1=CC=C(C=C1)Br Z19854469 [0,0,0,0,0,0|2,0,0]=2 41 B10R1.1 CSCC1=CC=C(C=C1)N Z732207336 [0,0,0,0,0,0|2,0,0]=2 42 B10R1.1 CSCC1=CN=C(C=C1)Cl Z732206922 [0,0,0,0,0,0|3,0,0]=3 43 B10R1.1 N#CCC1=CC=C(C=C1)F Z89283961 [0,0,0,0,0,0|2,0,1]=3 44 B10R1.1 N#CCC1=CC=C(C=C1)N Z90122117 [0,0,0,0,0,0|2,0,1]=3 45 B10R1.1 N#CCC1=CC=C(C=C1)O Z90120144 [0,0,0,0,0,0|1,0,1]=2 46 B10R1.1 N#CCC1=NC=C(C=C1)F Z1098233918 [0,0,0,0,0,0|3,0,1]=4 47 B10R1.1 NC1=CC=C(C=C1)CCO Z276600190 [0,0,0,0,0,0|2,0,0]=2 48 B10R1.1 NC1=CN=C(C=C1)CCO Z1898597735 [0,0,0,0,0,0|3,0,0]=3 49 B10R1.1 NCCC1=CC=C(C=C1)Br Z285143750 [0,0,0,0,0,0|2,0,0]=2 50 B10R1.1 NCCC1=CC=C(C=C1)Cl Z57051065 [0,0,0,0,0,0|2,0,0]=2 51 B10R1.1 NCCC1=CC=C(C=C1)F Z90122126 [0,0,0,0,0,0|2,0,0]=2 52 B10R1.1 NCCC1=CC=C(C=C1)I Z2515133713 [0,0,0,0,0,0|2,0,0]=2 53 B10R1.1 NCCC1=CC=C(C=C1)O Z744729058 [0,0,0,0,0,0|1,0,0]=1 54 B10R1.1 NCCC1=CN=C(C=C1)Cl Z1198178633 [0,0,0,0,0,0|3,0,0]=3 55 B10R1.1 NCCC1=CN=C(N=C1)O Z2725055726 [0,0,0,0,0,0|3,0,0]=3 56 B10R1.1 NCCC1=NC=C(C=C1)F Z2238508662 [0,0,0,0,0,0|3,0,0]=3 57 B10R1.1 NCCC1=NC=C(C=C1)O Z2350909287 [0,0,0,0,0,0|2,0,0]=2 58 B10R1.1 NCCC1=NC=C(C=N1)Br Z4752114140 [0,0,0,0,0,0|4,0,0]=4 59 B10R1.1 NOCC1=CC=C(C=C1)Cl Z1198164677 [0,0,0,0,0,0|3,0,0]=3 60 B10R1.1 O/N=C/C1=CC=C(C=C1)Br Z49568330 [0,0,0,0,0,0|3,0,1]=4 61 B10R1.1 O/N=C/C1=CC=C(C=C1)Cl Z49568332 [0,0,0,0,0,0|3,0,1]=4 62 B10R1.1 O/N=C/C1=CC=C(C=C1)F Z49568341 [0,0,0,0,0,0|3,0,1]=4 63 B10R1.1 O/N=C/C1=CC=C(C=C1)O Z49568314 [0,0,0,0,0,0|2,0,1]=3 64 B10R1.1 O=C1N=CC(=CN1)CCO Z2096659590 [0,0,0,0,0,0|3,0,1]=4 65 B10R1.1 O=C=NC1=CC=C(C=C1)Br Z316172584 [0,0,0,0,0,0|3,0,1]=4 66 B10R1.1 O=C=NC1=CC=C(C=C1)Cl Z104472166 [0,0,0,0,0,0|3,0,1]=4 67 B10R1.1 O=CCC1=CC=C(C=C1)Br Z1079442512 [0,0,0,0,0,0|2,0,1]=3 68 B10R1.1 O=CCC1=CC=C(C=C1)Cl Z993017718 [0,0,0,0,0,0|2,0,1]=3 69 B10R1.1 O=CCC1=CC=C(C=C1)F Z993017752 [0,0,0,0,0,0|2,0,1]=3 70 B10R1.1 O=CNC1=CC=C(C=C1)O Z87002541 [0,0,0,0,0,0|2,0,1]=3 71 B10R1.1 OCCC1=CC=C(C=C1)Br Z397587340 [0,0,0,0,0,0|2,0,0]=2 72 B10R1.1 OCCC1=CC=C(C=C1)F Z397587326 [0,0,0,0,0,0|2,0,0]=2 73 B10R1.1 OCCC1=CC=C(C=C1)O Z1250886919 [0,0,0,0,0,0|1,0,0]=1 74 B10R1.1 [N-]=[N+]=NC1=CC=C(C=C1)Br Z235340111 [0,0,0,0,0,0|4,0,0]=4 75 B9R1.1 CC1=CC=C(C=C1)C#N Z56965882 [1,0,0,0,0,0|2,0,1]=4 76 B9R1.1 CC1=CC=C(C=C1)C=O Z104477698 [1,0,0,0,0,0|2,0,1]=4 77 B9R1.1 CC1=CC=C(C=C1)NN Z56911942 [1,0,0,0,0,0|3,0,0]=4 78 B9R1.1 CC1=CN=C(C=C1)CO Z1198270889 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.1 CC1=NC=C(C=C1)CN Z444349734 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.1 CC1=NC=C(C=C1)CO Z397587474 [1,0,0,0,0,0|3,0,0]=4 81 B9R1.1 CCC1=CC=C(C=C1)I Z381540768 [1,0,0,0,0,0|1,0,0]=2 82 B9R1.1 CCC1=CC=C(C=C1)N Z104477836 [1,0,0,0,0,0|1,0,0]=2 83 B9R1.1 CCC1=CC=C(C=C1)O Z104479728 [1,0,0,0,0,0|0,0,0]=1 84 B9R1.1 CCC1=CN=C(C=C1)N Z1198224278 [1,0,0,0,0,0|2,0,0]=3 85 B9R1.1 CCC1=CN=C(N=C1)Br Z1255367602 [1,0,0,0,0,0|3,0,0]=4 86 B9R1.1 CCC1=CN=C(N=C1)Cl Z1255423971 [1,0,0,0,0,0|3,0,0]=4 87 B9R1.1 CCC1=CN=C(N=C1)N Z1137168329 [1,0,0,0,0,0|3,0,0]=4 88 B9R1.1 CCC1=NC=C(C=N1)N Z381402598 [1,0,0,0,0,0|3,0,0]=4 89 B9R1.1 CCC1=NC=C(N=C1)Br Z1198319305 [1,0,0,0,0,0|3,0,0]=4 90 B9R1.1 CNC1=CC=C(C=C1)I Z744582716 [1,0,0,0,0,0|2,0,0]=3 91 B9R1.1 CNC1=CC=C(C=C1)O Z940713298 [1,0,0,0,0,0|1,0,0]=2 92 B9R1.1 CNC1=NC=C(C=C1)Br Z359297630 [1,0,0,0,0,0|3,0,0]=4 93 B9R1.1 CNC1=NC=C(C=C1)C Z359297596 [1,0,0,0,0,0|3,0,0]=4 94 B9R1.1 CNC1=NC=C(C=C1)Cl Z359297632 [1,0,0,0,0,0|3,0,0]=4 95 B9R1.1 CNC1=NC=C(C=C1)F Z802823886 [1,0,0,0,0,0|3,0,0]=4 96 B9R1.1 COC1=CC=C(C=C1)C Z53834227 [1,0,0,0,0,0|2,0,0]=3 97 B9R1.1 COC1=CC=C(C=C1)F Z53834743 [1,0,0,0,0,0|2,0,0]=3 98 B9R1.1 COC1=CC=C(C=C1)N Z56938150 [1,0,0,0,0,0|2,0,0]=3 99 B9R1.1 COC1=CC=C(C=C1)O Z104474598 [1,0,0,0,0,0|1,0,0]=2 100 B9R1.1 COC1=CN=C(C=C1)C Z1198232754 [1,0,0,0,0,0|3,0,0]=4 101 B9R1.1 COC1=NC=C(C=C1)Br Z808608370 [1,0,0,0,0,0|3,0,0]=4 102 B9R1.1 COC1=NC=C(C=C1)Cl Z1094698482 [1,0,0,0,0,0|3,0,0]=4 103 B9R1.1 COC1=NC=C(C=C1)N Z56899049 [1,0,0,0,0,0|3,0,0]=4 104 B9R1.1 COC1=NC=C(C=C1)O Z1201623942 [1,0,0,0,0,0|2,0,0]=3 105 B9R1.1 CSC1=CC=C(C=C1)N Z104511114 [1,0,0,0,0,0|2,0,0]=3 106 B9R1.1 CSC1=CN=C(C=C1)N Z412025068 [1,0,0,0,0,0|3,0,0]=4 107 B9R1.1 CSC1=NC=C(C=C1)N Z412022842 [1,0,0,0,0,0|3,0,0]=4 108 B9R1.1 CSC1=NC=C(C=N1)O Z1198152371 [1,0,0,0,0,0|3,0,0]=4 109 B9R1.1 FC1=CC=C(C=C1)CBr Z89269613 [1,0,0,0,0,0|2,0,0]=3 110 B9R1.1 N#CC1=CC=C(C=C1)Br Z55928801 [1,0,0,0,0,0|2,0,1]=4 111 B9R1.1 N#CC1=CC=C(C=C1)Cl Z56942044 [1,0,0,0,0,0|2,0,1]=4 112 B9R1.1 N#CC1=CC=C(C=C1)I Z57899725 [1,0,0,0,0,0|2,0,1]=4 113 B9R1.1 N#CC1=CC=C(C=C1)N Z57073771 [1,0,0,0,0,0|2,0,1]=4 114 B9R1.1 N#CC1=CC=C(C=C1)O Z104473840 [1,0,0,0,0,0|1,0,1]=3 115 B9R1.1 NC1=NC=C(C=C1)CO Z960446254 [1,0,0,0,0,0|3,0,0]=4 116 B9R1.1 NCC1=CC=C(C=C1)F Z54748266 [1,0,0,0,0,0|2,0,0]=3 117 B9R1.1 NCC1=CC=C(C=C1)O Z235348101 [1,0,0,0,0,0|1,0,0]=2 118 B9R1.1 NCC1=CN=C(C=C1)Cl Z247612574 [1,0,0,0,0,0|3,0,0]=4 119 B9R1.1 NCC1=CN=C(C=C1)F Z1198311144 [1,0,0,0,0,0|3,0,0]=4 120 B9R1.1 NCC1=CN=C(C=C1)O Z1269638445 [1,0,0,0,0,0|2,0,0]=3 121 B9R1.1 NCC1=NC=C(C=C1)Br Z3241254216 [1,0,0,0,0,0|3,0,0]=4 122 B9R1.1 NCC1=NC=C(C=C1)Cl Z636367336 [1,0,0,0,0,0|3,0,0]=4 123 B9R1.1 NCC1=NC=C(C=C1)F Z1198277779 [1,0,0,0,0,0|3,0,0]=4 124 B9R1.1 NCC1=NC=C(C=C1)N Z3244746175 [1,0,0,0,0,0|3,0,0]=4 125 B9R1.1 NCC1=NC=C(C=C1)O Z3324887230 [1,0,0,0,0,0|2,0,0]=3 126 B9R1.1 NNC1=CC=C(C=C1)Cl Z56776889 [1,0,0,0,0,0|3,0,0]=4 127 B9R1.1 O=CC1=CC=C(C=C1)Br Z57162109 [1,0,0,0,0,0|2,0,1]=4 128 B9R1.1 O=CC1=CC=C(C=C1)Cl Z57772447 [1,0,0,0,0,0|2,0,1]=4 129 B9R1.1 O=CC1=CC=C(C=C1)F Z104472914 [1,0,0,0,0,0|2,0,1]=4 130 B9R1.1 O=CC1=CC=C(C=C1)I Z57887684 [1,0,0,0,0,0|2,0,1]=4 131 B9R1.1 O=CC1=CC=C(C=C1)O Z57127520 [1,0,0,0,0,0|1,0,1]=3 132 B9R1.1 O=CC1=CC=C(C=C1)S Z1198150788 [1,0,0,0,0,0|1,1,1]=4 133 B9R1.1 O=CC1=CN=C(C=C1)O Z1741969170 [1,0,0,0,0,0|2,0,1]=4 134 B9R1.1 O=CC1=NC=C(C=C1)O Z1741979912 [1,0,0,0,0,0|2,0,1]=4 135 B9R1.1 OCC1=CC=C(C=C1)Br Z335244742 [1,0,0,0,0,0|2,0,0]=3 136 B9R1.1 OCC1=CC=C(C=C1)Cl Z104478032 [1,0,0,0,0,0|2,0,0]=3 137 B9R1.1 OCC1=CC=C(C=C1)F Z104477460 [1,0,0,0,0,0|2,0,0]=3 138 B9R1.1 OCC1=CC=C(C=C1)I Z385370342 [1,0,0,0,0,0|2,0,0]=3 139 B9R1.1 OCC1=NC=C(C=C1)Br Z1065600752 [1,0,0,0,0,0|3,0,0]=4 140 B9R1.1 OCC1=NC=C(C=C1)Cl Z1198272591 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.1 OCC1=NC=C(C=C1)O Z1217915045 [1,0,0,0,0,0|2,0,0]=3 142 B9R1.1 SCC1=CC=C(C=C1)Cl Z55948216 [1,0,0,0,0,0|2,0,0]=3 143 B9R1.8 CCCC1=CC=CC=C1 Z104479154 [1,0,0,0,0,0|0,0,0]=1 144 B9R1.8 CCCC1=NC=CC=C1 Z1255434741 [1,0,0,0,0,0|1,0,0]=2 145 B9R1.8 CCCC1=NN=CC=C1 Z1486025396 [1,0,0,0,0,0|2,0,0]=3 146 B9R1.8 CCNC1=CC=CC=C1 Z104472482 [1,0,0,0,0,0|1,0,0]=2 147 B9R1.8 CCNC1=CC=NC=C1 Z359297730 [1,0,0,0,0,0|2,0,0]=3 148 B9R1.8 CCNC1=CN=CC=C1 Z334882416 [1,0,0,0,0,0|2,0,0]=3 149 B9R1.8 CCNC1=NN=CC=C1 Z991530898 [1,0,0,0,0,0|3,0,0]=4 150 B9R1.8 CCSC1=CC=NC=C1 Z1376454759 [1,0,0,0,0,0|2,0,0]=3 151 B9R1.8 CNCC1=CC=NC=C1 Z57390007 [1,0,0,0,0,0|2,0,0]=3 152 B9R1.8 CNCC1=CN=CC=C1 Z56963341 [1,0,0,0,0,0|2,0,0]=3 153 B9R1.8 CNCC1=NC=CC=N1 Z2310727788 [1,0,0,0,0,0|3,0,0]=4 154 B9R1.8 CNCC1=NC=CN=C1 Z385447136 [1,0,0,0,0,0|3,0,0]=4 155 B9R1.8 CNCC1=NC=NC=C1 Z2871313713 [1,0,0,0,0,0|3,0,0]=4 156 B9R1.8 CSCC1=CN=CC=C1 Z599631354 [1,0,0,0,0,0|2,0,0]=3 157 B9R1.8 N#CCC1=CN=CC=C1 Z239871646 [1,0,0,0,0,0|2,0,1]=4 158 B9R1.8 N#CCC1=NC=CC=C1 Z104476888 [1,0,0,0,0,0|2,0,1]=4 159 B9R1.8 N#COC1=CC=CC=C1 Z1198165353 [1,0,0,0,0,0|2,0,1]=4 160 B9R1.8 NCCC1=CC=NC=C1 Z241056520 [1,0,0,0,0,0|2,0,0]=3 161 B9R1.8 NCCC1=CN=CC=C1 Z241056524 [1,0,0,0,0,0|2,0,0]=3 162 B9R1.8 NCCC1=CN=NC=C1 Z3070743015 [1,0,0,0,0,0|3,0,0]=4 163 B9R1.8 NCCC1=NC=CC=C1 Z104478200 [1,0,0,0,0,0|2,0,0]=3 164 B9R1.8 NCCC1=NC=CN=C1 Z1925930460 [1,0,0,0,0,0|3,0,0]=4 165 B9R1.8 NCCC1=NC=NC=C1 Z2935002210 [1,0,0,0,0,0|3,0,0]=4 166 B9R1.8 NNCC1=CC=CC=C1 Z56969306 [1,0,0,0,0,0|2,0,0]=3 167 B9R1.8 NNCC1=CN=CC=C1 Z370706826 [1,0,0,0,0,0|3,0,0]=4 168 B9R1.8 NOCC1=CC=CC=C1 Z90668722 [1,0,0,0,0,0|2,0,0]=3 169 B9R1.8 O=CCC1=CC=CC=C1 Z104472146 [1,0,0,0,0,0|1,0,1]=3 170 B9R1.8 OCCC1=CC=CC=C1 Z104473586 [1,0,0,0,0,0|1,0,0]=2 171 B9R1.8 OCCC1=CN=CC=C1 Z992949518 [1,0,0,0,0,0|2,0,0]=3 172 B9R1.8 OCCC1=NC=CC=C1 Z104473592 [1,0,0,0,0,0|2,0,0]=3 173 B9R1.8 OCCC1=NC=CN=C1 Z234895105 [1,0,0,0,0,0|3,0,0]=4 174 B9R1.8 OCCC1=NC=NC=C1 Z1250886882 [1,0,0,0,0,0|3,0,0]=4 175 B9R1.8 S=C=NC1=CC=CC=C1 Z56904678 [1,0,0,0,0,0|2,0,1]=4 176 B11R1.1 BrCCOC1=CC=C(C=C1)Br Z56887702 [0,1,0,0,0,0|2,0,0]=3 177 B11R1.1 C#CCNC1=CC=C(C=C1)C Z266486858 [0,1,0,0,0,0|1,0,2]=4 178 B11R1.1 C#CCNC1=CC=C(C=C1)Cl Z3210379676 [0,1,0,0,0,0|1,0,2]=4 179 B11R1.1 C#CCNC1=CC=C(C=C1)F Z3210380008 [0,1,0,0,0,0|1,0,2]=4 180 B11R1.1 C#CCOC1=CC=C(C=C1)Br Z54475590 [0,1,0,0,0,0|1,0,2]=4 181 B11R1.1 C#CCOC1=CC=C(C=C1)C Z54775509 [0,1,0,0,0,0|1,0,2]=4 182 B11R1.1 C#CCOC1=CC=C(C=C1)Cl Z54472184 [0,1,0,0,0,0|1,0,2]=4 183 B11R1.1 C#CCOC1=CC=C(C=C1)F Z54473259 [0,1,0,0,0,0|1,0,2]=4 184 B11R1.1 C#CCOC1=CC=C(C=C1)N Z730512948 [0,1,0,0,0,0|1,0,2]=4 185 B11R1.1 C=CCOC1=CC=C(C=C1)O Z381414818 [0,1,0,0,0,0|0,0,2]=3 186 B11R1.1 CC1=CC=C(C=C1)CCCN Z4639316723 [0,1,0,0,0,0|1,0,0]=2 187 B11R1.1 CC1=CC=C(C=C1)NCC#N Z56855172 [0,1,0,0,0,0|2,0,1]=4 188 B11R1.1 CC1=CC=C(C=C1)OCCBr Z56886357 [0,1,0,0,0,0|2,0,0]=3 189 B11R1.1 CC1=CC=C(C=C1)OCCN Z54747869 [0,1,0,0,0,0|2,0,0]=3 190 B11R1.1 CC1=CC=C(C=C1)SCC#N Z54591058 [0,1,0,0,0,0|2,0,1]=4 191 B11R1.1 CC1=CC=C(C=C1)SCCCl Z90122598 [0,1,0,0,0,0|2,0,0]=3 192 B11R1.1 CC1=CC=C(C=C1)SCCO Z149178580 [0,1,0,0,0,0|2,0,0]=3 193 B11R1.1 CC1=CN=C(C=C1)NCCN Z1695797833 [0,1,0,0,0,0|3,0,0]=4 194 B11R1.1 CC1=NC=C(C=C1)CCC=O Z1233208116 [0,1,0,0,0,0|2,0,1]=4 195 B11R1.1 CCCCC1=CC=C(C=C1)N Z104475500 [0,1,0,0,0,0|1,0,0]=2 196 B11R1.1 CCCCC1=CN=C(N=C1)N Z1137168332 [0,1,0,0,0,0|3,0,0]=4 197 B11R1.1 CCCCC1=NC=C(C=N1)N Z1318447164 [0,1,0,0,0,0|3,0,0]=4 198 B11R1.1 CCCNC1=CC=C(C=C1)Cl Z1266933829 [0,1,0,0,0,0|1,0,0]=2 199 B11R1.1 CCCOC1=CC=C(C=C1)N Z239604724 [0,1,0,0,0,0|1,0,0]=2 200 B11R1.1 CCNCC1=CC=C(C=C1)F Z3244655509 [0,1,0,0,0,0|1,0,0]=2 201 B11R1.1 CCOCC1=CC=C(C=C1)Br Z823854370 [0,1,0,0,0,0|1,0,0]=2 202 B11R1.1 CCOCC1=CC=C(C=C1)N Z240084570 [0,1,0,0,0,0|1,0,0]=2 203 B11R1.1 CCSCC1=CC=C(C=C1)N Z332378208 [0,1,0,0,0,0|1,0,0]=2 204 B11R1.1 CNCCC1=CC=C(C=C1)Br Z385447024 [0,1,0,0,0,0|1,0,0]=2 205 B11R1.1 CNCCC1=CC=C(C=C1)C Z5115849578 [0,1,0,0,0,0|1,0,0]=2 206 B11R1.1 CNCCC1=CC=C(C=C1)Cl Z1623872266 [0,1,0,0,0,0|1,0,0]=2 207 B11R1.1 CNCCC1=CC=C(C=C1)F Z138454998 [0,1,0,0,0,0|1,0,0]=2 208 B11R1.1 CNCCC1=NC=C(C=N1)Br Z3023504208 [0,1,0,0,0,0|3,0,0]=4 209 B11R1.1 COCCC1=CC=C(C=C1)Br Z299596190 [0,1,0,0,0,0|1,0,0]=2 210 B11R1.1 COCCC1=CC=C(C=C1)Cl Z1470894103 [0,1,0,0,0,0|1,0,0]=2 211 B11R1.1 COCCC1=CC=C(C=C1)O Z104485614 [0,1,0,0,0,0|0,0,0]=1 212 B11R1.1 COCOC1=CC=C(C=C1)N Z1259226853 [0,1,0,0,0,0|2,0,0]=3 213 B11R1.1 CSCCC1=CC=C(C=C1)N Z732207426 [0,1,0,0,0,0|1,0,0]=2 214 B11R1.1 ClC1=CC=C(C=C1)OCCBr Z56926557 [0,1,0,0,0,0|2,0,0]=3 215 B11R1.1 ClCCSC1=CC=C(C=C1)Cl Z55993025 [0,1,0,0,0,0|2,0,0]=3 216 B11R1.1 FC1=CC=C(C=C1)CN=C=S Z57358375 [0,1,0,0,0,0|2,0,1]=4 217 B11R1.1 FCCOC1=CC=C(C=C1)Br Z1269166672 [0,1,0,0,0,0|2,0,0]=3 218 B11R1.1 N#CCCC1=CC=C(C=C1)N Z4750298565 [0,1,0,0,0,0|1,0,1]=3 219 B11R1.1 N#CCNC1=CC=C(C=C1)Br Z266466556 [0,1,0,0,0,0|2,0,1]=4 220 B11R1.1 N#CCOC1=CC=C(C=C1)Cl Z54608574 [0,1,0,0,0,0|2,0,1]=4 221 B11R1.1 N#CCOC1=CC=C(C=C1)F Z53791434 [0,1,0,0,0,0|2,0,1]=4 222 B11R1.1 N#CCOC1=CC=C(C=C1)N Z57052858 [0,1,0,0,0,0|2,0,1]=4 223 B11R1.1 N#CCSC1=CC=C(C=C1)Br Z18744575 [0,1,0,0,0,0|2,0,1]=4 224 B11R1.1 N#CCSC1=CC=C(C=C1)Cl Z19728982 [0,1,0,0,0,0|2,0,1]=4 225 B11R1.1 N#CCSC1=CC=C(C=C1)F Z16034822 [0,1,0,0,0,0|2,0,1]=4 226 B11R1.1 NC/C=C/C1=CC=C(C=C1)Br Z2235681463 [0,1,0,0,0,0|1,0,2]=4 227 B11R1.1 NC1=CC=C(C=C1)OCCF Z1262631146 [0,1,0,0,0,0|2,0,0]=3 228 B11R1.1 NC1=CC=C(C=C1)OCCO Z332379386 [0,1,0,0,0,0|2,0,0]=3 229 B11R1.1 NCC#CC1=CC=C(C=C1)I Z4775597113 [0,1,0,0,0,0|1,0,2]=4 230 B11R1.1 NCCCC1=CC=C(C=C1)Br Z3980240042 [0,1,0,0,0,0|1,0,0]=2 231 B11R1.1 NCCCC1=CC=C(C=C1)Cl Z992716848 [0,1,0,0,0,0|1,0,0]=2 232 B11R1.1 NCCCC1=CC=C(C=C1)F Z3244753845 [0,1,0,0,0,0|1,0,0]=2 233 B11R1.1 NCCCC1=CC=C(C=C1)N Z5453008768 [0,1,0,0,0,0|1,0,0]=2 234 B11R1.1 NCCCC1=CC=C(C=C1)O Z1270210797 [0,1,0,0,0,0|0,0,0]=1 235 B11R1.1 NCCNC1=CC=C(C=C1)O Z3386315806 [0,1,0,0,0,0|1,0,0]=2 236 B11R1.1 NCCOC1=CC=C(C=C1)Br Z1262237188 [0,1,0,0,0,0|2,0,0]=3 237 B11R1.1 NCCOC1=CC=C(C=C1)Cl Z85957193 [0,1,0,0,0,0|2,0,0]=3 238 B11R1.1 NCCOC1=CC=C(C=C1)F Z87000937 [0,1,0,0,0,0|2,0,0]=3 239 B11R1.1 NCCOC1=CC=C(C=C1)I Z381428104 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.1 NCCOC1=NC=C(C=C1)Cl Z1421528823 [0,1,0,0,0,0|3,0,0]=4 241 B11R1.1 NCCSC1=CC=C(C=C1)Br Z262221984 [0,1,0,0,0,0|2,0,0]=3 242 B11R1.1 NCCSC1=CC=C(C=C1)Cl Z54751093 [0,1,0,0,0,0|2,0,0]=3 243 B11R1.1 NCCSC1=CC=C(C=C1)F Z1267773811 [0,1,0,0,0,0|2,0,0]=3 244 B11R1.1 O=CCCC1=CC=C(C=C1)Br Z993017756 [0,1,0,0,0,0|1,0,1]=3 245 B11R1.1 O=CCCC1=CC=C(C=C1)Cl Z993017742 [0,1,0,0,0,0|1,0,1]=3 246 B11R1.1 O=CCCC1=CC=C(C=C1)F Z993017748 [0,1,0,0,0,0|1,0,1]=3 247 B11R1.1 O=CCOC1=CC=C(C=C1)F Z854102568 [0,1,0,0,0,0|2,0,1]=4 248 B11R1.1 O=CCSC1=CC=C(C=C1)F Z854102782 [0,1,0,0,0,0|2,0,1]=4 249 B11R1.1 OC/C=C/C1=CC=C(C=C1)O Z2235811101 [0,1,0,0,0,0|0,0,2]=3 250 B11R1.1 OCC#CC1=CC=C(C=C1)Cl Z540350074 [0,1,0,0,0,0|1,0,2]=4 251 B11R1.1 OCCCC1=CC=C(C=C1)F Z992949550 [0,1,0,0,0,0|1,0,0]=2 252 B11R1.1 OCCNC1=CC=C(C=C1)Br Z335275406 [0,1,0,0,0,0|2,0,0]=3 253 B11R1.1 OCCNC1=NC=C(C=C1)I Z1269164771 [0,1,0,0,0,0|3,0,0]=4 254 B11R1.1 OCCOC1=CC=C(C=C1)Br Z335092354 [0,1,0,0,0,0|2,0,0]=3 255 B11R1.1 OCCOC1=CC=C(C=C1)O Z381414946 [0,1,0,0,0,0|1,0,0]=2 256 B11R1.1 OCCOC1=NC=C(C=C1)Br Z808609020 [0,1,0,0,0,0|3,0,0]=4 257 B11R1.1 OCCSC1=CC=C(C=C1)Br Z149190682 [0,1,0,0,0,0|2,0,0]=3 258 B11R1.1 OCCSC1=CC=C(C=C1)Cl Z149162370 [0,1,0,0,0,0|2,0,0]=3 259 B11R1.20 C/[N+](=C/C1=CC=C(C=C1)Br)/[O-] Z57107891 [0,1,0,0,0,0|2,0,1]=4 260 B11R1.20 C/[N+](=C/C1=CC=C(C=C1)Cl)/[O-] Z57107890 [0,1,0,0,0,0|2,0,1]=4 261 B11R1.20 CC(=O)CC1=CC=C(C=C1)F Z329711590 [0,1,0,0,0,0|1,0,1]=3 262 B11R1.20 CC(=O)NC1=CC=C(C=C1)C Z28134680 [0,1,0,0,0,0|2,0,1]=4 263 B11R1.20 CC(=O)NC1=CC=C(C=C1)Cl Z28161730 [0,1,0,0,0,0|2,0,1]=4 264 B11R1.20 CC(=O)NC1=CC=C(C=C1)F Z27805821 [0,1,0,0,0,0|2,0,1]=4 265 B11R1.20 CC(=O)NC1=CC=C(C=C1)I Z30316374 [0,1,0,0,0,0|2,0,1]=4 266 B11R1.20 CC(=O)NC1=CC=C(C=C1)N Z56926521 [0,1,0,0,0,0|2,0,1]=4 267 B11R1.20 CC(=O)NC1=CC=C(C=C1)O Z56946051 [0,1,0,0,0,0|1,0,1]=3 268 B11R1.20 CC(=O)NC1=CC=C(C=C1)S Z104484984 [0,1,0,0,0,0|1,1,1]=4 269 B11R1.20 CC(=O)OC1=CC=C(C=C1)O Z1198155166 [0,1,0,0,0,0|1,0,1]=3 270 B11R1.20 CC(=S)NC1=CC=C(C=C1)F Z56756640 [0,1,0,0,0,0|2,0,1]=4 271 B11R1.20 CC(C)CC1=CC=C(C=C1)N Z1463350056 [0,1,0,0,0,0|1,0,0]=2 272 B11R1.20 CC(C)CC1=NC=C(C=C1)Br Z1269179231 [0,1,0,0,0,0|2,0,0]=3 273 B11R1.20 CC(C)CC1=NC=C(C=N1)N Z381402572 [0,1,0,0,0,0|3,0,0]=4 274 B11R1.20 CC(C)NC1=CC=C(C=C1)Cl Z993967140 [0,1,0,0,0,0|2,0,0]=3 275 B11R1.20 CC(C)NC1=CC=C(C=C1)F Z266481896 [0,1,0,0,0,0|2,0,0]=3 276 B11R1.20 CC(C)NC1=NC=C(C=C1)Br Z359297038 [0,1,0,0,0,0|3,0,0]=4 277 B11R1.20 CC(C)OC1=CC=C(C=C1)Br Z53834735 [0,1,0,0,0,0|2,0,0]=3 278 B11R1.20 CC(C)OC1=CC=C(C=C1)I Z54181200 [0,1,0,0,0,0|2,0,0]=3 279 B11R1.20 CC(C)OC1=NC=C(C=C1)Br Z808608768 [0,1,0,0,0,0|3,0,0]=4 280 B11R1.20 CC(N)CC1=CC=C(C=C1)O Z57102382 [0,1,0,0,0,0|0,0,0]=1 281 B11R1.20 CC1=CC=C(C=C1)CC(=N)N Z3244909870 [0,1,0,0,0,0|2,0,1]=4 282 B11R1.20 CC1=CC=C(C=C1)CC(=O)O Z104507548 [0,1,0,0,0,0|2,0,1]=4 283 B11R1.20 CC1=CC=C(C=C1)NC(C)C Z992717194 [0,1,0,0,0,0|2,0,0]=3 284 B11R1.20 CC1=CC=C(C=C1)OC(C)C Z53834229 [0,1,0,0,0,0|2,0,0]=3 285 B11R1.20 CN(C)CC1=CC=C(C=C1)N Z228584348 [0,1,0,0,0,0|2,0,0]=3 286 B11R1.20 CN(C)CC1=CN=C(C=C1)N Z1723849137 [0,1,0,0,0,0|3,0,0]=4 287 B11R1.20 FC(F)SC1=CC=C(C=C1)Cl Z55625938 [0,1,0,0,0,0|3,0,0]=4 288 B11R1.20 FC1=CC=C(C=C1)OC(F)F Z55671914 [0,1,0,0,0,0|3,0,0]=4 289 B11R1.20 N=C(N)CC1=CC=C(C=C1)Br Z1518844582 [0,1,0,0,0,0|2,0,1]=4 290 B11R1.20 N=C(N)CC1=CC=C(C=C1)F Z415636754 [0,1,0,0,0,0|2,0,1]=4 291 B11R1.20 NC(=O)CC1=CC=C(C=C1)Br Z33546958 [0,1,0,0,0,0|2,0,1]=4 292 B11R1.20 NC(=O)CC1=CC=C(C=C1)Cl Z33546677 [0,1,0,0,0,0|2,0,1]=4 293 B11R1.20 NC(=O)CC1=CC=C(C=C1)F Z33546755 [0,1,0,0,0,0|2,0,1]=4 294 B11R1.20 NC(=O)CC1=CC=C(C=C1)N Z234895133 [0,1,0,0,0,0|2,0,1]=4 295 B11R1.20 NC(=S)CC1=CC=C(C=C1)F Z285131734 [0,1,0,0,0,0|2,0,1]=4 296 B11R1.20 NC1=CC=C(C=C1)CC(=O)O Z104481066 [0,1,0,0,0,0|2,0,1]=4 297 B11R1.20 NC1=CC=C(C=C1)OC(F)F Z56899041 [0,1,0,0,0,0|3,0,0]=4 298 B11R1.20 NC1=CC=C(C=C1)SC(F)F Z335451374 [0,1,0,0,0,0|3,0,0]=4 299 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)Cl Z217293314 [0,1,0,0,0,0|2,0,1]=4 300 B11R1.20 O=C(O)CC1=CC=C(C=C1)Br Z90121253 [0,1,0,0,0,0|2,0,1]=4 301 B11R1.20 O=C(O)CC1=CC=C(C=C1)Cl Z104477676 [0,1,0,0,0,0|2,0,1]=4 302 B11R1.20 O=C(O)CC1=CC=C(C=C1)F Z104477312 [0,1,0,0,0,0|2,0,1]=4 303 B11R1.22 C#CC(N)C1=CC=C(C=C1)Br Z3378112680 [0,1,0,0,0,0|1,0,2]=4 304 B11R1.22 C=C(CO)C1=CC=C(C=C1)C Z1896562587 [0,1,0,0,0,0|2,0,1]=4 305 B11R1.22 C=CC(=O)C1=CC=C(C=C1)O Z1416178613 [0,1,0,0,0,0|0,0,3]=4 306 B11R1.22 CC(C#N)C1=CC=C(C=C1)Br Z1269233209 [0,1,0,0,0,0|2,0,1]=4 307 B11R1.22 CC(C#N)C1=CC=C(C=C1)Cl Z1198147665 [0,1,0,0,0,0|2,0,1]=4 308 B11R1.22 CC(C=O)C1=CC=C(C=C1)Br Z1269114153 [0,1,0,0,0,0|2,0,1]=4 309 B11R1.22 CC(C=O)C1=CC=C(C=C1)Cl Z1198334992 [0,1,0,0,0,0|2,0,1]=4 310 B11R1.22 CC(C=O)C1=CC=C(C=C1)F Z1255400140 [0,1,0,0,0,0|2,0,1]=4 311 B11R1.22 CC(CN)C1=CC=C(C=C1)Br Z2906280360 [0,1,0,0,0,0|2,0,0]=3 312 B11R1.22 CC(CN)C1=CC=C(C=C1)F Z415654954 [0,1,0,0,0,0|2,0,0]=3 313 B11R1.22 CC(CO)C1=CC=C(C=C1)F Z1255440783 [0,1,0,0,0,0|2,0,0]=3 314 B11R1.22 CC1=CC=C(C=C1)C(=O)CBr Z104481640 [0,1,0,0,0,0|2,0,1]=4 315 B11R1.22 CC1=CC=C(C=C1)C(=O)CCl Z56886309 [0,1,0,0,0,0|2,0,1]=4 316 B11R1.22 CC1=CC=C(C=C1)C(=O)CN Z275368898 [0,1,0,0,0,0|2,0,1]=4 317 B11R1.22 CC1=CC=C(C=C1)C(=O)CO Z228585628 [0,1,0,0,0,0|2,0,1]=4 318 B11R1.22 CC1=CC=C(C=C1)C(C)C#N Z415654732 [0,1,0,0,0,0|2,0,1]=4 319 B11R1.22 CC1=CC=C(C=C1)C(C)C=O Z1198150045 [0,1,0,0,0,0|2,0,1]=4 320 B11R1.22 CC1=CC=C(C=C1)C(C)CN Z415654970 [0,1,0,0,0,0|2,0,0]=3 321 B11R1.22 CC1=CC=C(C=C1)C(N)CF Z2474474695 [0,1,0,0,0,0|2,0,0]=3 322 B11R1.22 CC1=CC=C(C=C1)C(N)CO Z5087131901 [0,1,0,0,0,0|2,0,0]=3 323 B11R1.22 CC1=CC=C(C=C1)C(O)CN Z336086536 [0,1,0,0,0,0|2,0,0]=3 324 B11R1.22 CC1=CC=C(C=C1)[C@@H](O)CN Z1895741843 [0,1,0,0,0,0|2,0,0]=3 325 B11R1.22 CCC(=O)C1=CC=C(C=C1)Br Z104485724 [0,1,0,0,0,0|1,0,1]=3 326 B11R1.22 CCC(=O)C1=CC=C(C=C1)Cl Z104477486 [0,1,0,0,0,0|1,0,1]=3 327 B11R1.22 CCC(=O)C1=CC=C(C=C1)F Z104477898 [0,1,0,0,0,0|1,0,1]=3 328 B11R1.22 CCC(=O)C1=CC=C(C=C1)I Z285137052 [0,1,0,0,0,0|1,0,1]=3 329 B11R1.22 CCC(=O)C1=CC=C(C=C1)N Z1203578051 [0,1,0,0,0,0|1,0,1]=3 330 B11R1.22 CCC(=O)C1=CC=C(C=C1)O Z104499156 [0,1,0,0,0,0|0,0,1]=2 331 B11R1.22 CCC(=O)C1=CN=C(C=C1)F Z1216820526 [0,1,0,0,0,0|2,0,1]=4 332 B11R1.22 CCC(=O)C1=NC=C(C=C1)F Z1341677536 [0,1,0,0,0,0|2,0,1]=4 333 B11R1.22 CCC(C)C1=CC=C(C=C1)O Z104484172 [0,1,0,0,0,0|0,0,0]=1 334 B11R1.22 CCC(C)C1=NC=C(C=N1)N Z975823596 [0,1,0,0,0,0|3,0,0]=4 335 B11R1.22 CCC(N)C1=CC=C(C=C1)Br Z90662172 [0,1,0,0,0,0|1,0,0]=2 336 B11R1.22 CCC(N)C1=CC=C(C=C1)C Z90662186 [0,1,0,0,0,0|1,0,0]=2 337 B11R1.22 CCC(N)C1=CC=C(C=C1)Cl Z221421644 [0,1,0,0,0,0|1,0,0]=2 338 B11R1.22 CCC(O)C1=CC=C(C=C1)C Z228586316 [0,1,0,0,0,0|1,0,0]=2 339 B11R1.22 CCC(O)C1=CC=C(C=C1)Cl Z228586168 [0,1,0,0,0,0|1,0,0]=2 340 B11R1.22 CCC(O)C1=CC=C(C=C1)F Z228586174 [0,1,0,0,0,0|1,0,0]=2 341 B11R1.22 CCC(O)C1=CC=C(C=C1)O Z228586170 [0,1,0,0,0,0|0,0,0]=1 342 B11R1.22 CCC(O)C1=NC=C(C=C1)F Z1341678257 [0,1,0,0,0,0|2,0,0]=3 343 B11R1.22 CCS(=O)C1=CC=C(C=C1)F Z1154828228 [0,1,0,0,0,0|2,0,0]=3 344 B11R1.22 CC[C@@H](N)C1=CC=C(C=C1)F Z1626921240 [0,1,0,0,0,0|1,0,0]=2 345 B11R1.22 CC[C@H](N)C1=CC=C(C=C1)F Z1625822291 [0,1,0,0,0,0|1,0,0]=2 346 B11R1.22 CNC(=O)C1=CC=C(C=C1)Br Z30272262 [0,1,0,0,0,0|2,0,1]=4 347 B11R1.22 CNC(=O)C1=CC=C(C=C1)C Z32016517 [0,1,0,0,0,0|2,0,1]=4 348 B11R1.22 CNC(=O)C1=CC=C(C=C1)Cl Z32016366 [0,1,0,0,0,0|2,0,1]=4 349 B11R1.22 CNC(=O)C1=CC=C(C=C1)I Z30272273 [0,1,0,0,0,0|2,0,1]=4 350 B11R1.22 CNC(=O)C1=CC=C(C=C1)N Z56985799 [0,1,0,0,0,0|2,0,1]=4 351 B11R1.22 CNC(=O)C1=CC=C(C=C1)O Z183855140 [0,1,0,0,0,0|1,0,1]=3 352 B11R1.22 CNC(C)C1=CC=C(C=C1)C Z239628686 [0,1,0,0,0,0|2,0,0]=3 353 B11R1.22 CNC(C)C1=CC=C(C=C1)Cl Z159528172 [0,1,0,0,0,0|2,0,0]=3 354 B11R1.22 CNC(C)C1=CC=C(C=C1)F Z166605480 [0,1,0,0,0,0|2,0,0]=3 355 B11R1.22 CNC(C)C1=CC=C(C=C1)O Z316170374 [0,1,0,0,0,0|1,0,0]=2 356 B11R1.22 CNC(C)C1=NC=C(C=C1)Cl Z1392162358 [0,1,0,0,0,0|3,0,0]=4 357 B11R1.22 COC(=O)C1=CC=C(C=C1)Br Z19682625 [0,1,0,0,0,0|2,0,1]=4 358 B11R1.22 COC(=O)C1=CC=C(C=C1)I Z19776689 [0,1,0,0,0,0|2,0,1]=4 359 B11R1.22 COC(=O)C1=CC=C(C=C1)N Z54178705 [0,1,0,0,0,0|2,0,1]=4 360 B11R1.22 COC(=O)C1=CC=C(C=C1)O Z19674820 [0,1,0,0,0,0|1,0,1]=3 361 B11R1.22 N#CC(N)C1=CC=C(C=C1)Cl Z1262246247 [0,1,0,0,0,0|2,0,1]=4 362 B11R1.22 N#CC(N)C1=CC=C(C=C1)F Z99599728 [0,1,0,0,0,0|2,0,1]=4 363 B11R1.22 N/C(=N\O)/C1=CC=C(C=C1)O Z156964722 [0,1,0,0,0,0|2,0,1]=4 364 B11R1.22 NC(CF)C1=CC=C(C=C1)Cl Z1510155807 [0,1,0,0,0,0|2,0,0]=3 365 B11R1.22 NC(CO)C1=CC=C(C=C1)Br Z2188171600 [0,1,0,0,0,0|2,0,0]=3 366 B11R1.22 NC(CO)C1=CC=C(C=C1)F Z1268152327 [0,1,0,0,0,0|2,0,0]=3 367 B11R1.22 NCC(=O)C1=CC=C(C=C1)Br Z1741980207 [0,1,0,0,0,0|2,0,1]=4 368 B11R1.22 NCC(=O)C1=CC=C(C=C1)Cl Z56928681 [0,1,0,0,0,0|2,0,1]=4 369 B11R1.22 NCC(=O)C1=CC=C(C=C1)F Z275365838 [0,1,0,0,0,0|2,0,1]=4 370 B11R1.22 NCC(=O)C1=CC=C(C=C1)O Z1198177329 [0,1,0,0,0,0|1,0,1]=3 371 B11R1.22 NCC(O)C1=CC=C(C=C1)Cl Z295878600 [0,1,0,0,0,0|2,0,0]=3 372 B11R1.22 NNC(=O)C1=CC=C(C=C1)O Z57036327 [0,1,0,0,0,0|2,0,1]=4 373 B11R1.22 O=C(CBr)C1=CC=C(C=C1)Br Z57708731 [0,1,0,0,0,0|2,0,1]=4 374 B11R1.22 O=C(CBr)C1=CC=C(C=C1)Cl Z104484576 [0,1,0,0,0,0|2,0,1]=4 375 B11R1.22 O=C(CBr)C1=CC=C(C=C1)F Z104495742 [0,1,0,0,0,0|2,0,1]=4 376 B11R1.22 O=C(CCl)C1=CC=C(C=C1)Br Z56886257 [0,1,0,0,0,0|2,0,1]=4 377 B11R1.22 O=C(CCl)C1=CC=C(C=C1)Cl Z104477840 [0,1,0,0,0,0|2,0,1]=4 378 B11R1.22 O=C(CCl)C1=CC=C(C=C1)F Z104478978 [0,1,0,0,0,0|2,0,1]=4 379 B11R1.22 O=C(CCl)C1=CC=C(C=C1)I Z57046985 [0,1,0,0,0,0|2,0,1]=4 380 B11R1.22 O=C(CCl)C1=CC=C(C=C1)O Z104378296 [0,1,0,0,0,0|1,0,1]=3 381 B11R1.22 O=C(CO)C1=CC=C(C=C1)Cl Z906206720 [0,1,0,0,0,0|2,0,1]=4 382 B11R1.81 CC1=C(C=CC(=C1)Br)CC#N Z1269226853 [0,1,0,0,0,0|2,0,1]=4 383 B11R1.81 CC1=C(C=CC(=C1)Cl)CC#N Z1198263432 [0,1,0,0,0,0|2,0,1]=4 384 B11R1.81 CC1=C(C=CC(=C1)F)CC#N Z1198164414 [0,1,0,0,0,0|2,0,1]=4 385 B11R1.81 CC1=C(C=CC(=C1)F)CCN Z959351734 [0,1,0,0,0,0|2,0,0]=3 386 B11R1.81 CC1=CC(=C(C=C1)CC=O)C Z1020787114 [0,1,0,0,0,0|2,0,1]=4 387 B11R1.81 CC1=CC(=C(C=C1)CCN)Br Z4658970056 [0,1,0,0,0,0|2,0,0]=3 388 B11R1.81 CC1=CC(=C(C=C1)CCN)C Z285143724 [0,1,0,0,0,0|2,0,0]=3 389 B11R1.81 CC1=CC(=C(C=C1)CCN)Cl Z5010254329 [0,1,0,0,0,0|2,0,0]=3 390 B11R1.81 CC1=CC(=C(N=C1)CCO)C Z1504687585 [0,1,0,0,0,0|3,0,0]=4 391 B11R1.81 CCNC1=C(C=C(C=C1)C)C Z744754524 [0,1,0,0,0,0|2,0,0]=3 392 B11R1.81 CCNC1=C(C=C(C=C1)C)N Z394649004 [0,1,0,0,0,0|2,0,0]=3 393 B11R1.81 CCNC1=C(C=C(C=C1)Cl)Cl Z4201362307 [0,1,0,0,0,0|2,0,0]=3 394 B11R1.81 CCNC1=C(C=C(C=C1)F)N Z359511462 [0,1,0,0,0,0|2,0,0]=3 395 B11R1.81 CCOC1=C(C=C(C=C1)Br)N Z330803642 [0,1,0,0,0,0|2,0,0]=3 396 B11R1.81 CCOC1=C(C=C(C=C1)Cl)N Z234894877 [0,1,0,0,0,0|2,0,0]=3 397 B11R1.81 CCOC1=C(C=C(C=C1)F)Br Z55027547 [0,1,0,0,0,0|2,0,0]=3 398 B11R1.81 CCOC1=C(C=C(C=C1)F)N Z332375936 [0,1,0,0,0,0|2,0,0]=3 399 B11R1.81 CCOC1=C(C=C(C=C1)N)C Z385462628 [0,1,0,0,0,0|2,0,0]=3 400 B11R1.81 CCOC1=C(C=C(C=C1)N)Cl Z239873338 [0,1,0,0,0,0|2,0,0]=3 401 B11R1.81 CCOC1=C(C=C(C=C1)N)F Z362635048 [0,1,0,0,0,0|2,0,0]=3 402 B11R1.81 CCOC1=C(C=C(C=N1)C)N Z1270646056 [0,1,0,0,0,0|3,0,0]=4 403 B11R1.81 CCOC1=C(N=C(C=C1)N)C Z2583036218 [0,1,0,0,0,0|3,0,0]=4 404 B11R1.81 CCSC1=C(C=C(C=C1)Cl)N Z319450478 [0,1,0,0,0,0|2,0,0]=3 405 B11R1.81 CNCC1=C(C=C(C=C1)Br)Cl Z448247304 [0,1,0,0,0,0|2,0,0]=3 406 B11R1.81 CNCC1=C(C=C(C=C1)C)Br Z5345778789 [0,1,0,0,0,0|2,0,0]=3 407 B11R1.81 CNCC1=C(C=C(C=C1)C)C Z89283370 [0,1,0,0,0,0|2,0,0]=3 408 B11R1.81 CNCC1=C(C=C(C=C1)C)Cl Z5465034350 [0,1,0,0,0,0|2,0,0]=3 409 B11R1.81 CNCC1=C(C=C(C=C1)Cl)Br Z5214955384 [0,1,0,0,0,0|2,0,0]=3 410 B11R1.81 CNCC1=C(C=C(C=C1)Cl)Cl Z56959746 [0,1,0,0,0,0|2,0,0]=3 411 B11R1.81 CNCC1=C(C=C(C=C1)Cl)F Z385446922 [0,1,0,0,0,0|2,0,0]=3 412 B11R1.81 CNCC1=C(C=C(C=C1)F)Br Z1836652109 [0,1,0,0,0,0|2,0,0]=3 413 B11R1.81 CNCC1=C(C=C(C=C1)F)C Z4189742481 [0,1,0,0,0,0|2,0,0]=3 414 B11R1.81 CNCC1=C(C=C(C=C1)F)Cl Z138105392 [0,1,0,0,0,0|2,0,0]=3 415 B11R1.81 CNCC1=C(C=C(C=C1)F)F Z102767946 [0,1,0,0,0,0|2,0,0]=3 416 B11R1.81 CNCC1=C(C=C(C=N1)Cl)Cl Z3304519723 [0,1,0,0,0,0|3,0,0]=4 417 B11R1.81 COCC1=C(C=C(C=C1)Br)F Z823854350 [0,1,0,0,0,0|2,0,0]=3 418 B11R1.81 COCC1=C(C=C(C=C1)O)F Z1551937213 [0,1,0,0,0,0|1,0,0]=2 419 B11R1.81 COCC1=C(N=C(C=C1)N)C Z1262680326 [0,1,0,0,0,0|3,0,0]=4 420 B11R1.81 N#CCC1=C(C=C(C=C1)Br)Cl Z1269172560 [0,1,0,0,0,0|2,0,1]=4 421 B11R1.81 N#CCC1=C(C=C(C=C1)Br)I Z1269139987 [0,1,0,0,0,0|2,0,1]=4 422 B11R1.81 N#CCC1=C(C=C(C=C1)Cl)Br Z1269120223 [0,1,0,0,0,0|2,0,1]=4 423 B11R1.81 N#CCC1=C(C=C(C=C1)Cl)Cl Z104477208 [0,1,0,0,0,0|2,0,1]=4 424 B11R1.81 N#CCC1=C(C=C(C=C1)Cl)F Z1201620925 [0,1,0,0,0,0|2,0,1]=4 425 B11R1.81 N#CCC1=C(C=C(C=C1)F)Cl Z285184576 [0,1,0,0,0,0|2,0,1]=4 426 B11R1.81 N#CCC1=C(C=C(C=C1)F)F Z963395642 [0,1,0,0,0,0|2,0,1]=4 427 B11R1.81 NC1=CC(=C(C=C1)CCO)F Z1255436579 [0,1,0,0,0,0|2,0,0]=3 428 B11R1.81 NCCC1=C(C=C(C=C1)Br)Cl Z4668045321 [0,1,0,0,0,0|2,0,0]=3 429 B11R1.81 NCCC1=C(C=C(C=C1)Br)F Z405046450 [0,1,0,0,0,0|2,0,0]=3 430 B11R1.81 NCCC1=C(C=C(C=C1)Cl)Br Z2941505410 [0,1,0,0,0,0|2,0,0]=3 431 B11R1.81 NCCC1=C(C=C(C=C1)F)Cl Z1267881686 [0,1,0,0,0,0|2,0,0]=3 432 B11R1.81 NCCC1=C(C=C(C=C1)F)F Z285143768 [0,1,0,0,0,0|2,0,0]=3 433 B11R1.81 NCCC1=C(C=C(C=C1)O)O Z1166113553 [0,1,0,0,0,0|1,0,0]=2 434 B11R1.81 NCCC1=C(C=C(C=N1)F)F Z3024735908 [0,1,0,0,0,0|3,0,0]=4 435 B11R1.81 NNCC1=C(C=C(C=C1)Cl)Cl Z367452298 [0,1,0,0,0,0|3,0,0]=4 436 B11R1.81 NOCC1=C(C=C(C=C1)F)Br Z1318533831 [0,1,0,0,0,0|3,0,0]=4 437 B11R1.81 O=CCC1=C(C=C(C=C1)Cl)Cl Z1183459048 [0,1,0,0,0,0|2,0,1]=4 438 B11R1.81 O=CCC1=C(C=C(C=C1)F)Cl Z1183459114 [0,1,0,0,0,0|2,0,1]=4 439 B11R1.81 O=CCC1=C(C=C(C=C1)F)F Z1020790242 [0,1,0,0,0,0|2,0,1]=4 440 B11R1.81 OCCC1=C(C=C(C=C1)F)F Z1020790240 [0,1,0,0,0,0|2,0,0]=3 441 B11R1.81 OCCC1=C(C=C(C=C1)O)O Z1513827466 [0,1,0,0,0,0|1,0,0]=2 442 B11R1.83 C#CC1=CC=C(C=C1)CCN Z4634952920 [0,1,0,0,0,0|2,0,0]=3 443 B11R1.83 C#CC1=CC=C(C=C1)OCC Z1080385490 [0,1,0,0,0,0|2,0,0]=3 444 B11R1.83 C#CC1=CN=C(C=C1)OCC Z1255495748 [0,1,0,0,0,0|3,0,0]=4 445 B11R1.83 C/C=C/C1=CC=C(C=C1)OC Z2315575049 [0,1,0,0,0,0|0,0,2]=3 446 B11R1.83 C=CCC1=CC=C(C=C1)C=O Z1511744017 [0,1,0,0,0,0|0,0,3]=4 447 B11R1.83 CC#CC1=CC=C(C=C1)C=O Z1322793976 [0,1,0,0,0,0|0,0,3]=4 448 B11R1.83 CCC1=CC=C(C=C1)CCN Z285143808 [0,1,0,0,0,0|2,0,0]=3 449 B11R1.83 CCC1=CC=C(C=C1)CCO Z992949606 [0,1,0,0,0,0|2,0,0]=3 450 B11R1.83 CCCC1=CC=C(C=C1)C=O Z147641436 [0,1,0,0,0,0|0,0,1]=2 451 B11R1.83 CCNC1=CC=C(C=C1)C#N Z126933712 [0,1,0,0,0,0|2,0,0]=3 452 B11R1.83 CCNC1=CC=C(C=C1)CC Z286410160 [0,1,0,0,0,0|2,0,0]=3 453 B11R1.83 CCNC1=CC=C(C=C1)CN Z954985480 [0,1,0,0,0,0|2,0,0]=3 454 B11R1.83 CCNC1=CC=C(C=C1)OC Z286371004 [0,1,0,0,0,0|1,0,0]=2 455 B11R1.83 CCNC1=CN=C(C=C1)OC Z334876678 [0,1,0,0,0,0|2,0,0]=3 456 B11R1.83 CCNC1=NC=C(C=C1)C#N Z219104216 [0,1,0,0,0,0|3,0,0]=4 457 B11R1.83 CCOC1=CC=C(C=C1)C#N Z53834532 [0,1,0,0,0,0|2,0,0]=3 458 B11R1.83 CCOC1=CC=C(C=C1)C=O Z53833126 [0,1,0,0,0,0|1,0,1]=3 459 B11R1.83 CCOC1=CC=C(C=C1)NC Z335255846 [0,1,0,0,0,0|2,0,0]=3 460 B11R1.83 CCOC1=CN=C(C=C1)C=O Z1255437994 [0,1,0,0,0,0|2,0,1]=4 461 B11R1.83 CCOC1=NC=C(C=C1)C#N Z295203536 [0,1,0,0,0,0|3,0,0]=4 462 B11R1.83 CCOC1=NC=C(C=C1)C=O Z1198331588 [0,1,0,0,0,0|2,0,1]=4 463 B11R1.83 CCSC1=CC=C(C=C1)C#N Z332378580 [0,1,0,0,0,0|2,0,0]=3 464 B11R1.83 CNCC1=CC=C(C=C1)C#N Z123857104 [0,1,0,0,0,0|2,0,0]=3 465 B11R1.83 CNCC1=CC=C(C=C1)CO Z5435726703 [0,1,0,0,0,0|1,0,0]=2 466 B11R1.83 CNCC1=CC=C(C=C1)OC Z56928625 [0,1,0,0,0,0|1,0,0]=2 467 B11R1.83 CNCC1=CC=C(C=C1)SC Z56960262 [0,1,0,0,0,0|1,1,0]=3 468 B11R1.83 CNCC1=CN=C(C=C1)OC Z2490025030 [0,1,0,0,0,0|2,0,0]=3 469 B11R1.83 CNCC1=NC=C(C=C1)OC Z1849014421 [0,1,0,0,0,0|2,0,0]=3 470 B11R1.83 COC1=CC=C(C=C1)/C=N/O Z49568452 [0,1,0,0,0,0|2,0,1]=4 471 B11R1.83 COC1=CC=C(C=C1)CC#N Z104476452 [0,1,0,0,0,0|1,0,1]=3 472 B11R1.83 COC1=CC=C(C=C1)CC=O Z993017620 [0,1,0,0,0,0|1,0,1]=3 473 B11R1.83 COC1=CC=C(C=C1)CCN Z104476454 [0,1,0,0,0,0|1,0,0]=2 474 B11R1.83 COC1=CC=C(C=C1)N=C=S Z56921427 [0,1,0,0,0,0|2,0,1]=4 475 B11R1.83 COC1=NC=C(C=C1)CC#N Z1198263571 [0,1,0,0,0,0|2,0,1]=4 476 B11R1.83 COC1=NC=C(C=N1)CCO Z1198265089 [0,1,0,0,0,0|3,0,0]=4 477 B11R1.83 COCC1=CC=C(C=C1)C#N Z295205408 [0,1,0,0,0,0|2,0,0]=3 478 B11R1.83 COCC1=CC=C(C=C1)C=O Z1198331617 [0,1,0,0,0,0|1,0,1]=3 479 B11R1.83 COCC1=CC=C(C=C1)CN Z240084734 [0,1,0,0,0,0|2,0,0]=3 480 B11R1.83 COCC1=CC=C(C=C1)CO Z1255394253 [0,1,0,0,0,0|1,0,0]=2 481 B11R1.83 CSC1=CC=C(C=C1)CC#N Z1114998149 [0,1,0,0,0,0|1,1,1]=4 482 B11R1.83 CSC1=CC=C(C=C1)CC=O Z1198331627 [0,1,0,0,0,0|1,1,1]=4 483 B11R1.83 CSCC1=CC=C(C=C1)C#N Z432419878 [0,1,0,0,0,0|2,0,0]=3 484 B11R1.83 CSCC1=CC=C(C=C1)C=O Z2216784275 [0,1,0,0,0,0|1,0,1]=3 485 B11R1.83 CSCC1=CC=C(C=C1)SC Z599630492 [0,1,0,0,0,0|1,1,0]=3 486 B11R1.83 N#CC1=CC=C(C=C1)CCN Z1741971794 [0,1,0,0,0,0|2,0,0]=3 487 B11R1.83 N#CC1=CC=C(C=C1)CCO Z964982550 [0,1,0,0,0,0|2,0,0]=3 488 B11R1.83 N#CCC1=CC=C(C=C1)C=O Z1255373857 [0,1,0,0,0,0|1,0,2]=4 489 B11R1.83 NCCC1=CC=C(C=C1)CO Z3243654196 [0,1,0,0,0,0|1,0,0]=2 490 B11R1.83 O=CC1=CC=C(C=C1)CCF Z1813165432 [0,1,0,0,0,0|1,0,1]=3 491 B11R1.83 O=CC1=CC=C(C=C1)OCF Z4875012342 [0,1,0,0,0,0|2,0,1]=4 492 B11R1.192 CC1=C(C=C(C=C1)CC#N)Br Z1269175660 [0,1,0,0,0,0|2,0,1]=4 493 B11R1.192 CC1=C(C=C(C=C1)CC#N)Cl Z1198263502 [0,1,0,0,0,0|2,0,1]=4 494 B11R1.192 CC1=C(C=C(C=C1)CC=O)C Z993017804 [0,1,0,0,0,0|2,0,1]=4 495 B11R1.192 CC1=C(C=C(C=C1)CCN)C Z2526366647 [0,1,0,0,0,0|2,0,0]=3 496 B11R1.192 CC1=C(C=C(C=C1)CCN)Cl Z4330614334 [0,1,0,0,0,0|2,0,0]=3 497 B11R1.192 CC1=C(C=CC(=C1)CC#N)Br Z1269136507 [0,1,0,0,0,0|2,0,1]=4 498 B11R1.192 CC1=C(C=CC(=C1)CC#N)O Z1255368240 [0,1,0,0,0,0|1,0,1]=3 499 B11R1.192 CC1=C(C=CC(=C1)CC=O)F Z1020779938 [0,1,0,0,0,0|2,0,1]=4 500 B11R1.192 CC1=C(C=CC(=C1)CCN)Br Z1269233616 [0,1,0,0,0,0|2,0,0]=3 501 B11R1.192 CC1=C(C=CC(=C1)CCN)Cl Z1198178622 [0,1,0,0,0,0|2,0,0]=3 502 B11R1.192 CC1=C(C=CC(=C1)CCN)F Z1682072426 [0,1,0,0,0,0|2,0,0]=3 503 B11R1.192 CCNC1=CC(=C(C=C1)C)C Z5214919889 [0,1,0,0,0,0|2,0,0]=3 504 B11R1.192 CCNC1=CC(=C(C=C1)C)F Z2306658828 [0,1,0,0,0,0|2,0,0]=3 505 B11R1.192 CCNC1=CC(=C(C=C1)F)C Z2756154226 [0,1,0,0,0,0|2,0,0]=3 506 B11R1.192 CCNC1=CC(=C(C=C1)F)Cl Z286408112 [0,1,0,0,0,0|2,0,0]=3 507 B11R1.192 CCNC1=CC(=C(C=C1)F)F Z334934070 [0,1,0,0,0,0|2,0,0]=3 508 B11R1.192 CCOC1=CC(=C(C=C1)Br)F Z1185888453 [0,1,0,0,0,0|2,0,0]=3 509 B11R1.192 CCOC1=CC(=C(C=C1)Cl)N Z1255357315 [0,1,0,0,0,0|2,0,0]=3 510 B11R1.192 CCOC1=CC(=C(C=C1)N)F Z2327883785 [0,1,0,0,0,0|2,0,0]=3 511 B11R1.192 CNCC1=CC(=C(C=C1)Br)Br Z6011701708 [0,1,0,0,0,0|2,0,0]=3 512 B11R1.192 CNCC1=CC(=C(C=C1)Br)Cl Z5321384345 [0,1,0,0,0,0|2,0,0]=3 513 B11R1.192 CNCC1=CC(=C(C=C1)C)C Z2238897979 [0,1,0,0,0,0|2,0,0]=3 514 B11R1.192 CNCC1=CC(=C(C=C1)C)Cl Z5390415454 [0,1,0,0,0,0|2,0,0]=3 515 B11R1.192 CNCC1=CC(=C(C=C1)C)F Z385447006 [0,1,0,0,0,0|2,0,0]=3 516 B11R1.192 CNCC1=CC(=C(C=C1)Cl)Cl Z56963342 [0,1,0,0,0,0|2,0,0]=3 517 B11R1.192 CNCC1=CC(=C(C=C1)F)C Z1873867371 [0,1,0,0,0,0|2,0,0]=3 518 B11R1.192 CNCC1=CC(=C(C=C1)F)F Z102767736 [0,1,0,0,0,0|2,0,0]=3 519 B11R1.192 CSCC1=CC(=C(C=C1)Cl)N Z732207352 [0,1,0,0,0,0|2,0,0]=3 520 B11R1.192 N#CCC1=CC(=C(C=C1)Br)Cl Z1269153504 [0,1,0,0,0,0|2,0,1]=4 521 B11R1.192 N#CCC1=CC(=C(C=C1)Cl)Cl Z111875426 [0,1,0,0,0,0|2,0,1]=4 522 B11R1.192 N#CCC1=CC(=C(C=C1)F)Br Z285131462 [0,1,0,0,0,0|2,0,1]=4 523 B11R1.192 N#CCC1=CC(=C(C=C1)F)F Z1187714535 [0,1,0,0,0,0|2,0,1]=4 524 B11R1.192 N#CCC1=CC(=C(C=C1)N)Cl Z1255382501 [0,1,0,0,0,0|2,0,1]=4 525 B11R1.192 NCCC1=CC(=C(C=C1)Br)Cl Z5222342336 [0,1,0,0,0,0|2,0,0]=3 526 B11R1.192 NCCC1=CC(=C(C=C1)Cl)Cl Z285143770 [0,1,0,0,0,0|2,0,0]=3 527 B11R1.192 NCCC1=CC(=C(C=C1)Cl)F Z2681241887 [0,1,0,0,0,0|2,0,0]=3 528 B11R1.192 NCCC1=CC(=C(C=C1)F)Br Z752370708 [0,1,0,0,0,0|2,0,0]=3 529 B11R1.192 NCCC1=CC(=C(C=C1)F)Cl Z4607148848 [0,1,0,0,0,0|2,0,0]=3 530 B11R1.192 NCCC1=CC(=C(C=C1)F)F Z1695670002 [0,1,0,0,0,0|2,0,0]=3 531 B11R1.192 NCCC1=CC(=C(C=C1)O)O Z104474032 [0,1,0,0,0,0|1,0,0]=2 532 B11R1.192 O=CCC1=CC(=C(C=C1)Br)F Z1269156049 [0,1,0,0,0,0|2,0,1]=4 533 B11R1.192 O=CCC1=CC(=C(C=C1)F)F Z1020788676 [0,1,0,0,0,0|2,0,1]=4 534 B11R1.192 OCCC1=CC(=C(C=C1)Br)F Z1450935429 [0,1,0,0,0,0|2,0,0]=3 535 B11R1.192 OCCC1=CC(=C(C=C1)F)F Z1020788674 [0,1,0,0,0,0|2,0,0]=3 536 B11R1.192 OCCC1=CC(=C(C=C1)O)Cl Z1250886915 [0,1,0,0,0,0|1,0,0]=2 537 B9R0.48 CCOC(=O)/C=C/C(=O)O Z2315575179 [0,0,1,0,0,0|3,0,0]=4 538 B11R2.34 BrC1=CC=C(C=C1)C2CO2 Z278165164 [0,0,0,1,0,0|2,0,0]=3 539 B11R2.34 BrC1=CC=C(C=C1)[C@@H]2CO2 Z1198177141 [0,0,0,1,0,0|2,0,0]=3 540 B11R2.34 BrC1=CC=C(C=C1)[C@H]2CO2 Z1198177142 [0,0,0,1,0,0|2,0,0]=3 541 B11R2.34 BrC1=CN=C(C=C1)C2CC2 Z2943484009 [0,0,0,1,0,0|2,0,0]=3 542 B11R2.34 BrC1=NC=C(C=N1)C2CC2 Z1255375372 [0,0,0,1,0,0|3,0,0]=4 543 B11R2.34 BrC1=NC=C(N=C1)C2CC2 Z1198319306 [0,0,0,1,0,0|3,0,0]=4 544 B11R2.34 CC1=CC=C(C=C1)C2CO2 Z278165170 [0,0,0,1,0,0|2,0,0]=3 545 B11R2.34 CC1=NC=C(C=C1)C2CO2 Z1504684436 [0,0,0,1,0,0|3,0,0]=4 546 B11R2.34 ClC1=CC=C(C=C1)C2CO2 Z274971352 [0,0,0,1,0,0|2,0,0]=3 547 B11R2.34 ClC1=CC=C(C=C1)[C@@H]2CO2 Z1255450845 [0,0,0,1,0,0|2,0,0]=3 548 B11R2.34 ClC1=CC=C(C=C1)[C@H]2CO2 Z1198173162 [0,0,0,1,0,0|2,0,0]=3 549 B11R2.34 ClC1=NC=C(C=N1)C2CC2 Z1255437429 [0,0,0,1,0,0|3,0,0]=4 550 B11R2.34 ClC1=NN=C(C=C1)C2CC2 Z1013743432 [0,0,0,1,0,0|3,0,0]=4 551 B11R2.34 FC1=CC=C(C=C1)C2CO2 Z238878272 [0,0,0,1,0,0|2,0,0]=3 552 B11R2.34 FC1=CC=C(C=C1)[C@@H]2CO2 Z1255365381 [0,0,0,1,0,0|2,0,0]=3 553 B11R2.34 FC1=CC=C(C=C1)[C@H]2CO2 Z1255356921 [0,0,0,1,0,0|2,0,0]=3 554 B11R2.34 FC1=CN=C(C=C1)C2CO2 Z1575327880 [0,0,0,1,0,0|3,0,0]=4 555 B11R2.34 NC1=CN=C(N=C1)C2CC2 Z381402574 [0,0,0,1,0,0|3,0,0]=4 556 B11R2.34 NC1=NC=C(C=N1)C2CC2 Z1255436540 [0,0,0,1,0,0|3,0,0]=4 557 B11R2.34 NC1=NN=C(C=C1)C2CC2 Z1013744036 [0,0,0,1,0,0|3,0,0]=4 558 B11R2.34 O=C1C=CC(=NN1)C2CC2 Z1013742704 [0,0,0,1,0,0|2,0,1]=4 559 B11R2.34 OC1=CN=C(N=C1)C2CC2 Z1255433581 [0,0,0,1,0,0|2,0,0]=3 560 B11R2.36 BrC1=CC2=C(C=C1)CC=C2 Z1255379634 [0,0,0,1,0,0|1,0,2]=4 561 B11R2.36 BrC1=CC2=C(C=C1)CCC2 Z359513410 [0,0,0,1,0,0|1,0,0]=2 562 B11R2.36 BrC1=CC2=C(C=C1)CCN2 Z1267773746 [0,0,0,1,0,0|2,0,0]=3 563 B11R2.36 BrC1=CC2=C(C=C1)CCO2 Z1198181832 [0,0,0,1,0,0|2,0,0]=3 564 B11R2.36 BrC1=CC2=C(C=C1)CNC2 Z1694636353 [0,0,0,1,0,0|2,0,0]=3 565 B11R2.36 BrC1=CC2=C(C=C1)COC2 Z1079162022 [0,0,0,1,0,0|2,0,0]=3 566 B11R2.36 BrC1=CC2=C(C=C1)OCC2 Z299596228 [0,0,0,1,0,0|2,0,0]=3 567 B11R2.36 BrC1=CC2=C(C=C1)OCO2 Z1269199980 [0,0,0,1,0,0|3,0,0]=4 568 B11R2.36 BrC1=CC2=C(CCC2)N=C1 Z1198182024 [0,0,0,1,0,0|2,0,0]=3 569 B11R2.36 BrC1=CC2=C(CNC2)N=C1 Z3244825424 [0,0,0,1,0,0|3,0,0]=4 570 B11R2.36 BrC1=CC2=C(COC2)N=C1 Z1269164644 [0,0,0,1,0,0|3,0,0]=4 571 B11R2.36 BrC1=CC2=C(N=C1)NCC2 Z1198169618 [0,0,0,1,0,0|3,0,0]=4 572 B11R2.36 BrC1=CC2=C(N=C1)OCC2 Z1269230252 [0,0,0,1,0,0|3,0,0]=4 573 B11R2.36 BrC1=NC2=C(C=N1)CCC2 Z2311286011 [0,0,0,1,0,0|3,0,0]=4 574 B11R2.36 BrC1=NN=C2CCCC2=C1 Z5348405692 [0,0,0,1,0,0|3,0,0]=4 575 B11R2.36 CC1=CC2=C(C=C1)CCN2 Z1269638555 [0,0,0,1,0,0|2,0,0]=3 576 B11R2.36 CC1=CC2=C(C=C1)CNC2 Z2238336530 [0,0,0,1,0,0|2,0,0]=3 577 B11R2.36 CC1=CC2=C(C=C1)NCC2 Z235539062 [0,0,0,1,0,0|2,0,0]=3 578 B11R2.36 CC1=CC2=C(C=C1)OCO2 Z1255364672 [0,0,0,1,0,0|3,0,0]=4 579 B11R2.36 CC1=CC2=C(CNC2)N=C1 Z4912525222 [0,0,0,1,0,0|3,0,0]=4 580 B11R2.36 CC1=NC=C2CCNC2=C1 Z2651710943 [0,0,0,1,0,0|3,0,0]=4 581 B11R2.36 ClC1=CC2=C(C=C1)CCC2 Z1198234594 [0,0,0,1,0,0|1,0,0]=2 582 B11R2.36 ClC1=CC2=C(C=C1)CCN2 Z926915320 [0,0,0,1,0,0|2,0,0]=3 583 B11R2.36 ClC1=CC2=C(C=C1)CNC2 Z1198319382 [0,0,0,1,0,0|2,0,0]=3 584 B11R2.36 ClC1=CC2=C(C=C1)NCC2 Z235537274 [0,0,0,1,0,0|2,0,0]=3 585 B11R2.36 ClC1=NC2=C(C=N1)CCC2 Z1255467563 [0,0,0,1,0,0|3,0,0]=4 586 B11R2.36 ClC1=NN=C2CCCC2=C1 Z935132412 [0,0,0,1,0,0|3,0,0]=4 587 B11R2.36 FC1=CC2=C(C=C1)CCN2 Z440803576 [0,0,0,1,0,0|2,0,0]=3 588 B11R2.36 FC1=CC2=C(C=C1)CNC2 Z1094758928 [0,0,0,1,0,0|2,0,0]=3 589 B11R2.36 FC1=CC2=C(CCN2)N=C1 Z5452930143 [0,0,0,1,0,0|3,0,0]=4 590 B11R2.36 FC1=CC2=C(N=C1)NCC2 Z2757597421 [0,0,0,1,0,0|3,0,0]=4 591 B11R2.36 FC1=CC2=C(N=C1)OCC2 Z2732449946 [0,0,0,1,0,0|3,0,0]=4 592 B11R2.36 IC1=CC2=C(C=C1)CCC2 Z381540774 [0,0,0,1,0,0|1,0,0]=2 593 B11R2.36 IC1=CC2=C(C=C1)OCO2 Z381540748 [0,0,0,1,0,0|3,0,0]=4 594 B11R2.36 NC1=CC2=C(C=C1)CCO2 Z1203579091 [0,0,0,1,0,0|2,0,0]=3 595 B11R2.36 NC1=CC2=C(C=C1)CCS2 Z1198181342 [0,0,0,1,0,0|2,0,0]=3 596 B11R2.36 NC1=CC2=C(C=C1)CNC2 Z1192340875 [0,0,0,1,0,0|2,0,0]=3 597 B11R2.36 NC1=CC2=C(C=C1)COC2 Z995041906 [0,0,0,1,0,0|2,0,0]=3 598 B11R2.36 NC1=NC2=C(C=C1)CCC2 Z1198183883 [0,0,0,1,0,0|2,0,0]=3 599 B11R2.36 NC1=NC2=C(C=C1)OCC2 Z1203582734 [0,0,0,1,0,0|3,0,0]=4 600 B11R2.36 NC1=NC2=C(C=N1)CCC2 Z1137168278 [0,0,0,1,0,0|3,0,0]=4 601 B11R2.36 O=C1C=C2CCCC2=CN1 Z1255494860 [0,0,0,1,0,0|1,0,1]=3 602 B11R2.36 O=C1C=C2CCCC2=NN1 Z935132918 [0,0,0,1,0,0|2,0,1]=4 603 B11R2.36 O=C1C=CC2=C(N1)CCC2 Z234895263 [0,0,0,1,0,0|1,0,1]=3 604 B11R2.36 OC1=CC2=C(C=C1)C=NN2 Z1198147845 [0,0,0,1,0,0|2,0,1]=4 605 B11R2.36 OC1=CC2=C(C=C1)C=NS2 Z1513829991 [0,0,0,1,0,0|2,0,1]=4 606 B11R2.36 OC1=CC2=C(C=C1)CCN2 Z3241260546 [0,0,0,1,0,0|1,0,0]=2 607 B11R2.36 OC1=CC2=C(C=C1)CNC2 Z2489383861 [0,0,0,1,0,0|1,0,0]=2 608 B11R2.36 OC1=CC2=C(C=C1)NC=C2 Z1203162319 [0,0,0,1,0,0|1,0,2]=4 609 B11R2.36 OC1=CC2=C(C=C1)NC=N2 Z1042386518 [0,0,0,1,0,0|2,0,1]=4 610 B11R2.36 OC1=CC2=C(C=C1)NN=C2 Z1209763128 [0,0,0,1,0,0|2,0,1]=4 611 B11R2.36 OC1=CC2=C(C=C1)OC=N2 Z1198313500 [0,0,0,1,0,0|2,0,1]=4 612 B11R2.36 OC1=CC2=C(C=C1)OCC2 Z1198182902 [0,0,0,1,0,0|1,0,0]=2 613 B11R2.36 OC1=CC2=C(C=C1)OCO2 Z104473678 [0,0,0,1,0,0|2,0,0]=3 614 B11R2.36 OC1=CC2=C(C=C1)SC=C2 Z1255397714 [0,0,0,1,0,0|1,0,2]=4 615 B11R2.36 OC1=CC2=C(C=C1)SN=C2 Z1513812276 [0,0,0,1,0,0|2,0,1]=4 616 B11R2.36 OC1=CC2=C(C=CN2)C=C1 Z1203162244 [0,0,0,1,0,0|1,0,2]=4 617 B11R2.36 OC1=CC2=C(CCC2)N=C1 Z1255498919 [0,0,0,1,0,0|1,0,0]=2 618 B11R2.36 OC1=CC2=C(N=C1)NCC2 Z2310677431 [0,0,0,1,0,0|2,0,0]=3 619 B11R2.36 OC1=NC2=C(C=C1)CCN2 Z5351512817 [0,0,0,1,0,0|2,0,0]=3 620 B11R2.36 OC1=NC2=C(C=C1)CNC2 Z4913752558 [0,0,0,1,0,0|2,0,0]=3 621 B11R2.36 OC1=NN=C2CNCC2=C1 Z4499745654 [0,0,0,1,0,0|3,0,0]=4 622 B11R2.36 SC1=CC2=C(C=C1)OCC2 Z361891428 [0,0,0,1,0,0|1,1,0]=3 623 B9R1.7 CC1=CC=C(S1)CCN Z3038322398 [0,0,0,0,1,0|3,0,0]=4 624 B9R1.7 CCCC1=CC(=O)NN1 Z2583036240 [0,0,0,0,1,0|2,0,1]=4 625 B9R1.7 CCCC1=CN=C(S1)N Z1203578740 [0,0,0,0,1,0|3,0,0]=4 626 B9R1.7 CCCC1=CNC(=O)N1 Z1203732484 [0,0,0,0,1,0|2,0,1]=4 627 B9R1.7 CCCC1=CSC(=N1)N Z1582264042 [0,0,0,0,1,0|3,0,0]=4 628 B9R1.7 CCCC1=NNC(=C1)N Z1266854936 [0,0,0,0,1,0|3,0,0]=4 629 B9R1.7 CCCC1=NOC(=C1)N Z56979375 [0,0,0,0,1,0|3,0,0]=4 630 B9R1.7 CCCN1C=NC(=C1)N Z3210756298 [0,0,0,0,1,0|3,0,0]=4 631 B9R1.7 CNCC1=CC=C(O1)Br Z102767192 [0,0,0,0,1,0|3,0,0]=4 632 B9R1.7 CNCC1=CC=C(O1)C Z56957484 [0,0,0,0,1,0|3,0,0]=4 633 B9R1.7 CNCC1=CC=C(S1)C Z198747904 [0,0,0,0,1,0|3,0,0]=4 634 B9R1.7 CNCC1=CC=C(S1)Cl Z57057714 [0,0,0,0,1,0|3,0,0]=4 635 B9R1.7 CNCC1=CSC(=C1)Br Z401703212 [0,0,0,0,1,0|3,0,0]=4 636 B9R1.7 NCCC1=CC=C(O1)Br Z1442016604 [0,0,0,0,1,0|3,0,0]=4 637 B9R1.7 NCCC1=CC=C(S1)Cl Z432066930 [0,0,0,0,1,0|3,0,0]=4 638 B9R1.7 NCCC1=CC=C(S1)I Z1262398458 [0,0,0,0,1,0|3,0,0]=4 639 B9R1.7 NCCC1=CSC(=C1)Br Z4125344523 [0,0,0,0,1,0|3,0,0]=4 640 B8R1.2 C=CC1=CC=CC=C1 Z104474664 [2,0,0,0,0,0|0,0,2]=4 641 B8R1.2 CCC1=CC=CC=C1 Z104473632 [2,0,0,0,0,0|0,0,0]=2 642 B8R1.2 CCC1=CC=NC=C1 Z1251171246 [2,0,0,0,0,0|1,0,0]=3 643 B8R1.2 CCC1=CN=CC=C1 Z104476778 [2,0,0,0,0,0|1,0,0]=3 644 B8R1.2 CCC1=NC=CC=C1 Z113558650 [2,0,0,0,0,0|1,0,0]=3 645 B8R1.2 CCC1=NC=CC=N1 Z1198725952 [2,0,0,0,0,0|2,0,0]=4 646 B8R1.2 CCC1=NC=NC=C1 Z1198725956 [2,0,0,0,0,0|2,0,0]=4 647 B8R1.2 CCC1=NN=CC=C1 Z1222425026 [2,0,0,0,0,0|2,0,0]=4 648 B8R1.2 CNC1=CC=CC=C1 Z104472478 [2,0,0,0,0,0|1,0,0]=3 649 B8R1.2 CNC1=CN=CC=C1 Z1082871080 [2,0,0,0,0,0|2,0,0]=4 650 B8R1.2 COC1=CC=CC=C1 Z53833865 [2,0,0,0,0,0|1,0,0]=3 651 B8R1.2 CSC1=CC=NC=C1 Z1376456468 [2,0,0,0,0,0|2,0,0]=4 652 B8R1.2 Cl[Se]C1=CC=CC=C1 Z1255485131 [2,0,0,0,0,0|2,0,0]=4 653 B8R1.2 N#CC1=CC=CC=C1 Z104473628 [2,0,0,0,0,0|1,0,1]=4 654 B8R1.2 NCC1=CC=CC=C1 Z54748260 [2,0,0,0,0,0|1,0,0]=3 655 B8R1.2 NCC1=CC=NC=C1 Z104474354 [2,0,0,0,0,0|2,0,0]=4 656 B8R1.2 NCC1=CN=CC=C1 Z104474366 [2,0,0,0,0,0|2,0,0]=4 657 B8R1.2 NCC1=NC=CC=C1 Z104474352 [2,0,0,0,0,0|2,0,0]=4 658 B8R1.2 NNC1=CC=CC=C1 Z104472442 [2,0,0,0,0,0|2,0,0]=4 659 B8R1.2 OCC1=CC=CC=C1 Z104476418 [2,0,0,0,0,0|1,0,0]=3 660 B8R1.2 OCC1=CC=NC=C1 Z335244866 [2,0,0,0,0,0|2,0,0]=4 661 B8R1.2 OCC1=CN=CC=C1 Z104495622 [2,0,0,0,0,0|2,0,0]=4 662 B8R1.2 OCC1=NC=CC=C1 Z57921252 [2,0,0,0,0,0|2,0,0]=4 663 B8R1.3 BrC1=CC=C(C=C1)Br Z104474572 [2,0,0,0,0,0|2,0,0]=4 664 B8R1.3 BrC1=CC=C(C=C1)I Z299596184 [2,0,0,0,0,0|2,0,0]=4 665 B8R1.3 CC1=CC=C(C=C1)C Z199056432 [2,0,0,0,0,0|1,0,0]=3 666 B8R1.3 CC1=CC=C(C=C1)Cl Z56924546 [2,0,0,0,0,0|1,0,0]=3 667 B8R1.3 CC1=CC=C(C=C1)F Z104473648 [2,0,0,0,0,0|1,0,0]=3 668 B8R1.3 CC1=CC=C(C=C1)N Z57127875 [2,0,0,0,0,0|1,0,0]=3 669 B8R1.3 CC1=CC=C(C=C1)O Z104473818 [2,0,0,0,0,0|0,0,0]=2 670 B8R1.3 CC1=CN=C(C=C1)Br Z415645054 [2,0,0,0,0,0|2,0,0]=4 671 B8R1.3 CC1=CN=C(C=C1)N Z104475374 [2,0,0,0,0,0|2,0,0]=4 672 B8R1.3 CC1=CN=C(C=C1)O Z1255523405 [2,0,0,0,0,0|1,0,0]=3 673 B8R1.3 CC1=CN=C(C=C1)S Z271138132 [2,0,0,0,0,0|1,1,0]=4 674 B8R1.3 CC1=NC=C(C=C1)N Z425834586 [2,0,0,0,0,0|2,0,0]=4 675 B8R1.3 CC1=NC=C(C=C1)O Z838078132 [2,0,0,0,0,0|1,0,0]=3 676 B8R1.3 ClC1=CC=C(C=C1)Cl Z104476304 [2,0,0,0,0,0|2,0,0]=4 677 B8R1.3 NC1=CC=C(C=C1)Cl Z104472774 [2,0,0,0,0,0|2,0,0]=4 678 B8R1.3 NC1=CC=C(C=C1)F Z57127563 [2,0,0,0,0,0|2,0,0]=4 679 B8R1.3 NC1=CC=C(C=C1)I Z57127369 [2,0,0,0,0,0|2,0,0]=4 680 B8R1.3 NC1=CC=C(C=C1)N Z104472524 [2,0,0,0,0,0|2,0,0]=4 681 B8R1.3 NC1=CC=C(C=C1)O Z57127517 [2,0,0,0,0,0|1,0,0]=3 682 B8R1.3 NC1=CN=C(C=C1)O Z385458150 [2,0,0,0,0,0|2,0,0]=4 683 B8R1.3 O=C1C=CC(=O)C=C1 Z104474802 [2,0,0,0,0,0|1,0,1]=4 684 B8R1.3 OC1=CC=C(C=C1)Br Z57127362 [2,0,0,0,0,0|1,0,0]=3 685 B8R1.3 OC1=CC=C(C=C1)Cl Z104473434 [2,0,0,0,0,0|1,0,0]=3 686 B8R1.3 OC1=CC=C(C=C1)I Z104496300 [2,0,0,0,0,0|1,0,0]=3 687 B8R1.3 OC1=CC=C(C=C1)O Z57127551 [2,0,0,0,0,0|1,0,0]=3 688 B8R1.3 OC1=CN=C(C=C1)Br Z1201622821 [2,0,0,0,0,0|2,0,0]=4 689 B8R1.3 OC1=CN=C(C=C1)I Z1269183606 [2,0,0,0,0,0|2,0,0]=4 690 B8R1.3 OC1=CN=C(C=C1)O Z1198152559 [2,0,0,0,0,0|2,0,0]=4 691 B8R1.3 OC1=NC=C(C=C1)Cl Z2235409237 [2,0,0,0,0,0|2,0,0]=4 692 B8R1.3 OC1=NC=C(C=C1)F Z594267896 [2,0,0,0,0,0|2,0,0]=4 693 B8R1.3 OC1=NC=C(C=C1)I Z1269227573 [2,0,0,0,0,0|2,0,0]=4 694 B8R1.3 SC1=CC=C(C=C1)Cl Z57834219 [2,0,0,0,0,0|1,1,0]=4 695 B10R1.3 C#CC1=CC=C(C=C1)CC Z1080385542 [1,1,0,0,0,0|1,0,0]=3 696 B10R1.3 C#CC1=CC=C(C=C1)CO Z1255489573 [1,1,0,0,0,0|0,0,2]=4 697 B10R1.3 CCC1=CC=C(C=C1)C#N Z57900361 [1,1,0,0,0,0|1,0,0]=3 698 B10R1.3 CCC1=CC=C(C=C1)C=O Z104477712 [1,1,0,0,0,0|0,0,1]=3 699 B10R1.3 CCC1=CC=C(C=C1)CN Z239626560 [1,1,0,0,0,0|1,0,0]=3 700 B10R1.3 CCC1=CN=C(C=C1)C=O Z1198235245 [1,1,0,0,0,0|1,0,1]=4 701 B10R1.3 CCC1=NC=C(C=C1)C=O Z1255494858 [1,1,0,0,0,0|1,0,1]=4 702 B10R1.3 CNC1=CC=C(C=C1)C#N Z331873490 [1,1,0,0,0,0|2,0,0]=4 703 B10R1.3 CNC1=CC=C(C=C1)C=O Z1203730934 [1,1,0,0,0,0|1,0,1]=4 704 B10R1.3 CNC1=CC=C(C=C1)CN Z954985428 [1,1,0,0,0,0|2,0,0]=4 705 B10R1.3 CNC1=CC=C(C=C1)OC Z335282780 [1,1,0,0,0,0|1,0,0]=3 706 B10R1.3 CNC1=CC=C(C=C1)SC Z335261640 [1,1,0,0,0,0|1,1,0]=4 707 B10R1.3 CNC1=CN=C(C=C1)OC Z335249570 [1,1,0,0,0,0|2,0,0]=4 708 B10R1.3 CNC1=NC=C(C=C1)OC Z1255359415 [1,1,0,0,0,0|2,0,0]=4 709 B10R1.3 COC1=CC=C(C=C1)C#N Z53834531 [1,1,0,0,0,0|1,0,1]=4 710 B10R1.3 COC1=CC=C(C=C1)C=O Z53833125 [1,1,0,0,0,0|1,0,1]=4 711 B10R1.3 COC1=CC=C(C=C1)CO Z54603098 [1,1,0,0,0,0|1,0,0]=3 712 B10R1.3 COC1=CC=C(C=C1)CS Z1255360358 [1,1,0,0,0,0|1,0,0]=3 713 B10R1.3 COC1=CC=C(C=C1)OC Z53833835 [1,1,0,0,0,0|1,0,0]=3 714 B10R1.3 COC1=NC=C(C=C1)CO Z800297984 [1,1,0,0,0,0|2,0,0]=4 715 B10R1.3 CSC1=CC=C(C=C1)C#N Z57900348 [1,1,0,0,0,0|2,0,0]=4 716 B10R1.3 CSC1=CC=C(C=C1)C=O Z104478194 [1,1,0,0,0,0|1,0,1]=4 717 B10R1.3 CSC1=CC=C(C=C1)CCl Z56347089 [1,1,0,0,0,0|1,1,0]=4 718 B10R1.3 CSC1=CC=C(C=C1)CN Z54751956 [1,1,0,0,0,0|1,1,0]=4 719 B10R1.3 ClCC1=CC=C(C=C1)CCl Z99600486 [1,1,0,0,0,0|2,0,0]=4 720 B10R1.3 N#CC1=CC=C(C=C1)CBr Z56995138 [1,1,0,0,0,0|2,0,0]=4 721 B10R1.3 N#CC1=CC=C(C=C1)CO Z335244916 [1,1,0,0,0,0|1,0,1]=4 722 B10R1.3 NCC1=CC=C(C=C1)C=O Z2418414207 [1,1,0,0,0,0|1,0,1]=4 723 B10R1.3 NCC1=CC=C(C=C1)CO Z385458374 [1,1,0,0,0,0|1,0,0]=3 724 B10R1.3 O=CC1=CC=C(C=C1)CBr Z1201624503 [1,1,0,0,0,0|1,0,1]=4 725 B10R1.3 O=CC1=CC=C(C=C1)CCl Z1198151895 [1,1,0,0,0,0|1,0,1]=4 726 B10R1.3 O=CC1=CC=C(C=C1)CF Z1255498899 [1,1,0,0,0,0|1,0,1]=4 727 B10R1.3 O=CC1=CC=C(C=C1)CO Z1255384176 [1,1,0,0,0,0|1,0,1]=4 728 B10R1.13 CC(=O)C1=CC=C(C=C1)Br Z57127459 [1,1,0,0,0,0|1,0,1]=4 729 B10R1.13 CC(=O)C1=CC=C(C=C1)C Z57127458 [1,1,0,0,0,0|1,0,1]=4 730 B10R1.13 CC(=O)C1=CC=C(C=C1)Cl Z57127462 [1,1,0,0,0,0|1,0,1]=4 731 B10R1.13 CC(=O)C1=CC=C(C=C1)F Z57127466 [1,1,0,0,0,0|1,0,1]=4 732 B10R1.13 CC(=O)C1=CC=C(C=C1)I Z57073725 [1,1,0,0,0,0|1,0,1]=4 733 B10R1.13 CC(=O)C1=CC=C(C=C1)N Z57127377 [1,1,0,0,0,0|1,0,1]=4 734 B10R1.13 CC(=O)C1=CC=C(C=C1)O Z57040434 [1,1,0,0,0,0|0,0,1]=3 735 B10R1.13 CC(C)C1=CC=C(C=C1)Br Z732229746 [1,1,0,0,0,0|1,0,0]=3 736 B10R1.13 CC(C)C1=CC=C(C=C1)Cl Z1255372793 [1,1,0,0,0,0|1,0,0]=3 737 B10R1.13 CC(C)C1=CC=C(C=C1)N Z104476320 [1,1,0,0,0,0|1,0,0]=3 738 B10R1.13 CC(C)C1=CC=C(C=C1)O Z56347200 [1,1,0,0,0,0|0,0,0]=2 739 B10R1.13 CC(N)C1=CC=C(C=C1)Br Z56347162 [1,1,0,0,0,0|1,0,0]=3 740 B10R1.13 CC(N)C1=CC=C(C=C1)Cl Z56347112 [1,1,0,0,0,0|1,0,0]=3 741 B10R1.13 CC(N)C1=CC=C(C=C1)O Z1741968989 [1,1,0,0,0,0|0,0,0]=2 742 B10R1.13 CC(N)C1=CN=C(C=C1)O Z4423361180 [1,1,0,0,0,0|1,0,0]=3 743 B10R1.13 CC(O)C1=CC=C(C=C1)Br Z335244904 [1,1,0,0,0,0|1,0,0]=3 744 B10R1.13 CC(O)C1=CC=C(C=C1)Cl Z104479788 [1,1,0,0,0,0|1,0,0]=3 745 B10R1.13 CC(O)C1=CC=C(C=C1)F Z56347219 [1,1,0,0,0,0|1,0,0]=3 746 B10R1.13 CC(O)C1=CC=C(C=C1)I Z228586282 [1,1,0,0,0,0|1,0,0]=3 747 B10R1.13 CC(O)C1=NC=C(C=C1)F Z1255406174 [1,1,0,0,0,0|2,0,0]=4 748 B10R1.13 CC1=CC=C(C=C1)C(C)C Z104497772 [1,1,0,0,0,0|1,0,0]=3 749 B10R1.13 CC1=CC=C(C=C1)[C@@H](C)O Z1127664396 [1,1,0,0,0,0|1,0,0]=3 750 B10R1.13 CC1=CC=C(C=C1)[C@H](C)O Z1127664278 [1,1,0,0,0,0|1,0,0]=3 751 B10R1.13 CN(C)C1=CC=C(C=C1)O Z137981254 [1,1,0,0,0,0|1,0,0]=3 752 B10R1.13 CS(=O)C1=CC=C(C=C1)N Z609944508 [1,1,0,0,0,0|2,0,0]=4 753 B10R1.13 C[C@@H](O)C1=CC=C(C=C1)Br Z850973968 [1,1,0,0,0,0|1,0,0]=3 754 B10R1.13 C[C@@H](O)C1=CC=C(C=C1)I Z360055808 [1,1,0,0,0,0|1,0,0]=3 755 B10R1.13 C[C@H](N)C1=CC=C(C=C1)Br Z1869802525 [1,1,0,0,0,0|1,0,0]=3 756 B10R1.13 C[C@H](N)C1=CC=C(C=C1)I Z1696091699 [1,1,0,0,0,0|1,0,0]=3 757 B10R1.13 C[C@H](N)C1=CC=C(C=C1)O Z3183546879 [1,1,0,0,0,0|0,0,0]=2 758 B10R1.13 C[C@H](N)C1=NC=C(C=C1)Cl Z1753033020 [1,1,0,0,0,0|2,0,0]=4 759 B10R1.13 C[C@H](O)C1=CC=C(C=C1)Br Z850973970 [1,1,0,0,0,0|1,0,0]=3 760 B10R1.13 C[C@H](O)C1=CC=C(C=C1)I Z360055806 [1,1,0,0,0,0|1,0,0]=3 761 B10R1.13 N=C(N)C1=CC=C(C=C1)O Z1262398570 [1,1,0,0,0,0|1,0,1]=4 762 B10R1.13 NC(=O)C1=CC=C(C=C1)O Z104502228 [1,1,0,0,0,0|1,0,1]=4 763 B10R1.13 NC(=S)C1=CC=C(C=C1)O Z90124534 [1,1,0,0,0,0|1,0,1]=4 764 B10R1.13 NC1=CC=C(C=C1)C(F)F Z2900188029 [1,1,0,0,0,0|2,0,0]=4 765 B10R1.13 O=C(O)C1=CC=C(C=C1)O Z104498098 [1,1,0,0,0,0|1,0,1]=4 766 B10R1.13 O=[N+]([O-])C1=CC=C(C=C1)O Z57127483 [1,1,0,0,0,0|2,0,0]=4 767 B10R1.13 OB(O)C1=CC=C(C=C1)O Z336080006 [1,1,0,0,0,0|2,0,0]=4 768 B10R1.13 OC1=NC=C(C=C1)C(F)F Z1726130896 [1,1,0,0,0,0|2,0,0]=4 769 B10R1.25 CC1=C(C=CC(=C1)Br)CN Z1266854915 [1,1,0,0,0,0|2,0,0]=4 770 B10R1.25 CC1=C(C=CC(=C1)Br)CO Z444299166 [1,1,0,0,0,0|2,0,0]=4 771 B10R1.25 CC1=C(C=CC(=C1)Cl)CN Z4862693322 [1,1,0,0,0,0|2,0,0]=4 772 B10R1.25 CC1=C(C=CC(=C1)F)CN Z4450359823 [1,1,0,0,0,0|2,0,0]=4 773 B10R1.25 CC1=C(C=CC(=C1)F)CO Z959356974 [1,1,0,0,0,0|2,0,0]=4 774 B10R1.25 CC1=C(C=CC(=C1)N)CN Z2574928353 [1,1,0,0,0,0|2,0,0]=4 775 B10R1.25 CC1=C(C=CC(=C1)O)C#N Z1255452759 [1,1,0,0,0,0|1,0,1]=4 776 B10R1.25 CC1=C(C=CC(=C1)O)C=O Z1161074806 [1,1,0,0,0,0|1,0,1]=4 777 B10R1.25 CC1=CC(=C(C=C1)CN)C Z239626330 [1,1,0,0,0,0|2,0,0]=4 778 B10R1.25 CC1=CC(=C(C=C1)CN)F Z3071128846 [1,1,0,0,0,0|2,0,0]=4 779 B10R1.25 CC1=CC(=C(C=C1)CN)N Z5524803288 [1,1,0,0,0,0|2,0,0]=4 780 B10R1.25 CC1=CC(=C(C=C1)CN)O Z4525848236 [1,1,0,0,0,0|2,0,0]=4 781 B10R1.25 CC1=CC(=C(C=C1)CO)C Z335244716 [1,1,0,0,0,0|2,0,0]=4 782 B10R1.25 CC1=CC(=C(C=C1)CO)Cl Z1255382519 [1,1,0,0,0,0|2,0,0]=4 783 B10R1.25 CC1=CC(=C(C=C1)CO)N Z1198176996 [1,1,0,0,0,0|2,0,0]=4 784 B10R1.25 CCC1=C(C=C(C=C1)Br)Cl Z1551924119 [1,1,0,0,0,0|1,0,0]=3 785 B10R1.25 CCC1=C(C=C(C=C1)C)O Z1198181015 [1,1,0,0,0,0|1,0,0]=3 786 B10R1.25 CCC1=C(C=C(C=C1)Cl)Cl Z1862006036 [1,1,0,0,0,0|1,0,0]=3 787 B10R1.25 CCC1=C(C=C(C=C1)F)N Z4670692131 [1,1,0,0,0,0|1,0,0]=3 788 B10R1.25 CCC1=C(C=C(C=C1)N)F Z1203583183 [1,1,0,0,0,0|1,0,0]=3 789 B10R1.25 CCC1=C(C=C(C=C1)N)I Z4120967362 [1,1,0,0,0,0|1,0,0]=3 790 B10R1.25 CCC1=C(C=C(C=C1)O)O Z104499414 [1,1,0,0,0,0|0,0,0]=2 791 B10R1.25 CCC1=C(C=C(N=C1)C)N Z1198157196 [1,1,0,0,0,0|2,0,0]=4 792 B10R1.25 CCC1=C(N=C(C=C1)C)N Z1201619216 [1,1,0,0,0,0|2,0,0]=4 793 B10R1.25 CNC1=C(C=C(C=C1)Br)C Z335260018 [1,1,0,0,0,0|2,0,0]=4 794 B10R1.25 CNC1=C(C=C(C=C1)Br)Cl Z391885374 [1,1,0,0,0,0|2,0,0]=4 795 B10R1.25 CNC1=C(C=C(C=C1)Br)F Z803129926 [1,1,0,0,0,0|2,0,0]=4 796 B10R1.25 CNC1=C(C=C(C=C1)Br)N Z359511404 [1,1,0,0,0,0|2,0,0]=4 797 B10R1.25 CNC1=C(C=C(C=C1)C)Br Z335255150 [1,1,0,0,0,0|2,0,0]=4 798 B10R1.25 CNC1=C(C=C(C=C1)C)C Z335249338 [1,1,0,0,0,0|2,0,0]=4 799 B10R1.25 CNC1=C(C=C(C=C1)C)F Z2289768913 [1,1,0,0,0,0|2,0,0]=4 800 B10R1.25 CNC1=C(C=C(C=C1)C)N Z394648996 [1,1,0,0,0,0|2,0,0]=4 801 B10R1.25 CNC1=C(C=C(C=C1)Cl)F Z1966571852 [1,1,0,0,0,0|2,0,0]=4 802 B10R1.25 CNC1=C(C=C(C=C1)Cl)I Z4968144357 [1,1,0,0,0,0|2,0,0]=4 803 B10R1.25 CNC1=C(C=C(C=C1)Cl)N Z359511424 [1,1,0,0,0,0|2,0,0]=4 804 B10R1.25 CNC1=C(C=C(C=C1)F)Cl Z4102405978 [1,1,0,0,0,0|2,0,0]=4 805 B10R1.25 CNC1=C(C=C(C=C1)F)I Z3476924845 [1,1,0,0,0,0|2,0,0]=4 806 B10R1.25 CNC1=C(C=C(C=C1)F)N Z359511402 [1,1,0,0,0,0|2,0,0]=4 807 B10R1.25 CNC1=C(C=C(C=C1)N)C Z385462228 [1,1,0,0,0,0|2,0,0]=4 808 B10R1.25 CNC1=C(C=C(C=C1)O)C Z2740415969 [1,1,0,0,0,0|1,0,0]=3 809 B10R1.25 COC1=C(C=C(C=C1)Br)F Z54183592 [1,1,0,0,0,0|2,0,0]=4 810 B10R1.25 COC1=C(C=C(C=C1)Br)N Z330803600 [1,1,0,0,0,0|2,0,0]=4 811 B10R1.25 COC1=C(C=C(C=C1)Br)S Z367661854 [1,1,0,0,0,0|2,0,0]=4 812 B10R1.25 COC1=C(C=C(C=C1)C)N Z104477476 [1,1,0,0,0,0|2,0,0]=4 813 B10R1.25 COC1=C(C=C(C=C1)Cl)I Z1269181635 [1,1,0,0,0,0|2,0,0]=4 814 B10R1.25 COC1=C(C=C(C=C1)Cl)N Z56782009 [1,1,0,0,0,0|2,0,0]=4 815 B10R1.25 COC1=C(C=C(C=C1)F)N Z332375930 [1,1,0,0,0,0|2,0,0]=4 816 B10R1.25 COC1=C(C=C(C=C1)I)Br Z362776936 [1,1,0,0,0,0|2,0,0]=4 817 B10R1.25 COC1=C(C=C(C=C1)I)F Z57073900 [1,1,0,0,0,0|2,0,0]=4 818 B10R1.25 COC1=C(C=C(C=C1)N)Br Z57450975 [1,1,0,0,0,0|2,0,0]=4 819 B10R1.25 COC1=C(C=C(C=C1)N)C Z385462626 [1,1,0,0,0,0|2,0,0]=4 820 B10R1.25 COC1=C(C=C(C=C1)N)F Z362635046 [1,1,0,0,0,0|2,0,0]=4 821 B10R1.25 COC1=C(C=C(C=C1)N)O Z104494830 [1,1,0,0,0,0|2,0,0]=4 822 B10R1.25 COC1=C(C=C(C=C1)O)F Z415739536 [1,1,0,0,0,0|1,0,0]=3 823 B10R1.25 COC1=C(C=C(C=C1)O)I Z1269222013 [1,1,0,0,0,0|1,0,0]=3 824 B10R1.25 CSC1=C(C=C(C=C1)Br)N Z412043196 [1,1,0,0,0,0|2,0,0]=4 825 B10R1.25 CSC1=C(C=C(C=C1)Cl)N Z234894267 [1,1,0,0,0,0|2,0,0]=4 826 B10R1.25 CSC1=C(C=C(C=C1)F)N Z803129932 [1,1,0,0,0,0|2,0,0]=4 827 B10R1.25 CSC1=C(C=C(C=C1)N)Br Z852342876 [1,1,0,0,0,0|2,0,0]=4 828 B10R1.25 CSC1=C(C=C(C=C1)N)Cl Z412040302 [1,1,0,0,0,0|2,0,0]=4 829 B10R1.25 CSC1=C(C=C(C=C1)N)F Z412032312 [1,1,0,0,0,0|2,0,0]=4 830 B10R1.25 CSC1=C(C=C(C=C1)O)Br Z1269227695 [1,1,0,0,0,0|1,0,0]=3 831 B10R1.25 CSC1=C(C=C(C=C1)O)C Z277164168 [1,1,0,0,0,0|1,0,0]=3 832 B10R1.25 ClCC1=C(C=C(C=C1)Cl)Cl Z57834457 [1,1,0,0,0,0|2,0,0]=4 833 B10R1.25 N#CC1=C(C=C(C=C1)O)F Z1157728598 [1,1,0,0,0,0|1,0,1]=4 834 B10R1.25 N#CC1=C(C=C(C=C1)O)O Z1255361029 [1,1,0,0,0,0|1,0,1]=4 835 B10R1.25 NC1=C(C=CC(=C1)Br)CO Z1269175206 [1,1,0,0,0,0|2,0,0]=4 836 B10R1.25 NC1=C(C=CC(=C1)Cl)CO Z955147660 [1,1,0,0,0,0|2,0,0]=4 837 B10R1.25 NC1=C(C=CC(=C1)F)CO Z1198159868 [1,1,0,0,0,0|2,0,0]=4 838 B10R1.25 NCC1=C(C=C(C=C1)Br)Br Z3244847417 [1,1,0,0,0,0|2,0,0]=4 839 B10R1.25 NCC1=C(C=C(C=C1)Br)Cl Z448247302 [1,1,0,0,0,0|2,0,0]=4 840 B10R1.25 NCC1=C(C=C(C=C1)Br)F Z1266933858 [1,1,0,0,0,0|2,0,0]=4 841 B10R1.25 NCC1=C(C=C(C=C1)Br)O Z1269160590 [1,1,0,0,0,0|2,0,0]=4 842 B10R1.25 NCC1=C(C=C(C=C1)Cl)Br Z2787455611 [1,1,0,0,0,0|2,0,0]=4 843 B10R1.25 NCC1=C(C=C(C=C1)Cl)Cl Z316170412 [1,1,0,0,0,0|2,0,0]=4 844 B10R1.25 NCC1=C(C=C(C=C1)Cl)F Z2238931004 [1,1,0,0,0,0|2,0,0]=4 845 B10R1.25 NCC1=C(C=C(C=C1)Cl)I Z1889706351 [1,1,0,0,0,0|2,0,0]=4 846 B10R1.25 NCC1=C(C=C(C=C1)F)Br Z2238930616 [1,1,0,0,0,0|2,0,0]=4 847 B10R1.25 NCC1=C(C=C(C=C1)F)F Z239626462 [1,1,0,0,0,0|2,0,0]=4 848 B10R1.25 NCC1=C(C=C(C=C1)I)Cl Z1973465512 [1,1,0,0,0,0|2,0,0]=4 849 B10R1.25 NCC1=C(C=C(C=C1)N)F Z5197774367 [1,1,0,0,0,0|2,0,0]=4 850 B10R1.25 NCC1=C(C=C(C=C1)N)O Z3034846582 [1,1,0,0,0,0|2,0,0]=4 851 B10R1.25 NCC1=C(C=C(C=C1)O)F Z3244923137 [1,1,0,0,0,0|1,0,0]=3 852 B10R1.25 NCC1=C(C=C(C=C1)O)O Z2350903951 [1,1,0,0,0,0|1,0,0]=3 853 B10R1.25 O=CC1=C(C=C(C=C1)O)Br Z622749802 [1,1,0,0,0,0|1,0,1]=4 854 B10R1.25 O=CC1=C(C=C(C=C1)O)Cl Z1255419357 [1,1,0,0,0,0|1,0,1]=4 855 B10R1.25 O=CC1=C(C=C(C=C1)O)F Z1201623850 [1,1,0,0,0,0|1,0,1]=4 856 B10R1.25 O=CC1=C(C=C(C=C1)O)O Z104497974 [1,1,0,0,0,0|1,0,1]=4 857 B10R1.25 OCC1=C(C=C(C=C1)Br)Br Z1269234186 [1,1,0,0,0,0|2,0,0]=4 858 B10R1.25 OCC1=C(C=C(C=C1)Br)Cl Z448248274 [1,1,0,0,0,0|2,0,0]=4 859 B10R1.25 OCC1=C(C=C(C=C1)Br)I Z1269215229 [1,1,0,0,0,0|2,0,0]=4 860 B10R1.25 OCC1=C(C=C(C=C1)Cl)Br Z1269183118 [1,1,0,0,0,0|2,0,0]=4 861 B10R1.25 OCC1=C(C=C(C=C1)Cl)Cl Z111479786 [1,1,0,0,0,0|2,0,0]=4 862 B10R1.25 OCC1=C(C=C(C=C1)Cl)I Z1269244634 [1,1,0,0,0,0|2,0,0]=4 863 B10R1.25 OCC1=C(C=C(C=C1)F)Br Z397587428 [1,1,0,0,0,0|2,0,0]=4 864 B10R1.25 OCC1=C(C=C(C=C1)F)I Z1269118341 [1,1,0,0,0,0|2,0,0]=4 865 B10R1.25 OCC1=C(C=C(C=C1)I)Cl Z1269140641 [1,1,0,0,0,0|2,0,0]=4 866 B10R1.176 CC1=C(C=C(C=C1)CN)Cl Z4658099850 [1,1,0,0,0,0|2,0,0]=4 867 B10R1.176 CC1=C(C=C(C=C1)CN)F Z166652084 [1,1,0,0,0,0|2,0,0]=4 868 B10R1.176 CC1=C(C=C(C=C1)CN)N Z5023069916 [1,1,0,0,0,0|2,0,0]=4 869 B10R1.176 CC1=C(C=C(C=C1)CN)O Z3951014909 [1,1,0,0,0,0|2,0,0]=4 870 B10R1.176 CC1=C(C=C(C=C1)CO)Br Z1269190523 [1,1,0,0,0,0|2,0,0]=4 871 B10R1.176 CC1=C(C=C(C=C1)CO)I Z1269159118 [1,1,0,0,0,0|2,0,0]=4 872 B10R1.176 CC1=C(C=C(C=C1)CO)N Z1203578220 [1,1,0,0,0,0|2,0,0]=4 873 B10R1.176 CC1=C(C=CC(=C1)C#N)O Z606249182 [1,1,0,0,0,0|1,0,1]=4 874 B10R1.176 CC1=C(C=CC(=C1)C=O)O Z1082846778 [1,1,0,0,0,0|1,0,1]=4 875 B10R1.176 CC1=C(C=CC(=C1)CN)Br Z2293605627 [1,1,0,0,0,0|2,0,0]=4 876 B10R1.176 CC1=C(C=CC(=C1)CN)Cl Z1255503196 [1,1,0,0,0,0|2,0,0]=4 877 B10R1.176 CC1=C(C=CC(=C1)CN)I Z1992316385 [1,1,0,0,0,0|2,0,0]=4 878 B10R1.176 CC1=C(C=CC(=C1)CO)Br Z1269142250 [1,1,0,0,0,0|2,0,0]=4 879 B10R1.176 CC1=C(C=CC(=C1)CO)Cl Z1201623310 [1,1,0,0,0,0|2,0,0]=4 880 B10R1.176 CCC1=CC(=C(C=C1)Br)Cl Z1551924078 [1,1,0,0,0,0|1,0,0]=3 881 B10R1.176 CCC1=CC(=C(C=C1)Br)N Z2753220544 [1,1,0,0,0,0|1,0,0]=3 882 B10R1.176 CCC1=CC(=C(C=C1)N)F Z1255421063 [1,1,0,0,0,0|1,0,0]=3 883 B10R1.176 CCC1=CC(=C(C=C1)N)N Z1198311235 [1,1,0,0,0,0|1,0,0]=3 884 B10R1.176 CCC1=CC(=C(C=C1)O)C Z1255463943 [1,1,0,0,0,0|0,0,0]=2 885 B10R1.176 CCC1=CC(=C(C=C1)O)N Z1318147478 [1,1,0,0,0,0|0,0,0]=2 886 B10R1.176 CCN1C=CC(=O)C(=C1)N Z1455314607 [1,1,0,0,0,0|1,0,1]=4 887 B10R1.176 CNC1=CC(=C(C=C1)Br)C Z335264426 [1,1,0,0,0,0|2,0,0]=4 888 B10R1.176 CNC1=CC(=C(C=C1)F)F Z335273034 [1,1,0,0,0,0|2,0,0]=4 889 B10R1.176 COC1=CC(=C(C=C1)Br)N Z406520438 [1,1,0,0,0,0|2,0,0]=4 890 B10R1.176 COC1=CC(=C(C=C1)C)N Z1203578033 [1,1,0,0,0,0|2,0,0]=4 891 B10R1.176 COC1=CC(=C(C=C1)C)O Z1255384359 [1,1,0,0,0,0|2,0,0]=4 892 B10R1.176 COC1=CC(=C(C=C1)Cl)C Z54850187 [1,1,0,0,0,0|2,0,0]=4 893 B10R1.176 COC1=CC(=C(C=C1)Cl)N Z1259341039 [1,1,0,0,0,0|2,0,0]=4 894 B10R1.176 COC1=CC(=C(C=C1)F)Br Z1269188737 [1,1,0,0,0,0|2,0,0]=4 895 B10R1.176 COC1=CC(=C(C=C1)F)N Z1198319952 [1,1,0,0,0,0|2,0,0]=4 896 B10R1.176 COC1=CC(=C(C=C1)I)C Z1269244593 [1,1,0,0,0,0|2,0,0]=4 897 B10R1.176 COC1=CC(=C(C=C1)N)Br Z425366392 [1,1,0,0,0,0|2,0,0]=4 898 B10R1.176 COC1=CC(=C(C=C1)N)C Z239604794 [1,1,0,0,0,0|2,0,0]=4 899 B10R1.176 COC1=CC(=C(C=C1)N)Cl Z425366376 [1,1,0,0,0,0|2,0,0]=4 900 B10R1.176 COC1=CC(=C(C=C1)N)F Z425366382 [1,1,0,0,0,0|2,0,0]=4 901 B10R1.176 COC1=CC(=C(C=C1)N)I Z1868316833 [1,1,0,0,0,0|2,0,0]=4 902 B10R1.176 COC1=CC(=C(C=C1)O)C Z1198310476 [1,1,0,0,0,0|1,0,0]=3 903 B10R1.176 COC1=CC(=C(C=C1)O)N Z57727878 [1,1,0,0,0,0|1,0,0]=3 904 B10R1.176 COC1=NC(=C(C=C1)O)C Z1255447798 [1,1,0,0,0,0|2,0,0]=4 905 B10R1.176 CSC1=CC(=C(C=C1)Br)O Z1269146558 [1,1,0,0,0,0|2,0,0]=4 906 B10R1.176 CSC1=CC(=C(C=C1)C)N Z1037567098 [1,1,0,0,0,0|2,0,0]=4 907 B10R1.176 CSC1=CC(=C(C=C1)Cl)N Z2507870687 [1,1,0,0,0,0|2,0,0]=4 908 B10R1.176 ClC1=C(C=C(C=C1)CBr)Br Z1269140591 [1,1,0,0,0,0|2,0,0]=4 909 B10R1.176 ClC1=C(C=C(C=C1)CBr)Cl Z56969314 [1,1,0,0,0,0|2,0,0]=4 910 B10R1.176 N#CC1=CC(=C(C=C1)O)Cl Z99599532 [1,1,0,0,0,0|1,0,1]=4 911 B10R1.176 N#CC1=CC(=C(C=C1)O)I Z1269175329 [1,1,0,0,0,0|1,0,1]=4 912 B10R1.176 N#CC1=CC(=C(C=C1)O)N Z425853908 [1,1,0,0,0,0|1,0,1]=4 913 B10R1.176 NC1=C(C=CC(=C1)CO)Br Z1269218344 [1,1,0,0,0,0|2,0,0]=4 914 B10R1.176 NC1=C(C=CC(=C1)CO)Cl Z394691290 [1,1,0,0,0,0|2,0,0]=4 915 B10R1.176 NC1=C(C=CC(=C1)CO)F Z4518011880 [1,1,0,0,0,0|2,0,0]=4 916 B10R1.176 NCC1=CC(=C(C=C1)Br)F Z2327126749 [1,1,0,0,0,0|2,0,0]=4 917 B10R1.176 NCC1=CC(=C(C=C1)Cl)F Z3244773428 [1,1,0,0,0,0|2,0,0]=4 918 B10R1.176 NCC1=CC(=C(C=C1)Cl)N Z1480642430 [1,1,0,0,0,0|2,0,0]=4 919 B10R1.176 NCC1=CC(=C(C=C1)F)Cl Z992424146 [1,1,0,0,0,0|2,0,0]=4 920 B10R1.176 NCC1=CC(=C(C=C1)F)F Z239626576 [1,1,0,0,0,0|2,0,0]=4 921 B10R1.176 NCC1=CC(=C(C=C1)F)O Z2786079401 [1,1,0,0,0,0|2,0,0]=4 922 B10R1.176 NCC1=CC(=C(C=C1)O)Br Z1436472846 [1,1,0,0,0,0|1,0,0]=3 923 B10R1.176 NCC1=CC(=C(C=C1)O)Cl Z2757555437 [1,1,0,0,0,0|1,0,0]=3 924 B10R1.176 NCC1=CC(=C(C=C1)O)F Z1250080941 [1,1,0,0,0,0|1,0,0]=3 925 B10R1.176 NCC1=CC(=C(C=C1)O)O Z1272096628 [1,1,0,0,0,0|1,0,0]=3 926 B10R1.176 NCC1=CC(=C(N=C1)O)F Z5004159399 [1,1,0,0,0,0|2,0,0]=4 927 B10R1.176 O=C1C=C(OC=C1O)CCl Z56946853 [1,1,0,0,0,0|2,0,0]=4 928 B10R1.176 O=C1C=C(OC=C1O)CO Z104484860 [1,1,0,0,0,0|2,0,0]=4 929 B10R1.176 O=CC1=CC(=C(C=C1)O)Br Z56960236 [1,1,0,0,0,0|1,0,1]=4 930 B10R1.176 O=CC1=CC(=C(C=C1)O)Cl Z57313902 [1,1,0,0,0,0|1,0,1]=4 931 B10R1.176 O=CC1=CC(=C(C=C1)O)F Z385458796 [1,1,0,0,0,0|1,0,1]=4 932 B10R1.176 O=CC1=CC(=C(C=C1)O)O Z56957508 [1,1,0,0,0,0|1,0,1]=4 933 B10R1.176 OCC1=CC(=C(C=C1)Br)Cl Z1269181450 [1,1,0,0,0,0|2,0,0]=4 934 B10R1.176 OCC1=CC(=C(C=C1)Cl)Br Z1269238306 [1,1,0,0,0,0|2,0,0]=4 935 B10R1.176 OCC1=CC(=C(C=C1)I)Cl Z1269236145 [1,1,0,0,0,0|2,0,0]=4 936 B10R1.176 OCC1=CC(=C(C=C1)I)O Z1269159331 [1,1,0,0,0,0|2,0,0]=4 937 B10R1.176 OCC1=CC(=C(C=C1)O)Cl Z839172284 [1,1,0,0,0,0|1,0,0]=3 938 B10R1.176 OCC1=CC(=C(C=C1)O)F Z385458838 [1,1,0,0,0,0|1,0,0]=3 939 B10R1.176 OCC1=NC=C(C(=C1)O)O Z3003010756 [1,1,0,0,0,0|2,0,0]=4 940 B10R1.4 C=CCC1=C(C=CC=C1)O Z104493210 [1,1,0,0,0,0|0,0,2]=4 941 B10R1.4 CC1=C(C=CC=C1)CC#N Z57039593 [1,1,0,0,0,0|1,0,1]=4 942 B10R1.4 CC1=C(C=CC=C1)CC=O Z993017618 [1,1,0,0,0,0|1,0,1]=4 943 B10R1.4 CC1=C(C=CC=C1)CNN Z336481586 [1,1,0,0,0,0|2,0,0]=4 944 B10R1.4 CC1=C(C=NC=C1)CCN Z1198264124 [1,1,0,0,0,0|2,0,0]=4 945 B10R1.4 CC1=C(N=CC=C1)CCN Z1098234132 [1,1,0,0,0,0|2,0,0]=4 946 B10R1.4 CC1=C(N=CC=C1)CCO Z1198169041 [1,1,0,0,0,0|2,0,0]=4 947 B10R1.4 CCCC1=C(C=CC=C1)Br Z1479686725 [1,1,0,0,0,0|0,0,0]=2 948 B10R1.4 CCCC1=C(C=CC=C1)I Z821158622 [1,1,0,0,0,0|0,0,0]=2 949 B10R1.4 CCCC1=C(C=CC=C1)N Z336087926 [1,1,0,0,0,0|0,0,0]=2 950 B10R1.4 CCCC1=C(N=CC=N1)Cl Z1504680268 [1,1,0,0,0,0|2,0,0]=4 951 B10R1.4 CCNC1=C(C=CC=C1)C Z104477886 [1,1,0,0,0,0|1,0,0]=3 952 B10R1.4 CCNC1=C(C=CC=C1)F Z286518592 [1,1,0,0,0,0|1,0,0]=3 953 B10R1.4 CCNC1=C(C=CC=C1)I Z4405452872 [1,1,0,0,0,0|1,0,0]=3 954 B10R1.4 CCNC1=C(C=CC=C1)N Z359511482 [1,1,0,0,0,0|1,0,0]=3 955 B10R1.4 CCNC1=C(C=CC=C1)O Z5185414820 [1,1,0,0,0,0|1,0,0]=3 956 B10R1.4 CCNC1=C(C=CC=N1)C Z968907586 [1,1,0,0,0,0|2,0,0]=4 957 B10R1.4 CCNC1=C(C=CC=N1)N Z803145254 [1,1,0,0,0,0|2,0,0]=4 958 B10R1.4 CCNC1=C(C=CN=C1)C Z1946684572 [1,1,0,0,0,0|2,0,0]=4 959 B10R1.4 CCNC1=C(C=NC=C1)N Z359511456 [1,1,0,0,0,0|2,0,0]=4 960 B10R1.4 CCOC1=C(C=CC=C1)Br Z153728256 [1,1,0,0,0,0|1,0,0]=3 961 B10R1.4 CCOC1=C(C=CC=C1)I Z406416174 [1,1,0,0,0,0|1,0,0]=3 962 B10R1.4 CCOC1=C(C=CC=C1)N Z104478442 [1,1,0,0,0,0|1,0,0]=3 963 B10R1.4 CCOC1=C(C=CC=C1)O Z104480244 [1,1,0,0,0,0|1,0,0]=3 964 B10R1.4 CCOC1=C(C=CC=N1)N Z240084312 [1,1,0,0,0,0|2,0,0]=4 965 B10R1.4 CCOC1=C(N=CC=C1)N Z362783900 [1,1,0,0,0,0|2,0,0]=4 966 B10R1.4 CCSC1=C(C=CC=C1)Br Z149386616 [1,1,0,0,0,0|1,0,0]=3 967 B10R1.4 CCSC1=C(C=CC=C1)N Z316174690 [1,1,0,0,0,0|1,0,0]=3 968 B10R1.4 CCSC1=C(C=CC=C1)O Z905204460 [1,1,0,0,0,0|1,0,0]=3 969 B10R1.4 CCSC1=CC=CNC1=O Z1509297963 [1,1,0,0,0,0|2,0,0]=4 970 B10R1.4 CCSC1=[N+](C=CC=C1)[O-] Z18546433 [1,1,0,0,0,0|2,0,0]=4 971 B10R1.4 CNCC1=C(C=CC=C1)C Z56948272 [1,1,0,0,0,0|1,0,0]=3 972 B10R1.4 CNCC1=C(C=CC=C1)Cl Z56955956 [1,1,0,0,0,0|1,0,0]=3 973 B10R1.4 CNCC1=C(C=CC=C1)F Z56953087 [1,1,0,0,0,0|1,0,0]=3 974 B10R1.4 CNCC1=C(C=CC=C1)N Z764242576 [1,1,0,0,0,0|1,0,0]=3 975 B10R1.4 CNCC1=C(C=CC=C1)O Z398513608 [1,1,0,0,0,0|1,0,0]=3 976 B10R1.4 CNCC1=C(C=CC=N1)Cl Z5392638231 [1,1,0,0,0,0|2,0,0]=4 977 B10R1.4 CNCC1=C(C=NC=C1)F Z4545616296 [1,1,0,0,0,0|2,0,0]=4 978 B10R1.4 COCC1=C(C=CC=C1)I Z821093342 [1,1,0,0,0,0|1,0,0]=3 979 B10R1.4 COCC1=C(C=CC=C1)O Z821093528 [1,1,0,0,0,0|1,0,0]=3 980 B10R1.4 COCC1=C(N=CC=C1)N Z991490684 [1,1,0,0,0,0|2,0,0]=4 981 B10R1.4 CSCC1=C(C=CC=C1)N Z732207148 [1,1,0,0,0,0|1,0,0]=3 982 B10R1.4 N#CCC1=C(C=CC=C1)Cl Z56904744 [1,1,0,0,0,0|1,0,1]=4 983 B10R1.4 N#CCC1=C(C=CC=C1)F Z104477228 [1,1,0,0,0,0|1,0,1]=4 984 B10R1.4 NC1=C(C=CC=C1)CCO Z3417485770 [1,1,0,0,0,0|1,0,0]=3 985 B10R1.4 NCCC1=C(C=CC=C1)Br Z295382782 [1,1,0,0,0,0|1,0,0]=3 986 B10R1.4 NCCC1=C(C=CC=C1)Cl Z285143744 [1,1,0,0,0,0|1,0,0]=3 987 B10R1.4 NCCC1=C(C=CC=C1)F Z57051087 [1,1,0,0,0,0|1,0,0]=3 988 B10R1.4 NCCC1=C(C=CC=C1)O Z594038184 [1,1,0,0,0,0|1,0,0]=3 989 B10R1.4 NCCC1=C(N=CC=C1)O Z5862214540 [1,1,0,0,0,0|2,0,0]=4 990 B10R1.4 NCCN1C=CC=CC1=O Z1891776659 [1,1,0,0,0,0|2,0,0]=4 991 B10R1.4 O=C1C=CC=CN1CCO Z234898059 [1,1,0,0,0,0|2,0,0]=4 992 B10R1.4 O=CCC1=C(C=CC=C1)Br Z1183459130 [1,1,0,0,0,0|1,0,1]=4 993 B10R1.4 O=CCC1=C(C=CC=C1)F Z993017796 [1,1,0,0,0,0|1,0,1]=4 994 B10R1.4 OCCC1=C(C=CC=C1)Br Z1183459188 [1,1,0,0,0,0|1,0,0]=3 995 B10R1.4 OCCC1=C(C=CC=C1)F Z397587382 [1,1,0,0,0,0|1,0,0]=3 996 B10R1.10 CC1=CC(=CC=C1)CC#N Z285131450 [1,1,0,0,0,0|1,0,1]=4 997 B10R1.10 CC1=CC(=CC=C1)CCN Z241056516 [1,1,0,0,0,0|1,0,0]=3 998 B10R1.10 CC1=NC(=CC=C1)CCN Z1098234194 [1,1,0,0,0,0|2,0,0]=4 999 B10R1.10 CCCC1=CC(=CC=C1)Br Z1541586975 [1,1,0,0,0,0|0,0,0]=2 1000 B10R1.10 CCCC1=CC(=NN=C1)Cl Z4580564381 [1,1,0,0,0,0|2,0,0]=4 1001 B10R1.10 CCCC1=CC(=NN=C1)N Z4580562529 [1,1,0,0,0,0|2,0,0]=4 1002 B10R1.10 CCCC1=CC(=O)NN=C1 Z1198341234 [1,1,0,0,0,0|2,0,0]=4 1003 B10R1.10 CCCC1=NC(=CC=N1)N Z856211250 [1,1,0,0,0,0|2,0,0]=4 1004 B10R1.10 CCNC1=CC(=CC=C1)Br Z1217910559 [1,1,0,0,0,0|1,0,0]=3 1005 B10R1.10 CCNC1=CC(=CC=C1)C Z56785946 [1,1,0,0,0,0|1,0,0]=3 1006 B10R1.10 CCNC1=CC(=CC=C1)Cl Z286371690 [1,1,0,0,0,0|1,0,0]=3 1007 B10R1.10 CCNC1=CC(=NC=C1)Cl Z979422192 [1,1,0,0,0,0|2,0,0]=4 1008 B10R1.10 CCOC1=CC(=CC=C1)Br Z53833934 [1,1,0,0,0,0|1,0,0]=3 1009 B10R1.10 CCOC1=CC(=CC=C1)I Z54181578 [1,1,0,0,0,0|1,0,0]=3 1010 B10R1.10 CCOC1=CC(=NC=C1)N Z1198157310 [1,1,0,0,0,0|2,0,0]=4 1011 B10R1.10 CCOC1=NC(=CC=C1)C Z1198168604 [1,1,0,0,0,0|2,0,0]=4 1012 B10R1.10 CCOC1=NC(=CC=C1)N Z1139188017 [1,1,0,0,0,0|2,0,0]=4 1013 B10R1.10 CCSC1=CC(=CC=C1)Br Z1090207966 [1,1,0,0,0,0|1,0,0]=3 1014 B10R1.10 CCSC1=CC(=CC=C1)N Z600393424 [1,1,0,0,0,0|1,0,0]=3 1015 B10R1.10 CCSC1=CC(=NC=C1)Cl Z1157653444 [1,1,0,0,0,0|2,0,0]=4 1016 B10R1.10 CCSC1=CC=CC(=O)N1 Z3004833863 [1,1,0,0,0,0|2,0,0]=4 1017 B10R1.10 CNCC1=CC(=CC=C1)C Z102766992 [1,1,0,0,0,0|1,0,0]=3 1018 B10R1.10 CNCC1=CC(=CC=C1)Cl Z56963343 [1,1,0,0,0,0|1,0,0]=3 1019 B10R1.10 CNCC1=CC(=CC=C1)F Z56946085 [1,1,0,0,0,0|1,0,0]=3 1020 B10R1.10 CNCC1=CC(=CC=C1)I Z3302798080 [1,1,0,0,0,0|1,0,0]=3 1021 B10R1.10 CNCC1=CC(=CC=C1)O Z102766970 [1,1,0,0,0,0|1,0,0]=3 1022 B10R1.10 CNCC1=CC(=CN=C1)Br Z5095377359 [1,1,0,0,0,0|2,0,0]=4 1023 B10R1.10 CNCC1=CC=CC(=O)N1 Z2895739022 [1,1,0,0,0,0|2,0,0]=4 1024 B10R1.10 CNCC1=NC(=CC=C1)C Z1255523287 [1,1,0,0,0,0|2,0,0]=4 1025 B10R1.10 CNCC1=NC=CC(=C1)C Z5443664854 [1,1,0,0,0,0|2,0,0]=4 1026 B10R1.10 CNCC1=NC=CC(=C1)Cl Z3214695745 [1,1,0,0,0,0|2,0,0]=4 1027 B10R1.10 COCC1=CC(=CC=C1)N Z285163816 [1,1,0,0,0,0|1,0,0]=3 1028 B10R1.10 COCC1=CC(=CC=C1)O Z821093526 [1,1,0,0,0,0|1,0,0]=3 1029 B10R1.10 COCC1=CC(=NC=C1)N Z991490692 [1,1,0,0,0,0|2,0,0]=4 1030 B10R1.10 CSCC1=CC(=CC=C1)Br Z17129082 [1,1,0,0,0,0|1,0,0]=3 1031 B10R1.10 CSCC1=CC(=CC=C1)N Z732207152 [1,1,0,0,0,0|1,0,0]=3 1032 B10R1.10 CSCC1=CC(=NC=C1)N Z991494168 [1,1,0,0,0,0|2,0,0]=4 1033 B10R1.10 N#CCC1=CC=CC(=C1)Cl Z57039594 [1,1,0,0,0,0|1,0,1]=4 1034 B10R1.10 N#CCC1=CC=CC(=C1)F Z104477994 [1,1,0,0,0,0|1,0,1]=4 1035 B10R1.10 N#CCC1=CC=CC(=C1)N Z90120426 [1,1,0,0,0,0|1,0,1]=4 1036 B10R1.10 N#CCC1=CC=CC(=C1)O Z1198161712 [1,1,0,0,0,0|1,0,1]=4 1037 B10R1.10 NC1=CC(=CC=C1)CCO Z1198160776 [1,1,0,0,0,0|1,0,0]=3 1038 B10R1.10 NC1=NC=CC(=C1)CCO Z1197888440 [1,1,0,0,0,0|2,0,0]=4 1039 B10R1.10 NCCC1=CC(=CC=C1)Br Z285143760 [1,1,0,0,0,0|1,0,0]=3 1040 B10R1.10 NCCC1=CC(=CC=C1)Cl Z57051063 [1,1,0,0,0,0|1,0,0]=3 1041 B10R1.10 NCCC1=CC(=CC=C1)F Z96092963 [1,1,0,0,0,0|1,0,0]=3 1042 B10R1.10 NCCC1=CC(=CC=C1)I Z4874662549 [1,1,0,0,0,0|1,0,0]=3 1043 B10R1.10 NCCC1=CC(=CC=C1)O Z935140764 [1,1,0,0,0,0|1,0,0]=3 1044 B10R1.10 NCCC1=CC(=CN=C1)O Z1504671788 [1,1,0,0,0,0|2,0,0]=4 1045 B10R1.10 NCCC1=CC(=NC=C1)N Z2310698980 [1,1,0,0,0,0|2,0,0]=4 1046 B10R1.10 NOCC1=CC(=CC=C1)Cl Z1198339567 [1,1,0,0,0,0|2,0,0]=4 1047 B10R1.10 O=CCC1=CC=CC(=C1)Br Z1079442816 [1,1,0,0,0,0|1,0,1]=4 1048 B10R1.10 O=CCC1=CC=CC(=C1)Cl Z993017836 [1,1,0,0,0,0|1,0,1]=4 1049 B10R1.10 OCCC1=CC(=CC=C1)Cl Z992289382 [1,1,0,0,0,0|1,0,0]=3 1050 B10R1.10 OCCC1=CC(=CC=C1)F Z397587224 [1,1,0,0,0,0|1,0,0]=3 1051 B10R1.15 C=C(CN)C1=CC=CC=C1 Z2065464323 [1,1,0,0,0,0|1,0,1]=4 1052 B10R1.15 C=CC(O)C1=CC=CC=C1 Z1255438717 [1,1,0,0,0,0|0,0,2]=4 1053 B10R1.15 CC(C=O)C1=CC=CC=C1 Z104495674 [1,1,0,0,0,0|1,0,1]=4 1054 B10R1.15 CC(CBr)C1=CC=CC=C1 Z756118300 [1,1,0,0,0,0|1,0,0]=3 1055 B10R1.15 CC(CN)C1=CC=NC=C1 Z415654978 [1,1,0,0,0,0|2,0,0]=4 1056 B10R1.15 CCC(=O)C1=CC=CC=C1 Z104473068 [1,1,0,0,0,0|0,0,1]=3 1057 B10R1.15 CCC(=O)C1=CC=NC=C1 Z513733916 [1,1,0,0,0,0|1,0,1]=4 1058 B10R1.15 CCC(N)C1=CC=CC=C1 Z1262252904 [1,1,0,0,0,0|0,0,0]=2 1059 B10R1.15 CCC(N)C1=CC=NC=C1 Z228583312 [1,1,0,0,0,0|1,0,0]=3 1060 B10R1.15 CCC(O)C1=CC=CC=C1 Z335245178 [1,1,0,0,0,0|0,0,0]=2 1061 B10R1.15 CCC(O)C1=CC=NC=C1 Z513749638 [1,1,0,0,0,0|1,0,0]=3 1062 B10R1.15 CNC(=N)C1=CC=CC=C1 Z2096088186 [1,1,0,0,0,0|1,0,1]=4 1063 B10R1.15 CNC(=O)C1=CC=CC=C1 Z32016410 [1,1,0,0,0,0|1,0,1]=4 1064 B10R1.15 CNC(C)C1=CC=CC=C1 Z85917524 [1,1,0,0,0,0|1,0,0]=3 1065 B10R1.15 CNC(C)C1=CN=CC=C1 Z451350188 [1,1,0,0,0,0|2,0,0]=4 1066 B10R1.15 CNC(C)C1=NC=CC=C1 Z451350194 [1,1,0,0,0,0|2,0,0]=4 1067 B10R1.15 COC(=O)C1=CC=CC=C1 Z19825577 [1,1,0,0,0,0|1,0,1]=4 1068 B10R1.15 C[C@H](CN)C1=CC=CC=C1 Z1203578128 [1,1,0,0,0,0|1,0,0]=3 1069 B10R1.15 N#CC(Br)C1=CC=CC=C1 Z1198157485 [1,1,0,0,0,0|1,0,1]=4 1070 B10R1.15 NC(CO)C1=CC=CC=C1 Z381674942 [1,1,0,0,0,0|1,0,0]=3 1071 B10R1.15 NC(CO)C1=CN=CC=C1 Z2350903961 [1,1,0,0,0,0|2,0,0]=4 1072 B10R1.15 NCC(=O)C1=CC=CC=C1 Z600428568 [1,1,0,0,0,0|1,0,1]=4 1073 B10R1.15 NCC(N)C1=CC=CC=C1 Z425861034 [1,1,0,0,0,0|1,0,0]=3 1074 B10R1.15 NCC(O)C1=CC=CC=C1 Z104476088 [1,1,0,0,0,0|1,0,0]=3 1075 B10R1.15 NCC(O)C1=CN=CC=C1 Z336086578 [1,1,0,0,0,0|2,0,0]=4 1076 B10R1.15 NCC(O)C1=NC=CC=C1 Z802671456 [1,1,0,0,0,0|2,0,0]=4 1077 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 Z1201618614 [1,1,0,0,0,0|1,0,0]=3 1078 B10R1.15 N[C@H](CO)C1=CC=CC=C1 Z1101444224 [1,1,0,0,0,0|1,0,0]=3 1079 B10R1.15 O=C(CCl)C1=CC=CC=C1 Z57834468 [1,1,0,0,0,0|1,0,1]=4 1080 B10R1.15 O=C(CO)C1=CC=CC=C1 Z906206792 [1,1,0,0,0,0|1,0,1]=4 1081 B10R1.15 OCC(O)C1=CC=NC=C1 Z2736474279 [1,1,0,0,0,0|2,0,0]=4 1082 B10R1.15 OCC(O)C1=NC=CC=C1 Z4985119178 [1,1,0,0,0,0|2,0,0]=4 1083 B10R1.17 BrCCOC1=CC=CC=C1 Z56950513 [1,1,0,0,0,0|1,0,0]=3 1084 B10R1.17 CCCCC1=CC=CC=C1 Z104492496 [1,1,0,0,0,0|0,0,0]=2 1085 B10R1.17 CCCNC1=CN=CC=C1 Z334882412 [1,1,0,0,0,0|1,0,0]=3 1086 B10R1.17 CCCOC1=NC=CN=C1 Z2182020100 [1,1,0,0,0,0|2,0,0]=4 1087 B10R1.17 CCCSC1=NC=CC=N1 Z18380759 [1,1,0,0,0,0|2,0,0]=4 1088 B10R1.17 CCNCC1=CC=CC=C1 Z57327176 [1,1,0,0,0,0|0,0,0]=2 1089 B10R1.17 CCNCC1=CC=NC=C1 Z57327181 [1,1,0,0,0,0|1,0,0]=3 1090 B10R1.17 CCNCC1=NC=CC=C1 Z90513146 [1,1,0,0,0,0|1,0,0]=3 1091 B10R1.17 CCSCC1=NC=CC=C1 Z1607601848 [1,1,0,0,0,0|1,0,0]=3 1092 B10R1.17 CNCCC1=CC=CC=C1 Z445226260 [1,1,0,0,0,0|0,0,0]=2 1093 B10R1.17 CNCCC1=CC=NC=C1 Z235580560 [1,1,0,0,0,0|1,0,0]=3 1094 B10R1.17 CNCCC1=CN=CC=C1 Z2418466818 [1,1,0,0,0,0|1,0,0]=3 1095 B10R1.17 CNCCC1=NC=CC=C1 Z2238930991 [1,1,0,0,0,0|1,0,0]=3 1096 B10R1.17 CNCCC1=NC=CC=N1 Z3023337072 [1,1,0,0,0,0|2,0,0]=4 1097 B10R1.17 COCCC1=CC=CC=C1 Z104494216 [1,1,0,0,0,0|0,0,0]=2 1098 B10R1.17 N#CCCC1=CC=CC=C1 Z104507980 [1,1,0,0,0,0|0,0,1]=3 1099 B10R1.17 N#CCNC1=CC=CC=C1 Z56347332 [1,1,0,0,0,0|1,0,1]=4 1100 B10R1.17 N#CCOC1=CC=CC=C1 Z53792061 [1,1,0,0,0,0|1,0,1]=4 1101 B10R1.17 N#CCSC1=CC=CC=C1 Z19751391 [1,1,0,0,0,0|1,0,1]=4 1102 B10R1.17 NC/C=C/C1=CC=CC=C1 Z2953771905 [1,1,0,0,0,0|0,0,2]=4 1103 B10R1.17 NCC#CC1=CC=CC=C1 Z227964210 [1,1,0,0,0,0|0,0,2]=4 1104 B10R1.17 NCCCC1=CC=CC=C1 Z104478312 [1,1,0,0,0,0|0,0,0]=2 1105 B10R1.17 NCCCC1=CN=CC=C1 Z3058301115 [1,1,0,0,0,0|1,0,0]=3 1106 B10R1.17 NCCCC1=CN=NC=C1 Z3270187722 [1,1,0,0,0,0|2,0,0]=4 1107 B10R1.17 NCCCC1=NC=CC=C1 Z600381818 [1,1,0,0,0,0|1,0,0]=3 1108 B10R1.17 NCCCC1=NC=CN=C1 Z1474025943 [1,1,0,0,0,0|2,0,0]=4 1109 B10R1.17 NCCNC1=CC=NC=C1 Z317257862 [1,1,0,0,0,0|2,0,0]=4 1110 B10R1.17 NCCNC1=NC=CC=C1 Z85923460 [1,1,0,0,0,0|2,0,0]=4 1111 B10R1.17 NCCOC1=CC=CC=C1 Z355423232 [1,1,0,0,0,0|1,0,0]=3 1112 B10R1.17 NCCOC1=CC=NC=C1 Z3243651499 [1,1,0,0,0,0|2,0,0]=4 1113 B10R1.17 NCCOC1=CN=CC=C1 Z429662874 [1,1,0,0,0,0|2,0,0]=4 1114 B10R1.17 NCCSC1=CC=CC=C1 Z57970213 [1,1,0,0,0,0|1,0,0]=3 1115 B10R1.17 NNCCC1=CC=CC=C1 Z927192062 [1,1,0,0,0,0|1,0,0]=3 1116 B10R1.17 O=CCCC1=CC=CC=C1 Z87002472 [1,1,0,0,0,0|0,0,1]=3 1117 B10R1.17 O=CCCC1=CC=NC=C1 Z1070006438 [1,1,0,0,0,0|1,0,1]=4 1118 B10R1.17 O=CCCC1=CN=CC=C1 Z1198276578 [1,1,0,0,0,0|1,0,1]=4 1119 B10R1.17 O=CCCC1=NC=CC=C1 Z1079158816 [1,1,0,0,0,0|1,0,1]=4 1120 B10R1.17 O=CCOC1=CC=CC=C1 Z854102570 [1,1,0,0,0,0|1,0,1]=4 1121 B10R1.17 O=CNCC1=CC=CC=C1 Z1203730748 [1,1,0,0,0,0|1,0,1]=4 1122 B10R1.17 OC/C=C/C1=CC=CC=C1 Z104473562 [1,1,0,0,0,0|0,0,2]=4 1123 B10R1.17 OCCCC1=CC=CC=C1 Z104476660 [1,1,0,0,0,0|0,0,0]=2 1124 B10R1.17 OCCCC1=CC=NC=C1 Z104475752 [1,1,0,0,0,0|1,0,0]=3 1125 B10R1.17 OCCCC1=CN=CC=C1 Z104479004 [1,1,0,0,0,0|1,0,0]=3 1126 B10R1.17 OCCCC1=NC=NC=C1 Z2044799287 [1,1,0,0,0,0|2,0,0]=4 1127 B10R1.17 OCCNC1=CC=NC=C1 Z359301874 [1,1,0,0,0,0|2,0,0]=4 1128 B10R1.17 OCCNC1=NC=CC=C1 Z31212159 [1,1,0,0,0,0|2,0,0]=4 1129 B10R1.17 OCCOC1=CC=CC=C1 Z104473570 [1,1,0,0,0,0|1,0,0]=3 1130 B10R1.17 OCCOC1=CN=CC=C1 Z1180078238 [1,1,0,0,0,0|2,0,0]=4 1131 B10R1.17 OCCSC1=CC=CC=C1 Z149157348 [1,1,0,0,0,0|1,0,0]=3 1132 B10R1.17 S=C=NCC1=CC=CC=C1 Z56869309 [1,1,0,0,0,0|1,0,1]=4 1133 B10R1.18 CC(=O)CC1=CC=NC=C1 Z992409812 [1,1,0,0,0,0|1,0,1]=4 1134 B10R1.18 CC(=O)NC1=CC=CC=C1 Z27782600 [1,1,0,0,0,0|1,0,1]=4 1135 B10R1.18 CC(C)CC1=CC=CC=C1 Z104486386 [1,1,0,0,0,0|0,0,0]=2 1136 B10R1.18 CC(C)CC1=NC=CC=C1 Z1201621742 [1,1,0,0,0,0|1,0,0]=3 1137 B10R1.18 CC(C)NC1=CC=CC=C1 Z104475020 [1,1,0,0,0,0|1,0,0]=3 1138 B10R1.18 CC(C)NC1=CN=CC=C1 Z334882282 [1,1,0,0,0,0|2,0,0]=4 1139 B10R1.18 CC(C)OC1=CC=CC=C1 Z53833867 [1,1,0,0,0,0|1,0,0]=3 1140 B10R1.18 CC(C)OC1=CC=NC=C1 Z1140308716 [1,1,0,0,0,0|2,0,0]=4 1141 B10R1.18 CC(N)CC1=CC=NC=C1 Z285143992 [1,1,0,0,0,0|1,0,0]=3 1142 B10R1.18 CC(O)CC1=CC=CC=C1 Z513749298 [1,1,0,0,0,0|0,0,0]=2 1143 B10R1.18 CC(O)CC1=CC=NC=C1 Z992409872 [1,1,0,0,0,0|1,0,0]=3 1144 B10R1.18 CC(O)CC1=NC=CC=C1 Z513750714 [1,1,0,0,0,0|1,0,0]=3 1145 B10R1.18 CN(C)CC1=CN=CC=C1 Z140563088 [1,1,0,0,0,0|2,0,0]=4 1146 B10R1.18 CN(C)CC1=NC=CC=C1 Z4614651190 [1,1,0,0,0,0|2,0,0]=4 1147 B10R1.18 N=C(N)CC1=CC=CC=C1 Z600428462 [1,1,0,0,0,0|1,0,1]=4 1148 B10R1.18 NC(=O)CC1=CC=CC=C1 Z33546508 [1,1,0,0,0,0|1,0,1]=4 1149 B10R1.18 NC(=S)CC1=CC=CC=C1 Z56928578 [1,1,0,0,0,0|1,0,1]=4 1150 B10R1.18 O=S(O)CC1=CC=CC=C1 Z3211806022 [1,1,0,0,0,0|2,0,0]=4 1151 B10R1.18 O=[N+]([O-])CC1=CC=CC=C1 Z995236210 [1,1,0,0,0,0|2,0,0]=4 1152 B10R1.18 OB(O)CC1=CC=CC=C1 Z1147227831 [1,1,0,0,0,0|2,0,0]=4 1153 B10R1.14 CCC(N)C1=CC=C(S1)Cl Z359503512 [0,1,0,0,1,0|2,0,0]=4 1154 B10R1.16 CCNCC1=CC=C(S1)Br Z85920474 [0,1,0,0,1,0|2,0,0]=4 1155 B10R1.16 CCNCC1=CC=C(S1)Cl Z57051062 [0,1,0,0,1,0|2,0,0]=4 1156 B10R1.16 NCCCC1=CC(=NO1)O Z3214695832 [0,1,0,0,1,0|2,0,0]=4 1157 B10R1.16 OCCCC1=CC(=CS1)Br Z993012592 [0,1,0,0,1,0|2,0,0]=4 1158 B10R1.54 CC1=CC=C(S1)CC(C)N Z381678020 [0,1,0,0,1,0|2,0,0]=4 1159 B10R1.96 CCCC1=CC=C(S1)C=O Z1198171732 [0,1,0,0,1,0|1,0,1]=4 1160 B10R1.96 CCCN1C=CC(=C1)C=O Z1274736901 [0,1,0,0,1,0|1,0,1]=4 1161 B12R1.1 C#CCNCC1=CC=C(C=C1)C Z857666950 [0,2,0,0,0,0|1,0,1]=4 1162 B12R1.1 C#CCNCC1=CC=C(C=C1)F Z951367660 [0,2,0,0,0,0|1,0,1]=4 1163 B12R1.1 CC1=CC=C(C=C1)CNCCO Z57328136 [0,2,0,0,0,0|1,0,0]=3 1164 B12R1.1 CC1=CC=C(C=C1)NCCC#N Z56887629 [0,2,0,0,0,0|1,0,1]=4 1165 B12R1.1 CC1=CC=C(C=C1)OCCC#N Z54337098 [0,2,0,0,0,0|1,0,1]=4 1166 B12R1.1 CC1=CC=C(C=C1)OCCCN Z285166764 [0,2,0,0,0,0|1,0,0]=3 1167 B12R1.1 CC1=CC=C(C=C1)SCCC#N Z54555980 [0,2,0,0,0,0|1,0,1]=4 1168 B12R1.1 CC1=CN=C(C=C1)NCCCN Z1267881688 [0,2,0,0,0,0|2,0,0]=4 1169 B12R1.1 CCCCOC1=CC=C(C=C1)O Z381414690 [0,2,0,0,0,0|0,0,0]=2 1170 B12R1.1 CCCCOC1=NC=C(C=C1)N Z409191158 [0,2,0,0,0,0|2,0,0]=4 1171 B12R1.1 CCCNCC1=CC=C(C=C1)F Z57065603 [0,2,0,0,0,0|1,0,0]=3 1172 B12R1.1 CNC/C=C/C1=CC=C(C=C1)Br Z1834223589 [0,2,0,0,0,0|1,0,1]=4 1173 B12R1.1 CNCCOC1=CC=C(C=C1)Br Z55993065 [0,2,0,0,0,0|1,0,0]=3 1174 B12R1.1 CNCCOC1=CC=C(C=C1)C Z138105388 [0,2,0,0,0,0|1,0,0]=3 1175 B12R1.1 CNCCOC1=CC=C(C=C1)Cl Z56963344 [0,2,0,0,0,0|1,0,0]=3 1176 B12R1.1 CNCCOC1=CC=C(C=C1)F Z138105420 [0,2,0,0,0,0|1,0,0]=3 1177 B12R1.1 CNCCOC1=CC=C(C=C1)O Z1209979801 [0,2,0,0,0,0|0,0,0]=2 1178 B12R1.1 COCCNC1=CC=C(C=C1)N Z812516870 [0,2,0,0,0,0|1,0,0]=3 1179 B12R1.1 COCCOC1=CC=C(C=C1)Br Z167838728 [0,2,0,0,0,0|1,0,0]=3 1180 B12R1.1 COCCOC1=CC=C(C=C1)F Z285938284 [0,2,0,0,0,0|1,0,0]=3 1181 B12R1.1 COCCOC1=CC=C(C=C1)O Z381414750 [0,2,0,0,0,0|0,0,0]=2 1182 B12R1.1 COCCOC1=CC=C(C=C1)S Z1689885585 [0,2,0,0,0,0|0,1,0]=3 1183 B12R1.1 COCCOC1=NC=C(C=C1)Br Z808608862 [0,2,0,0,0,0|2,0,0]=4 1184 B12R1.1 COCCOC1=NC=C(C=C1)N Z234893809 [0,2,0,0,0,0|2,0,0]=4 1185 B12R1.1 COCCSC1=CC=C(C=C1)N Z412014166 [0,2,0,0,0,0|1,0,0]=3 1186 B12R1.1 CSCCOC1=CC=C(C=C1)I Z54518503 [0,2,0,0,0,0|1,0,0]=3 1187 B12R1.1 ClC1=CC=C(C=C1)OCCCBr Z90122426 [0,2,0,0,0,0|1,0,0]=3 1188 B12R1.1 FC1=CC=C(C=C1)OCCCBr Z90122147 [0,2,0,0,0,0|1,0,0]=3 1189 B12R1.1 FC1=CC=C(C=C1)OCCCCl Z56347250 [0,2,0,0,0,0|1,0,0]=3 1190 B12R1.1 N#CCCNC1=CC=C(C=C1)Br Z56855204 [0,2,0,0,0,0|1,0,1]=4 1191 B12R1.1 N#CCCNC1=CC=C(C=C1)Cl Z56938006 [0,2,0,0,0,0|1,0,1]=4 1192 B12R1.1 N#CCCNC1=CC=C(C=C1)F Z56813500 [0,2,0,0,0,0|1,0,1]=4 1193 B12R1.1 N#CCCOC1=CC=C(C=C1)Br Z54336945 [0,2,0,0,0,0|1,0,1]=4 1194 B12R1.1 N#CCCOC1=CC=C(C=C1)F Z54337110 [0,2,0,0,0,0|1,0,1]=4 1195 B12R1.1 N#CCCSC1=CC=C(C=C1)F Z54340130 [0,2,0,0,0,0|1,0,1]=4 1196 B12R1.1 N#CCSCC1=CC=C(C=C1)Cl Z18433100 [0,2,0,0,0,0|1,0,1]=4 1197 B12R1.1 NC1=CC=C(C=C1)CCCCO Z1262622677 [0,2,0,0,0,0|1,0,0]=3 1198 B12R1.1 NC1=CC=C(C=C1)COCCO Z332379572 [0,2,0,0,0,0|1,0,0]=3 1199 B12R1.1 NC1=CC=C(C=C1)OCCCO Z382707186 [0,2,0,0,0,0|1,0,0]=3 1200 B12R1.1 NC1=CC=C(C=C1)SCCCO Z412012390 [0,2,0,0,0,0|1,0,0]=3 1201 B12R1.1 NCC/C=C/C1=CC=C(C=C1)Br Z2651620817 [0,2,0,0,0,0|1,0,1]=4 1202 B12R1.1 NCCCCC1=CC=C(C=C1)Br Z5880376049 [0,2,0,0,0,0|1,0,0]=3 1203 B12R1.1 NCCCCC1=CC=C(C=C1)Cl Z3234944947 [0,2,0,0,0,0|1,0,0]=3 1204 B12R1.1 NCCCOC1=CC=C(C=C1)F Z271006096 [0,2,0,0,0,0|1,0,0]=3 1205 B12R1.1 NCCCSC1=CC=C(C=C1)F Z56988241 [0,2,0,0,0,0|1,0,0]=3 1206 B12R1.1 NCCOCC1=CC=C(C=C1)Cl Z1511495255 [0,2,0,0,0,0|1,0,0]=3 1207 B12R1.1 NCCSCC1=CC=C(C=C1)Cl Z1891773800 [0,2,0,0,0,0|1,0,0]=3 1208 B12R1.1 NCCSCC1=CN=C(C=C1)Cl Z406685558 [0,2,0,0,0,0|2,0,0]=4 1209 B12R1.1 NNCCOC1=CC=C(C=C1)Cl Z94597880 [0,2,0,0,0,0|2,0,0]=4 1210 B12R1.1 OC1=CC=C(C=C1)SC/C=C/Cl Z733876456 [0,2,0,0,0,0|0,0,2]=4 1211 B12R1.1 OCCCNC1=CC=C(C=C1)Cl Z104647680 [0,2,0,0,0,0|1,0,0]=3 1212 B12R1.1 OCCCOC1=CC=C(C=C1)Br Z425795726 [0,2,0,0,0,0|1,0,0]=3 1213 B12R1.1 OCCCOC1=CC=C(C=C1)F Z228585902 [0,2,0,0,0,0|1,0,0]=3 1214 B12R1.1 OCCNCC1=CC=C(C=C1)F Z3225797537 [0,2,0,0,0,0|1,0,0]=3 1215 B12R1.16 CCCC(=O)C1=CC=C(C=C1)Cl Z104483624 [0,2,0,0,0,0|1,0,0]=3 1216 B12R1.16 CCCC(=O)C1=NC=C(C=C1)Cl Z1392159744 [0,2,0,0,0,0|2,0,0]=4 1217 B12R1.16 CCCC(N)C1=CC=C(C=C1)Cl Z1416203204 [0,2,0,0,0,0|1,0,0]=3 1218 B12R1.16 CCNC(=O)C1=CC=C(C=C1)I Z30281227 [0,2,0,0,0,0|1,0,1]=4 1219 B12R1.16 CCNC(=O)C1=CC=C(C=C1)N Z239124802 [0,2,0,0,0,0|1,0,1]=4 1220 B12R1.16 CCNC(=O)C1=CC=C(C=C1)O Z183861716 [0,2,0,0,0,0|0,0,1]=3 1221 B12R1.16 CCNC(C)C1=CC=C(C=C1)F Z451452334 [0,2,0,0,0,0|1,0,0]=3 1222 B12R1.16 CCOC(=O)C1=CC=C(C=C1)N Z54178706 [0,2,0,0,0,0|1,0,1]=4 1223 B12R1.16 CCOC(=O)C1=CC=C(C=C1)O Z53833636 [0,2,0,0,0,0|0,0,1]=3 1224 B12R1.16 CN(CCO)C1=CC=C(C=C1)F Z905079510 [0,2,0,0,0,0|2,0,0]=4 1225 B12R1.16 CN(CCO)C1=CC=C(C=C1)N Z359383966 [0,2,0,0,0,0|2,0,0]=4 1226 B12R1.16 CNCC(O)C1=CC=C(C=C1)F Z1263820285 [0,2,0,0,0,0|1,0,0]=3 1227 B12R1.16 COCC(N)C1=CC=C(C=C1)F Z1297772361 [0,2,0,0,0,0|1,0,0]=3 1228 B12R1.16 NC(CCO)C1=CC=C(C=C1)Br Z979743656 [0,2,0,0,0,0|1,0,0]=3 1229 B12R1.16 NC(CCO)C1=CC=C(C=C1)F Z979743658 [0,2,0,0,0,0|1,0,0]=3 1230 B12R1.16 O=C(CCCl)C1=CC=C(C=C1)F Z104478542 [0,2,0,0,0,0|1,0,1]=4 1231 B12R1.21 CC(=O)CCC1=CC=C(C=C1)C Z406376788 [0,2,0,0,0,0|1,0,0]=3 1232 B12R1.21 CC(=O)CCC1=CC=C(C=C1)F Z406376784 [0,2,0,0,0,0|1,0,0]=3 1233 B12R1.21 CC(=O)CCC1=CC=C(C=C1)I Z1263632422 [0,2,0,0,0,0|1,0,0]=3 1234 B12R1.21 CC(=O)NCC1=CC=C(C=C1)Br Z816034502 [0,2,0,0,0,0|1,0,1]=4 1235 B12R1.21 CC(=O)NCC1=CC=C(C=C1)N Z600391558 [0,2,0,0,0,0|1,0,1]=4 1236 B12R1.21 CC(C)CCC1=CC=C(C=C1)N Z424736042 [0,2,0,0,0,0|1,0,0]=3 1237 B12R1.21 CC(C)CNC1=CC=C(C=C1)Cl Z1695729058 [0,2,0,0,0,0|1,0,0]=3 1238 B12R1.21 CC(C)CNC1=NC=C(C=C1)F Z802823880 [0,2,0,0,0,0|2,0,0]=4 1239 B12R1.21 CC(C)COC1=CC=C(C=C1)O Z381414742 [0,2,0,0,0,0|0,0,0]=2 1240 B12R1.21 CC(C)COC1=NC=C(C=C1)N Z285175576 [0,2,0,0,0,0|2,0,0]=4 1241 B12R1.21 CC(C)NCC1=CC=C(C=C1)Br Z86129856 [0,2,0,0,0,0|1,0,0]=3 1242 B12R1.21 CC(C)NCC1=CC=C(C=C1)F Z86129862 [0,2,0,0,0,0|1,0,0]=3 1243 B12R1.21 CC(C)OCC1=CC=C(C=C1)Br Z823855528 [0,2,0,0,0,0|1,0,0]=3 1244 B12R1.21 CC(C)OCC1=CC=C(C=C1)N Z285178068 [0,2,0,0,0,0|1,0,0]=3 1245 B12R1.21 CC(C)SCC1=CC=C(C=C1)Br Z54548572 [0,2,0,0,0,0|1,0,0]=3 1246 B12R1.21 CC(N)CCC1=CC=C(C=C1)Br Z235361851 [0,2,0,0,0,0|1,0,0]=3 1247 B12R1.21 CC(N)CCC1=CC=C(C=C1)I Z1947443961 [0,2,0,0,0,0|1,0,0]=3 1248 B12R1.21 CC(N)CCC1=CC=C(C=C1)O Z220327456 [0,2,0,0,0,0|0,0,0]=2 1249 B12R1.21 CC(N)COC1=CC=C(C=C1)F Z271017038 [0,2,0,0,0,0|1,0,0]=3 1250 B12R1.21 CC(O)CCC1=CC=C(C=C1)O Z57921369 [0,2,0,0,0,0|0,0,0]=2 1251 B12R1.21 CC1=CC=C(C=C1)CCC(=O)N Z194976512 [0,2,0,0,0,0|1,0,1]=4 1252 B12R1.21 CC1=CC=C(C=C1)CCC(=O)O Z169855336 [0,2,0,0,0,0|1,0,1]=4 1253 B12R1.21 CC1=CC=C(C=C1)NCC(C)C Z334955606 [0,2,0,0,0,0|1,0,0]=3 1254 B12R1.21 CC1=CC=C(C=C1)OCC(C)N Z285166960 [0,2,0,0,0,0|1,0,0]=3 1255 B12R1.21 CC1=CC=C(C=C1)SCC(C)N Z1238717325 [0,2,0,0,0,0|1,0,0]=3 1256 B12R1.21 CN(C)CCC1=CC=C(C=C1)Br Z2335774813 [0,2,0,0,0,0|1,0,0]=3 1257 B12R1.21 CN(C)CCC1=CC=C(C=C1)N Z335289246 [0,2,0,0,0,0|1,0,0]=3 1258 B12R1.21 C[C@@H](O)CNC1=NC=C(C=C1)Br Z1564028158 [0,2,0,0,0,0|2,0,0]=4 1259 B12R1.21 C[C@H](O)CNC1=NC=C(C=C1)Br Z1564015843 [0,2,0,0,0,0|2,0,0]=4 1260 B12R1.21 FC1=CC=C(C=C1)NCC(F)F Z608352362 [0,2,0,0,0,0|2,0,0]=4 1261 B12R1.21 NC(=O)CCC1=CC=C(C=C1)F Z87614992 [0,2,0,0,0,0|1,0,1]=4 1262 B12R1.21 NC(=O)CCC1=CC=C(C=C1)N Z414316852 [0,2,0,0,0,0|1,0,1]=4 1263 B12R1.21 NC(=O)COC1=CC=C(C=C1)O Z381414726 [0,2,0,0,0,0|1,0,1]=4 1264 B12R1.21 NC1=CC=C(C=C1)CCC(=O)O Z336079452 [0,2,0,0,0,0|1,0,1]=4 1265 B12R1.21 NC1=CC=C(C=C1)OCC(F)F Z608351552 [0,2,0,0,0,0|2,0,0]=4 1266 B12R1.21 O=C(O)CCC1=CC=C(C=C1)Br Z118438622 [0,2,0,0,0,0|1,0,1]=4 1267 B12R1.21 O=C(O)CCC1=CC=C(C=C1)Cl Z178961272 [0,2,0,0,0,0|1,0,1]=4 1268 B12R1.21 O=C(O)CCC1=CC=C(C=C1)F Z89264973 [0,2,0,0,0,0|1,0,1]=4 1269 B12R1.21 O=C(O)CCC1=CC=C(C=C1)O Z317038012 [0,2,0,0,0,0|0,0,1]=3 1270 B12R1.21 O=C(O)CNC1=CC=C(C=C1)O Z57127481 [0,2,0,0,0,0|1,0,1]=4 1271 B12R1.21 O=C(O)COC1=CC=C(C=C1)O Z1192367471 [0,2,0,0,0,0|1,0,1]=4 1272 B12R1.21 O=C(O)CSC1=CC=C(C=C1)O Z733878444 [0,2,0,0,0,0|1,0,1]=4 1273 B12R1.49 CC(C#N)SC1=CC=C(C=C1)Br Z18744283 [0,2,0,0,0,0|2,0,0]=4 1274 B12R1.49 CC(C#N)SC1=CC=C(C=C1)Cl Z19728690 [0,2,0,0,0,0|2,0,0]=4 1275 B12R1.49 CC(C#N)SC1=CC=C(C=C1)F Z16034530 [0,2,0,0,0,0|2,0,0]=4 1276 B12R1.49 CC(CN)OC1=CC=C(C=C1)Br Z844632490 [0,2,0,0,0,0|2,0,0]=4 1277 B12R1.49 CC(CN)OC1=CC=C(C=C1)Cl Z844632498 [0,2,0,0,0,0|2,0,0]=4 1278 B12R1.49 CC(CN)OC1=CC=C(C=C1)F Z274779140 [0,2,0,0,0,0|2,0,0]=4 1279 B12R1.49 CC(CN)SC1=CC=C(C=C1)Br Z1266854950 [0,2,0,0,0,0|2,0,0]=4 1280 B12R1.49 CC1=CC=C(C=C1)CC(=O)CCl Z316174762 [0,2,0,0,0,0|1,0,1]=4 1281 B12R1.49 CC1=CC=C(C=C1)CC(Br)C#N Z85923462 [0,2,0,0,0,0|1,0,1]=4 1282 B12R1.49 CC1=CC=C(C=C1)CC(Cl)C=O Z982126370 [0,2,0,0,0,0|1,0,1]=4 1283 B12R1.49 CC1=CC=C(C=C1)CC(N)CO Z1800620539 [0,2,0,0,0,0|1,0,0]=3 1284 B12R1.49 CC1=CC=C(C=C1)OC(C)CN Z844632044 [0,2,0,0,0,0|2,0,0]=4 1285 B12R1.49 CC1=CC=C(C=C1)SC(C)C#N Z45224430 [0,2,0,0,0,0|2,0,0]=4 1286 B12R1.49 CCC(=O)CC1=CC=C(C=C1)Br Z513733694 [0,2,0,0,0,0|1,0,0]=3 1287 B12R1.49 CCC(=O)CC1=CC=C(C=C1)C Z513735300 [0,2,0,0,0,0|1,0,0]=3 1288 B12R1.49 CCC(=O)NC1=CC=C(C=C1)F Z27805867 [0,2,0,0,0,0|1,0,1]=4 1289 B12R1.49 CCC(=O)NC1=CC=C(C=C1)I Z30316420 [0,2,0,0,0,0|1,0,1]=4 1290 B12R1.49 CCC(=O)NC1=CC=C(C=C1)N Z432066898 [0,2,0,0,0,0|1,0,1]=4 1291 B12R1.49 CCC(=O)NC1=CC=C(C=C1)O Z223656304 [0,2,0,0,0,0|0,0,1]=3 1292 B12R1.49 CCC(C)OC1=CC=C(C=C1)Br Z336342658 [0,2,0,0,0,0|1,0,0]=3 1293 B12R1.49 CCC(C)OC1=CC=C(C=C1)N Z274541874 [0,2,0,0,0,0|1,0,0]=3 1294 B12R1.49 CCC(C)OC1=CC=C(C=C1)O Z381414944 [0,2,0,0,0,0|0,0,0]=2 1295 B12R1.49 CCC(N)CC1=CC=C(C=C1)Br Z2582143601 [0,2,0,0,0,0|1,0,0]=3 1296 B12R1.49 CCC(N)CC1=CC=C(C=C1)C Z431980102 [0,2,0,0,0,0|1,0,0]=3 1297 B12R1.49 CCC(N)CC1=CC=C(C=C1)Cl Z2044769785 [0,2,0,0,0,0|1,0,0]=3 1298 B12R1.49 CCC(N)CC1=CC=C(C=C1)F Z2492774579 [0,2,0,0,0,0|1,0,0]=3 1299 B12R1.49 CCC(N)CC1=CC=C(C=C1)O Z1815149210 [0,2,0,0,0,0|0,0,0]=2 1300 B12R1.49 CCC(O)CC1=CC=C(C=C1)C Z513751166 [0,2,0,0,0,0|1,0,0]=3 1301 B12R1.49 CNC(=O)CC1=CC=C(C=C1)Br Z30272406 [0,2,0,0,0,0|1,0,1]=4 1302 B12R1.49 CNC(=O)CC1=CC=C(C=C1)N Z239124750 [0,2,0,0,0,0|1,0,1]=4 1303 B12R1.49 CNC(=O)CC1=CC=C(C=C1)O Z135505392 [0,2,0,0,0,0|0,0,1]=3 1304 B12R1.49 COC(=O)CC1=CC=C(C=C1)Br Z18830099 [0,2,0,0,0,0|1,0,1]=4 1305 B12R1.49 COC(=O)CC1=CC=C(C=C1)Cl Z18425668 [0,2,0,0,0,0|1,0,1]=4 1306 B12R1.49 COC(=O)CC1=CC=C(C=C1)N Z285139238 [0,2,0,0,0,0|1,0,1]=4 1307 B12R1.49 COC(=O)NC1=CC=C(C=C1)O Z335810072 [0,2,0,0,0,0|1,0,1]=4 1308 B12R1.49 C[C@@H](CN)OC1=CC=C(C=C1)Cl Z1860991587 [0,2,0,0,0,0|2,0,0]=4 1309 B12R1.49 NC(CO)CC1=CC=C(C=C1)Cl Z3244488892 [0,2,0,0,0,0|1,0,0]=3 1310 B12R1.49 NC(CO)CC1=CC=C(C=C1)F Z1849004242 [0,2,0,0,0,0|1,0,0]=3 1311 B12R1.49 NC(CO)CC1=CC=C(C=C1)I Z1263636488 [0,2,0,0,0,0|1,0,0]=3 1312 B12R1.49 NC1=CC=C(C=C1)CC(F)CO Z4580450313 [0,2,0,0,0,0|1,0,0]=3 1313 B12R1.49 NCC(=O)CC1=CC=C(C=C1)F Z1889902528 [0,2,0,0,0,0|1,0,1]=4 1314 B12R1.49 NCC(=O)NC1=CC=C(C=C1)O Z1262237164 [0,2,0,0,0,0|1,0,1]=4 1315 B12R1.49 NCC(O)CC1=CC=C(C=C1)Br Z4990293859 [0,2,0,0,0,0|1,0,0]=3 1316 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)O Z295456854 [0,2,0,0,0,0|0,0,0]=2 1317 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)O Z203038576 [0,2,0,0,0,0|0,0,0]=2 1318 B12R1.49 O=C(CC1=CC=C(C=C1)O)NO Z135512374 [0,2,0,0,0,0|1,0,1]=4 1319 B12R1.49 O=C(CCl)CC1=CC=C(C=C1)Br Z408178414 [0,2,0,0,0,0|1,0,1]=4 1320 B12R1.49 O=C(CCl)CC1=CC=C(C=C1)Cl Z316174770 [0,2,0,0,0,0|1,0,1]=4 1321 B12R1.49 O=C(CCl)CC1=CC=C(C=C1)F Z316174768 [0,2,0,0,0,0|1,0,1]=4 1322 B12R1.49 O=C(CCl)NC1=CC=C(C=C1)O Z166646964 [0,2,0,0,0,0|1,0,1]=4 1323 B12R1.49 O=C(CO)CC1=CC=C(C=C1)F Z906206828 [0,2,0,0,0,0|1,0,1]=4 1324 B12R1.69 CC1=C(C=CC(=C1)I)NCCO Z1381509892 [0,2,0,0,0,0|2,0,0]=4 1325 B12R1.69 CC1=CC(=C(C=C1)CCCN)C Z90666959 [0,2,0,0,0,0|1,0,0]=3 1326 B12R1.69 CCCNC1=C(C=C(C=C1)Br)Cl Z2943872485 [0,2,0,0,0,0|1,0,0]=3 1327 B12R1.69 CCCNC1=C(C=C(C=C1)Cl)N Z359511154 [0,2,0,0,0,0|1,0,0]=3 1328 B12R1.69 CCCOC1=C(C=C(C=C1)F)N Z406677838 [0,2,0,0,0,0|1,0,0]=3 1329 B12R1.69 CCCOC1=C(C=C(C=C1)N)C Z2689925106 [0,2,0,0,0,0|1,0,0]=3 1330 B12R1.69 CCCOC1=C(C=C(C=C1)N)Cl Z239873352 [0,2,0,0,0,0|1,0,0]=3 1331 B12R1.69 CCCOC1=C(C=C(C=C1)N)F Z406677828 [0,2,0,0,0,0|1,0,0]=3 1332 B12R1.69 CCNCC1=C(C=C(C=C1)F)F Z1163062001 [0,2,0,0,0,0|1,0,0]=3 1333 B12R1.69 CNCCC1=C(C=C(C=C1)F)F Z3302963389 [0,2,0,0,0,0|1,0,0]=3 1334 B12R1.69 COCCN1C=CC(=CC1=O)Br Z2313531034 [0,2,0,0,0,0|2,0,0]=4 1335 B12R1.69 ClC1=CC(=C(C=C1)OCCBr)Br Z90122429 [0,2,0,0,0,0|2,0,0]=4 1336 B12R1.69 ClC1=CC(=C(C=C1)OCCBr)Cl Z56948382 [0,2,0,0,0,0|2,0,0]=4 1337 B12R1.69 NCCCC1=C(C=C(C=C1)Br)F Z424783082 [0,2,0,0,0,0|1,0,0]=3 1338 B12R1.69 NCCCC1=C(C=C(C=C1)Cl)Cl Z424783018 [0,2,0,0,0,0|1,0,0]=3 1339 B12R1.69 NCCOC1=C(C=C(C=C1)Cl)Cl Z5435727950 [0,2,0,0,0,0|2,0,0]=4 1340 B12R1.69 NCCOC1=C(C=C(C=C1)F)F Z1263820293 [0,2,0,0,0,0|2,0,0]=4 1341 B12R1.69 O=CCCC1=C(C=C(C=C1)Cl)Cl Z993017674 [0,2,0,0,0,0|1,0,1]=4 1342 B12R1.69 O=CCCC1=C(C=C(C=C1)F)F Z993017790 [0,2,0,0,0,0|1,0,1]=4 1343 B12R1.69 OCCNC1=C(C=C(C=C1)F)F Z335277958 [0,2,0,0,0,0|2,0,0]=4 1344 B12R1.69 OCCOC1=C(C=C(C=C1)Br)Br Z149164564 [0,2,0,0,0,0|2,0,0]=4 1345 B12R1.69 OCCOC1=C(C=C(C=C1)Br)Cl Z71184687 [0,2,0,0,0,0|2,0,0]=4 1346 B12R1.69 OCCOC1=C(C=C(C=C1)Cl)Br Z74088094 [0,2,0,0,0,0|2,0,0]=4 1347 B12R1.71 C#CCNC1=CC=C(C=C1)OC Z266490072 [0,2,0,0,0,0|0,0,2]=4 1348 B12R1.71 C#CCOC1=CC=C(C=C1)CO Z54564256 [0,2,0,0,0,0|0,0,2]=4 1349 B12R1.71 C=CCOC1=CC=C(C=C1)CO Z54636167 [0,2,0,0,0,0|0,0,2]=4 1350 B12R1.71 CCC1=CC=C(C=C1)CCC=O Z993017820 [0,2,0,0,0,0|1,0,1]=4 1351 B12R1.71 CCCCC1=CC=C(C=C1)C=O Z385369906 [0,2,0,0,0,0|0,0,1]=3 1352 B12R1.71 CCCCC1=CC=C(C=C1)NC Z1331041631 [0,2,0,0,0,0|1,0,0]=3 1353 B12R1.71 CCCNC1=CC=C(C=C1)CC Z334948098 [0,2,0,0,0,0|1,0,0]=3 1354 B12R1.71 CCCOC1=CC=C(C=C1)C#N Z53834534 [0,2,0,0,0,0|1,0,0]=3 1355 B12R1.71 CCCOC1=CC=C(C=C1)C=O Z53833128 [0,2,0,0,0,0|0,0,1]=3 1356 B12R1.71 CCCOC1=CC=C(C=C1)CN Z57102483 [0,2,0,0,0,0|1,0,0]=3 1357 B12R1.71 CCCOC1=CC=C(C=C1)CO Z54603099 [0,2,0,0,0,0|0,0,0]=2 1358 B12R1.71 CCCOC1=NC=C(C=C1)CN Z406677818 [0,2,0,0,0,0|2,0,0]=4 1359 B12R1.71 CCNCC1=CC=C(C=C1)C#N Z123866350 [0,2,0,0,0,0|1,0,0]=3 1360 B12R1.71 CCNCC1=CC=C(C=C1)OC Z451452322 [0,2,0,0,0,0|0,0,0]=2 1361 B12R1.71 CCOCC1=CC=C(C=C1)C#N Z295205422 [0,2,0,0,0,0|1,0,0]=3 1362 B12R1.71 COC1=CC=C(C=C1)CCC=O Z1079442590 [0,2,0,0,0,0|0,0,1]=3 1363 B12R1.71 COC1=CC=C(C=C1)CCCN Z291234224 [0,2,0,0,0,0|0,0,0]=2 1364 B12R1.71 COC1=CC=C(C=C1)CCNN Z2327071096 [0,2,0,0,0,0|1,0,0]=3 1365 B12R1.71 COC1=CC=C(C=C1)CN=C=S Z104482850 [0,2,0,0,0,0|1,0,1]=4 1366 B12R1.71 COC1=CC=C(C=C1)NCC#N Z266491018 [0,2,0,0,0,0|1,0,1]=4 1367 B12R1.71 COC1=CC=C(C=C1)OCC#N Z53792243 [0,2,0,0,0,0|1,0,1]=4 1368 B12R1.71 COC1=CC=C(C=C1)OCCBr Z56886539 [0,2,0,0,0,0|1,0,0]=3 1369 B12R1.71 COC1=CC=C(C=C1)OCCN Z54845983 [0,2,0,0,0,0|1,0,0]=3 1370 B12R1.71 COC1=CC=C(C=C1)SCC=O Z854102788 [0,2,0,0,0,0|1,0,1]=4 1371 B12R1.71 COC1=NC=C(C=C1)NCCO Z335249622 [0,2,0,0,0,0|2,0,0]=4 1372 B12R1.71 COCCC1=CC=C(C=C1)CO Z385370424 [0,2,0,0,0,0|0,0,0]=2 1373 B12R1.71 N#CC1=CC=C(C=C1)CCC=O Z1198182710 [0,2,0,0,0,0|1,0,1]=4 1374 B12R1.71 N#CC1=CC=C(C=C1)NCCO Z196118762 [0,2,0,0,0,0|2,0,0]=4 1375 B12R1.71 N#CC1=CC=C(C=C1)OCCBr Z56960251 [0,2,0,0,0,0|2,0,0]=4 1376 B12R1.71 N#CC1=CC=C(C=C1)OCCN Z1262398529 [0,2,0,0,0,0|2,0,0]=4 1377 B12R1.71 N#CC1=CC=C(C=C1)OCCO Z149165452 [0,2,0,0,0,0|2,0,0]=4 1378 B12R1.71 NCC1=CC=C(C=C1)OCCO Z1891774500 [0,2,0,0,0,0|2,0,0]=4 1379 B12R1.71 NCC1=CC=C(C=C1)SCCO Z4457865489 [0,2,0,0,0,0|2,0,0]=4 1380 B12R1.71 O=CC1=CC=C(C=C1)OCCO Z295452566 [0,2,0,0,0,0|1,0,1]=4 1381 B12R1.385 C#CCSC1=CC(=C(C=C1)O)C Z1513913579 [0,2,0,0,0,0|0,0,2]=4 1382 B12R1.385 CC1=C(C=C(C=C1)SCCN)C Z56347318 [0,2,0,0,0,0|2,0,0]=4 1383 B12R1.385 CC1=C(C=C(C=C1)SCCO)C Z149235456 [0,2,0,0,0,0|2,0,0]=4 1384 B12R1.385 CC1=C(C=CC(=C1)OCCO)N Z335092234 [0,2,0,0,0,0|2,0,0]=4 1385 B12R1.385 CCCCC1=CC(=C(C=C1)C)N Z1262626215 [0,2,0,0,0,0|1,0,0]=3 1386 B12R1.385 CCCCC1=CC(=C(C=C1)O)C Z1416171318 [0,2,0,0,0,0|0,0,0]=2 1387 B12R1.385 CCCCC1=NC(=C(C=C1)N)C Z1947958364 [0,2,0,0,0,0|2,0,0]=4 1388 B12R1.385 CCCCC1=NC=C(C(=C1)C)N Z1994825572 [0,2,0,0,0,0|2,0,0]=4 1389 B12R1.385 CCCNC1=CC(=C(C=C1)C)C Z3179194889 [0,2,0,0,0,0|1,0,0]=3 1390 B12R1.385 CCCNC1=CC(=C(C=C1)C)Cl Z3178892110 [0,2,0,0,0,0|1,0,0]=3 1391 B12R1.385 CCCNC1=CC(=C(C=C1)Cl)C Z3178893817 [0,2,0,0,0,0|1,0,0]=3 1392 B12R1.385 CCCNC1=CC(=C(C=C1)Cl)Cl Z3006084945 [0,2,0,0,0,0|1,0,0]=3 1393 B12R1.385 CCCOC1=CC(=C(C=C1)Br)Cl Z1618009620 [0,2,0,0,0,0|1,0,0]=3 1394 B12R1.385 CCCOC1=CC(=C(C=C1)N)C Z239604814 [0,2,0,0,0,0|1,0,0]=3 1395 B12R1.385 CCNCC1=CC(=C(C=C1)Cl)Cl Z752370982 [0,2,0,0,0,0|1,0,0]=3 1396 B12R1.385 CCNCC1=CC(=C(C=C1)F)F Z594413796 [0,2,0,0,0,0|1,0,0]=3 1397 B12R1.385 CNCCC1=CC(=C(C=C1)O)Br Z3710478807 [0,2,0,0,0,0|0,0,0]=2 1398 B12R1.385 COCCC1=CC(=C(C=C1)O)Cl Z1513901493 [0,2,0,0,0,0|0,0,0]=2 1399 B12R1.385 NCCOC1=CC(=C(C=C1)Cl)F Z2235790693 [0,2,0,0,0,0|2,0,0]=4 1400 B12R1.385 NCCOC1=CC(=C(C=C1)F)F Z1263820280 [0,2,0,0,0,0|2,0,0]=4 1401 B12R1.385 O=CCCC1=CC(=C(C=C1)Cl)Cl Z993017630 [0,2,0,0,0,0|1,0,1]=4 1402 B12R1.385 O=CCCC1=CC(=C(C=C1)Cl)F Z1198182696 [0,2,0,0,0,0|1,0,1]=4 1403 B12R1.385 O=CCCC1=CC(=C(C=C1)F)F Z1198182685 [0,2,0,0,0,0|1,0,1]=4 1404 B12R1.385 OCCCC1=CC(=C(C=C1)Cl)Cl Z993012522 [0,2,0,0,0,0|1,0,0]=3 1405 B12R1.385 OCCNC1=CC(=C(C=C1)F)F Z335273086 [0,2,0,0,0,0|2,0,0]=4 1406 B12R1.4 C#CC1=CC=C(C=C1)OC(C)C Z1080385566 [0,2,0,0,0,0|2,0,0]=4 1407 B12R1.4 CC(=O)NC1=CC=C(C=C1)CO Z228585230 [0,2,0,0,0,0|1,0,1]=4 1408 B12R1.4 CC(C)CC1=CC=C(C=C1)C=O Z385369920 [0,2,0,0,0,0|0,0,1]=3 1409 B12R1.4 CC(C)CC1=CC=C(C=C1)CO Z385370338 [0,2,0,0,0,0|0,0,0]=2 1410 B12R1.4 CC(C)CC1=NC=C(C=C1)C=O Z2732484016 [0,2,0,0,0,0|1,0,1]=4 1411 B12R1.4 CC(C)NC1=CC=C(C=C1)CN Z4905251594 [0,2,0,0,0,0|2,0,0]=4 1412 B12R1.4 CC(C)OC1=CC=C(C=C1)C#N Z53834533 [0,2,0,0,0,0|2,0,0]=4 1413 B12R1.4 CC(C)OC1=CC=C(C=C1)C=O Z53833127 [0,2,0,0,0,0|1,0,1]=4 1414 B12R1.4 CC(C)OC1=CC=C(C=C1)CO Z54549633 [0,2,0,0,0,0|1,0,0]=3 1415 B12R1.4 CC(C)SC1=CC=C(C=C1)CO Z1157828975 [0,2,0,0,0,0|1,0,0]=3 1416 B12R1.4 CC(O)CC1=CC=C(C=C1)C=O Z1511913303 [0,2,0,0,0,0|0,0,1]=3 1417 B12R1.4 CCC1=CC=C(C=C1)NC(C)C Z266668684 [0,2,0,0,0,0|2,0,0]=4 1418 B12R1.4 CN(C)CC1=CC=C(C=C1)C#N Z54750053 [0,2,0,0,0,0|2,0,0]=4 1419 B12R1.4 CN(C)CC1=CC=C(C=C1)C=O Z1065726000 [0,2,0,0,0,0|1,0,1]=4 1420 B12R1.4 CN(C)CC1=CC=C(C=C1)CO Z336081024 [0,2,0,0,0,0|1,0,0]=3 1421 B12R1.4 CNC1=CC=C(C=C1)OC(C)C Z1889917384 [0,2,0,0,0,0|2,0,0]=4 1422 B12R1.4 COC1=CC=C(C=C1)CC(=O)N Z33546648 [0,2,0,0,0,0|1,0,1]=4 1423 B12R1.4 COC1=CC=C(C=C1)CC(=O)O Z104476074 [0,2,0,0,0,0|1,0,1]=4 1424 B12R1.4 COC1=CC=C(C=C1)CC(C)O Z228586162 [0,2,0,0,0,0|0,0,0]=2 1425 B12R1.4 COC1=CC=C(C=C1)NC(=O)C Z28138902 [0,2,0,0,0,0|1,0,1]=4 1426 B12R1.4 COC1=CC=C(C=C1)OC(=O)C Z30195429 [0,2,0,0,0,0|1,0,1]=4 1427 B12R1.4 COC1=NC=C(C=C1)CC(=O)C Z1216822629 [0,2,0,0,0,0|1,0,1]=4 1428 B12R1.4 OCC1=CC=C(C=C1)OC(F)F Z335244764 [0,2,0,0,0,0|2,0,0]=4 1429 B12R1.19 CC(=O)CC1=CC(=C(C=C1)Br)F Z1269186824 [0,2,0,0,0,0|1,0,1]=4 1430 B12R1.19 CC(=O)CC1=CC(=C(C=C1)O)Br Z1269192817 [0,2,0,0,0,0|0,0,1]=3 1431 B12R1.19 CC(=O)NC1=CC(=C(C=C1)O)F Z1216844087 [0,2,0,0,0,0|1,0,1]=4 1432 B12R1.19 CC(C)NC1=CC(=C(C=C1)Cl)Cl Z267194630 [0,2,0,0,0,0|2,0,0]=4 1433 B12R1.19 CC(C)OC1=CC(=C(C=C1)N)Cl Z955172598 [0,2,0,0,0,0|2,0,0]=4 1434 B12R1.19 CC(C)OC1=CC(=C(C=C1)N)F Z839157364 [0,2,0,0,0,0|2,0,0]=4 1435 B12R1.19 CC(N)CC1=CC(=C(C=C1)F)Br Z285144030 [0,2,0,0,0,0|1,0,0]=3 1436 B12R1.19 CC(N)CC1=CC(=C(C=C1)O)O Z1891776857 [0,2,0,0,0,0|0,0,0]=2 1437 B12R1.19 CC(O)CC1=CC(=C(C=C1)Br)F Z1295686053 [0,2,0,0,0,0|1,0,0]=3 1438 B12R1.19 CC1=C(C=C(C=C1)CC(C)N)F Z4098107054 [0,2,0,0,0,0|1,0,0]=3 1439 B12R1.19 CC1=C(C=C(C=C1)CN(C)C)N Z335289232 [0,2,0,0,0,0|2,0,0]=4 1440 B12R1.19 CC1=C(C=CC(=C1)CC(=O)O)O Z1198169209 [0,2,0,0,0,0|1,0,1]=4 1441 B12R1.19 CC1=C(C=CC(=C1)CN(C)C)N Z335289244 [0,2,0,0,0,0|2,0,0]=4 1442 B12R1.19 CC1=C(C=CC(=C1)OC(C)C)N Z239604804 [0,2,0,0,0,0|2,0,0]=4 1443 B12R1.19 CN(C)CC1=CC(=C(C=C1)N)F Z1097100932 [0,2,0,0,0,0|2,0,0]=4 1444 B12R1.19 CN(C)CC1=CC(=C(C=C1)O)Cl Z1945695050 [0,2,0,0,0,0|1,0,0]=3 1445 B12R1.19 CS(=O)CC1=CC(=C(C=C1)Cl)N Z802580892 [0,2,0,0,0,0|2,0,0]=4 1446 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)Cl Z1205411134 [0,2,0,0,0,0|1,0,1]=4 1447 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)F Z1255445925 [0,2,0,0,0,0|1,0,1]=4 1448 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)O Z1255438427 [0,2,0,0,0,0|1,0,1]=4 1449 B12R1.20 C=C(C)C(=O)C1=CC=C(C=C1)O Z1513599636 [0,2,0,0,0,0|0,0,2]=4 1450 B12R1.20 CC(=O)C(C)C1=CC=C(C=C1)Cl Z1276728135 [0,2,0,0,0,0|1,0,1]=4 1451 B12R1.20 CC(=O)C(Cl)C1=CC=C(C=C1)F Z1255439681 [0,2,0,0,0,0|1,0,1]=4 1452 B12R1.20 CC(=O)N(C)C1=CC=C(C=C1)O Z335806634 [0,2,0,0,0,0|1,0,1]=4 1453 B12R1.20 CC(C)C(=O)C1=CC=C(C=C1)Cl Z385417200 [0,2,0,0,0,0|1,0,1]=4 1454 B12R1.20 CC(C)C(=O)C1=CC=C(C=C1)N Z1198162397 [0,2,0,0,0,0|1,0,1]=4 1455 B12R1.20 CC(C)C(=O)C1=CC=C(C=C1)O Z1198150713 [0,2,0,0,0,0|0,0,1]=3 1456 B12R1.20 CC(C)C(N)C1=CC=C(C=C1)Br Z3211605350 [0,2,0,0,0,0|1,0,0]=3 1457 B12R1.20 CC(C)C(N)C1=CC=C(C=C1)Cl Z221528970 [0,2,0,0,0,0|1,0,0]=3 1458 B12R1.20 CC(C)C(N)C1=CC=C(C=C1)F Z99598998 [0,2,0,0,0,0|1,0,0]=3 1459 B12R1.20 CC(C)C(O)C1=CC=C(C=C1)Cl Z513748660 [0,2,0,0,0,0|1,0,0]=3 1460 B12R1.20 CC(C)C(O)C1=NC=C(C=C1)Br Z1649738214 [0,2,0,0,0,0|2,0,0]=4 1461 B12R1.20 CC(Cl)C(=O)C1=CC=C(C=C1)Br Z56928896 [0,2,0,0,0,0|1,0,1]=4 1462 B12R1.20 CC(Cl)C(=O)C1=CC=C(C=C1)Cl Z85933873 [0,2,0,0,0,0|1,0,1]=4 1463 B12R1.20 CC(Cl)C(=O)C1=CC=C(C=C1)F Z56968508 [0,2,0,0,0,0|1,0,1]=4 1464 B12R1.20 CC(N)C(=O)C1=CC=C(C=C1)Cl Z3023980683 [0,2,0,0,0,0|1,0,1]=4 1465 B12R1.20 CC(N)C(O)C1=CC=C(C=C1)Br Z336086694 [0,2,0,0,0,0|1,0,0]=3 1466 B12R1.20 CC(N)C(O)C1=CC=C(C=C1)F Z336086696 [0,2,0,0,0,0|1,0,0]=3 1467 B12R1.20 CC1=CC=C(C=C1)C(=O)C(C)Cl Z56921784 [0,2,0,0,0,0|1,0,1]=4 1468 B12R1.20 CN(C)C(=O)C1=CC=C(C=C1)O Z68247175 [0,2,0,0,0,0|1,0,1]=4 1469 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)O Z1198149764 [0,2,0,0,0,0|1,0,1]=4 1470 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)O Z1255364887 [0,2,0,0,0,0|1,0,1]=4 1471 B12R1.106 CC(C)(C)CC1=CC=C(C=C1)Br Z1681356955 [0,2,0,0,0,0|1,0,0]=3 1472 B12R1.106 CC(C)(C)OC1=CC=C(C=C1)Br Z1203159865 [0,2,0,0,0,0|2,0,0]=4 1473 B12R1.106 CC(C)(C)OC1=CC=C(C=C1)N Z362795876 [0,2,0,0,0,0|2,0,0]=4 1474 B12R1.106 CC(C)(C)SC1=CC=C(C=C1)N Z332377642 [0,2,0,0,0,0|2,0,0]=4 1475 B12R1.106 CC(C)(N)CC1=CC=C(C=C1)Br Z1263529603 [0,2,0,0,0,0|1,0,0]=3 1476 B12R1.106 CC(C)(O)CC1=CC=C(C=C1)Br Z513707720 [0,2,0,0,0,0|1,0,0]=3 1477 B12R1.106 CC1=CC=C(C=C1)CC(C)(C)N Z415658550 [0,2,0,0,0,0|1,0,0]=3 1478 B12R1.106 CS(=O)(=O)CC1=CC=C(C=C1)Br Z416908782 [0,2,0,0,0,0|2,0,0]=4 1479 B12R1.106 CS(=O)(=O)CC1=CC=C(C=C1)N Z732208132 [0,2,0,0,0,0|2,0,0]=4 1480 B12R1.106 CS(=O)(=O)NC1=CC=C(C=C1)O Z45652935 [0,2,0,0,0,0|2,0,0]=4 1481 B12R1.106 FC(F)(F)CC1=CC=C(C=C1)Br Z1269118370 [0,2,0,0,0,0|2,0,0]=4 1482 B12R1.106 NC1=CC=C(C=C1)CC(F)(F)F Z1198165325 [0,2,0,0,0,0|2,0,0]=4 1483 B12R1.106 OC1=CC=C(C=C1)CC(F)(F)F Z1198278054 [0,2,0,0,0,0|1,0,0]=3 1484 B12R1.106 OC1=CC=C(C=C1)SC(F)(F)F Z276151196 [0,2,0,0,0,0|2,0,0]=4 1485 B12R1.233 CC(=O)CC1=C(C=C(C=C1)Br)F Z992965764 [0,2,0,0,0,0|1,0,1]=4 1486 B12R1.233 CC(=O)CC1=C(C=C(C=C1)Cl)F Z1198331241 [0,2,0,0,0,0|1,0,1]=4 1487 B12R1.233 CC(=O)CC1=C(C=C(C=C1)F)Br Z992965738 [0,2,0,0,0,0|1,0,1]=4 1488 B12R1.233 CC(C)CC1=C(C=C(C=C1)O)O Z1513805538 [0,2,0,0,0,0|0,0,0]=2 1489 B12R1.233 CC(C)NC1=C(C=C(C=C1)Cl)N Z359511184 [0,2,0,0,0,0|2,0,0]=4 1490 B12R1.233 CC(C)NC1=C(C=C(C=C1)F)Cl Z267287236 [0,2,0,0,0,0|2,0,0]=4 1491 B12R1.233 CC(C)NC1=C(C=C(C=C1)F)I Z4034733287 [0,2,0,0,0,0|2,0,0]=4 1492 B12R1.233 CC(C)OC1=C(C=C(C=C1)Br)N Z330805102 [0,2,0,0,0,0|2,0,0]=4 1493 B12R1.233 CC(C)OC1=C(C=C(C=C1)Cl)N Z274542066 [0,2,0,0,0,0|2,0,0]=4 1494 B12R1.233 CC(C)OC1=C(C=C(C=C1)F)N Z332376424 [0,2,0,0,0,0|2,0,0]=4 1495 B12R1.233 CC(C)OC1=C(C=C(C=C1)N)Cl Z239873346 [0,2,0,0,0,0|2,0,0]=4 1496 B12R1.233 CC(C)SC1=C(C=C(C=C1)Cl)N Z319450618 [0,2,0,0,0,0|2,0,0]=4 1497 B12R1.233 CC(N)CC1=C(C=C(C=C1)Br)F Z405046456 [0,2,0,0,0,0|1,0,0]=3 1498 B12R1.233 CC(N)CC1=C(C=C(C=C1)Cl)Cl Z285143988 [0,2,0,0,0,0|1,0,0]=3 1499 B12R1.233 CC(N)CC1=C(C=C(C=C1)F)F Z5002837134 [0,2,0,0,0,0|1,0,0]=3 1500 B12R1.233 CC1=C(C=CC(=C1)N)OC(C)C Z385462788 [0,2,0,0,0,0|2,0,0]=4 1501 B12R1.233 CC1=CC(=C(C=C1)CC(C)N)C Z285143886 [0,2,0,0,0,0|1,0,0]=3 1502 B12R1.233 CC1=CC(=C(C=C1)NC(C)C)C Z1259341051 [0,2,0,0,0,0|2,0,0]=4 1503 B12R1.233 CN(C)CC1=C(C=C(C=C1)N)Br Z489537698 [0,2,0,0,0,0|2,0,0]=4 1504 B12R1.233 CN(C)CC1=C(C=C(C=C1)N)Cl Z905073032 [0,2,0,0,0,0|2,0,0]=4 1505 B12R1.233 CN(C)CC1=C(C=C(C=C1)N)F Z1250077979 [0,2,0,0,0,0|2,0,0]=4 1506 B12R1.233 O=C(O)CC1=C(C=C(C=C1)O)Cl Z1198307592 [0,2,0,0,0,0|1,0,1]=4 1507 B12R1.5 C=C(CO)C1=CC=C(C=C1)OC Z1896425058 [0,2,0,0,0,0|1,0,1]=4 1508 B12R1.5 CCC(=O)C1=CC=C(C=C1)C#N Z1251353904 [0,2,0,0,0,0|1,0,1]=4 1509 B12R1.5 CCC(=O)C1=CC=C(C=C1)CC Z285137084 [0,2,0,0,0,0|1,0,1]=4 1510 B12R1.5 CCC(C)C1=CC=C(C=C1)C=O Z385369904 [0,2,0,0,0,0|0,0,1]=3 1511 B12R1.5 CCC(N)C1=CC=C(C=C1)OC Z85929849 [0,2,0,0,0,0|0,0,0]=2 1512 B12R1.5 CCC(O)C1=CC=C(C=C1)OC Z228586320 [0,2,0,0,0,0|0,0,0]=2 1513 B12R1.5 CCN(C)C1=CC=C(C=C1)CO Z409026316 [0,2,0,0,0,0|1,0,0]=3 1514 B12R1.5 CNC(=O)C1=CC=C(C=C1)OC Z32016396 [0,2,0,0,0,0|1,0,1]=4 1515 B12R1.5 CNC(C)C1=CC=C(C=C1)OC Z239628826 [0,2,0,0,0,0|1,0,0]=3 1516 B12R1.5 COC(=O)C1=CC=C(C=C1)CO Z25262776 [0,2,0,0,0,0|1,0,1]=4 1517 B12R1.5 COC1=CC=C(C=C1)C(=O)CCl Z56945957 [0,2,0,0,0,0|1,0,1]=4 1518 B12R1.5 COC1=CC=C(C=C1)C(=O)CO Z228585822 [0,2,0,0,0,0|1,0,1]=4 1519 B12R1.5 COC1=CC=C(C=C1)C(C)C=O Z1255380175 [0,2,0,0,0,0|1,0,1]=4 1520 B12R1.5 COC1=CC=C(C=C1)C(N)CO Z1263714101 [0,2,0,0,0,0|1,0,0]=3 1521 B12R1.5 COC1=CC=C(C=C1)[C@H](C)C=O Z1511751525 [0,2,0,0,0,0|1,0,1]=4 1522 B12R1.5 N#CC1=CC=C(C=C1)C(N)CF Z3270204937 [0,2,0,0,0,0|2,0,0]=4 1523 B12R1.5 NCC(N)C1=CC=C(C=C1)CO Z3475823886 [0,2,0,0,0,0|1,0,0]=3 1524 B12R1.9 CC(C)(CN)C1=CC=C(C=C1)Br Z415697662 [0,2,0,0,0,0|2,0,0]=4 1525 B12R1.9 CC(C)(CN)C1=CC=C(C=C1)Cl Z556092664 [0,2,0,0,0,0|2,0,0]=4 1526 B12R1.9 CC(C)(CN)C1=CC=C(C=C1)F Z725146590 [0,2,0,0,0,0|2,0,0]=4 1527 B12R1.9 CC(C)(CN)C1=CC=C(C=C1)O Z4309614316 [0,2,0,0,0,0|1,0,0]=3 1528 B12R1.9 CC(C)(CO)C1=CC=C(C=C1)N Z4991552655 [0,2,0,0,0,0|2,0,0]=4 1529 B12R1.9 CC(N)(CO)C1=CC=C(C=C1)Br Z2050688353 [0,2,0,0,0,0|2,0,0]=4 1530 B12R1.9 CC(N)(CO)C1=CC=C(C=C1)O Z2111443595 [0,2,0,0,0,0|1,0,0]=3 1531 B12R1.9 CC(O)(CN)C1=CC=C(C=C1)F Z1020684278 [0,2,0,0,0,0|2,0,0]=4 1532 B12R1.9 CC(O)(CO)C1=CC=C(C=C1)Br Z1537124450 [0,2,0,0,0,0|2,0,0]=4 1533 B12R1.9 CC1=CC=C(C=C1)C(C)(C)CN Z725146612 [0,2,0,0,0,0|2,0,0]=4 1534 B12R1.9 CCC(C)(C)C1=CC=C(C=C1)Br Z1270554970 [0,2,0,0,0,0|1,0,0]=3 1535 B12R1.9 CCC(C)(C)C1=CC=C(C=C1)O Z104477686 [0,2,0,0,0,0|0,0,0]=2 1536 B12R1.9 CCC(C)(O)C1=CC=C(C=C1)Cl Z449374102 [0,2,0,0,0,0|1,0,0]=3 1537 B12R1.9 CCS(=O)(=O)C1=CC=C(C=C1)Br Z432548638 [0,2,0,0,0,0|2,0,0]=4 1538 B12R1.9 CCS(=O)(=O)C1=CC=C(C=C1)F Z425338420 [0,2,0,0,0,0|2,0,0]=4 1539 B12R1.9 CCS(=O)(=O)C1=CC=C(C=C1)N Z227830172 [0,2,0,0,0,0|2,0,0]=4 1540 B12R1.9 CNS(=O)(=O)C1=CC=C(C=C1)O Z381036150 [0,2,0,0,0,0|2,0,0]=4 1541 B12R1.9 COC(C)(C)C1=CC=C(C=C1)Br Z1269200225 [0,2,0,0,0,0|2,0,0]=4 1542 B12R1.9 NC1=CC=C(C=C1)C(F)(F)CF Z3241835627 [0,2,0,0,0,0|2,0,0]=4 1543 B12R1.9 OCC(F)(F)C1=CC=C(C=C1)F Z1486032148 [0,2,0,0,0,0|2,0,0]=4 1544 B12R1.12 CC/C(=N/O)/C1=CC=C(C=C1)O Z49568596 [0,2,0,0,0,0|0,0,1]=3 1545 B12R1.12 CCC(C#N)C1=CC=C(C=C1)Cl Z1198339343 [0,2,0,0,0,0|1,0,0]=3 1546 B12R1.12 CCC(CN)C1=CC=C(C=C1)Cl Z1198306661 [0,2,0,0,0,0|1,0,0]=3 1547 B12R1.12 CCN(C#N)C1=CC=C(C=C1)Cl Z1862008399 [0,2,0,0,0,0|2,0,0]=4 1548 B12R1.12 CNC(CF)C1=CC=C(C=C1)Br Z3179025555 [0,2,0,0,0,0|2,0,0]=4 1549 B12R1.12 CNC(CN)C1=CC=C(C=C1)F Z941154056 [0,2,0,0,0,0|2,0,0]=4 1550 B12R1.12 CNC(CO)C1=CC=C(C=C1)Cl Z2235386839 [0,2,0,0,0,0|2,0,0]=4 1551 B12R1.12 COC(C#N)C1=CC=C(C=C1)F Z1270207023 [0,2,0,0,0,0|2,0,0]=4 1552 B12R1.12 COC(CN)C1=CC=C(C=C1)C Z4168346391 [0,2,0,0,0,0|2,0,0]=4 1553 B12R1.12 COC(CN)C1=CC=C(C=C1)Cl Z838184210 [0,2,0,0,0,0|2,0,0]=4 1554 B12R1.12 COC(CN)C1=CC=C(C=C1)F Z1278866649 [0,2,0,0,0,0|2,0,0]=4 1555 B12R1.12 COC(CN)C1=CC=C(C=C1)O Z4639315632 [0,2,0,0,0,0|1,0,0]=3 1556 B12R1.12 NCC(CO)C1=CC=C(C=C1)Cl Z2130644164 [0,2,0,0,0,0|2,0,0]=4 1557 B12R1.12 NCC(CO)C1=CC=C(C=C1)F Z1269131038 [0,2,0,0,0,0|2,0,0]=4 1558 B12R1.12 OCC(CO)C1=CC=C(C=C1)Cl Z1198166557 [0,2,0,0,0,0|2,0,0]=4 1559 B12R1.12 OCC(CO)C1=CC=C(C=C1)O Z1513899322 [0,2,0,0,0,0|1,0,0]=3 1560 B12R1.367 CC(CN)C1=CC(=C(C=C1)Cl)Cl Z4937190097 [0,2,0,0,0,0|2,0,0]=4 1561 B12R1.367 CC(CN)C1=CC(=C(C=C1)F)Cl Z4937045907 [0,2,0,0,0,0|2,0,0]=4 1562 B12R1.367 CC(CN)C1=CC(=C(C=C1)F)F Z415655058 [0,2,0,0,0,0|2,0,0]=4 1563 B12R1.367 CCC(=O)C1=CC(=C(C=C1)Cl)Cl Z56858267 [0,2,0,0,0,0|1,0,1]=4 1564 B12R1.367 CCC(=O)C1=CC(=C(C=C1)Cl)N Z1255492628 [0,2,0,0,0,0|1,0,1]=4 1565 B12R1.367 CCC(=O)C1=CC(=C(C=C1)F)N Z1255373684 [0,2,0,0,0,0|1,0,1]=4 1566 B12R1.367 CCC(=O)C1=CC(=C(C=C1)O)F Z1255468561 [0,2,0,0,0,0|0,0,1]=3 1567 B12R1.367 CCC(=O)C1=CC(=C(C=C1)O)N Z2177031047 [0,2,0,0,0,0|0,0,1]=3 1568 B12R1.367 CCC(C)C1=CC(=C(C=C1)O)N Z57441610 [0,2,0,0,0,0|0,0,0]=2 1569 B12R1.367 CCC(N)C1=CC(=C(C=C1)Br)F Z5368653956 [0,2,0,0,0,0|1,0,0]=3 1570 B12R1.367 CCC(O)C1=CC(=C(C=C1)Cl)Cl Z235447502 [0,2,0,0,0,0|1,0,0]=3 1571 B12R1.367 CC[C@@H](O)C1=CC(=C(C=C1)Cl)Cl Z1483951050 [0,2,0,0,0,0|1,0,0]=3 1572 B12R1.367 CC[C@H](O)C1=CC(=C(C=C1)C)F Z1255444475 [0,2,0,0,0,0|1,0,0]=3 1573 B12R1.367 CNC(C)C1=CC(=C(C=C1)Cl)Cl Z159528194 [0,2,0,0,0,0|2,0,0]=4 1574 B12R1.367 COC(=O)C1=CC(=C(C=C1)O)Br Z111782420 [0,2,0,0,0,0|1,0,1]=4 1575 B12R1.367 COC(=O)C1=CC(=C(C=C1)O)Cl Z25120254 [0,2,0,0,0,0|1,0,1]=4 1576 B12R1.367 COC(=O)C1=CC(=C(C=C1)O)F Z1198152178 [0,2,0,0,0,0|1,0,1]=4 1577 B12R1.367 COC(=O)C1=CC(=C(C=C1)O)N Z802838774 [0,2,0,0,0,0|1,0,1]=4 1578 B12R1.367 NC(CO)C1=CC(=C(C=C1)Br)F Z2205958451 [0,2,0,0,0,0|2,0,0]=4 1579 B12R1.367 NC(CO)C1=CC(=C(C=C1)F)Cl Z3398351125 [0,2,0,0,0,0|2,0,0]=4 1580 B12R1.367 NCC(O)C1=CC(=C(C=C1)F)F Z330910382 [0,2,0,0,0,0|2,0,0]=4 1581 B12R1.367 O=C(CCl)C1=CC(=C(C=C1)O)O Z56912624 [0,2,0,0,0,0|1,0,1]=4 1582 B12R1.367 OCC(O)C1=CC(=C(C=C1)Cl)F Z1537124099 [0,2,0,0,0,0|2,0,0]=4 1583 B12R1.1703 CC(CN)C1=C(C=C(C=C1)F)F Z415655056 [0,2,0,0,0,0|2,0,0]=4 1584 B12R1.1703 CCC(=O)C1=C(C=C(C=C1)C)O Z1513595149 [0,2,0,0,0,0|1,0,1]=4 1585 B12R1.1703 CCC(=O)C1=C(C=C(C=C1)F)F Z285136992 [0,2,0,0,0,0|1,0,1]=4 1586 B12R1.1703 CCC(=O)C1=C(C=C(C=C1)F)O Z1255424803 [0,2,0,0,0,0|1,0,1]=4 1587 B12R1.1703 CCC(N)C1=C(C=C(C=C1)F)F Z335236622 [0,2,0,0,0,0|1,0,0]=3 1588 B12R1.1703 CCC(O)C1=C(C=C(C=C1)Cl)F Z1082848670 [0,2,0,0,0,0|1,0,0]=3 1589 B12R1.1703 CCC(O)C1=C(C=C(C=C1)F)F Z756131106 [0,2,0,0,0,0|1,0,0]=3 1590 B12R1.1703 CNC(C)C1=C(C=C(C=C1)C)C Z239628972 [0,2,0,0,0,0|2,0,0]=4 1591 B12R1.1703 CNC(C)C1=C(C=C(C=C1)Cl)Cl Z140561866 [0,2,0,0,0,0|2,0,0]=4 1592 B12R1.1703 COC(=O)C1=C(C=C(C=C1)O)Cl Z1198164600 [0,2,0,0,0,0|1,0,1]=4 1593 B12R1.1703 COC(=O)C1=C(C=C(C=C1)O)F Z1198184471 [0,2,0,0,0,0|1,0,1]=4 1594 B12R1.1703 COC(=O)C1=C(C=C(C=C1)O)N Z1255399732 [0,2,0,0,0,0|1,0,1]=4 1595 B12R1.1703 COC(=O)C1=C(C=C(C=C1)O)O Z25218921 [0,2,0,0,0,0|1,0,1]=4 1596 B12R1.1703 NC(CO)C1=C(C=C(C=C1)F)F Z2582144029 [0,2,0,0,0,0|2,0,0]=4 1597 B12R1.1703 NCC(O)C1=C(C=C(C=C1)Cl)Cl Z336086576 [0,2,0,0,0,0|2,0,0]=4 1598 B12R1.1703 NCC(O)C1=C(C=C(C=C1)F)F Z330910386 [0,2,0,0,0,0|2,0,0]=4 1599 B12R1.1703 O=C(CCl)C1=C(C=C(C=C1)O)O Z56886635 [0,2,0,0,0,0|1,0,1]=4 1600 B12R1.112 CCOC1=C(C=C(C=C1)Br)C#N Z57756797 [0,2,0,0,0,0|2,0,0]=4 1601 B12R1.112 CCOC1=C(C=C(C=C1)Br)C=O Z53834335 [0,2,0,0,0,0|2,0,0]=4 1602 B12R1.112 CCOC1=C(C=C(C=C1)Cl)C=O Z57498102 [0,2,0,0,0,0|2,0,0]=4 1603 B12R1.112 CCOC1=C(C=C(C=C1)N)CO Z408157854 [0,2,0,0,0,0|2,0,0]=4 1604 B12R1.112 CCOC1=C(C=C(C=C1)N)OC Z57011404 [0,2,0,0,0,0|2,0,0]=4 1605 B12R1.112 CNCC1=C(C=C(C=C1)F)OC Z5451130516 [0,2,0,0,0,0|2,0,0]=4 1606 B12R1.112 COC1=C(C=CC(=C1)Br)CCN Z1551924124 [0,2,0,0,0,0|2,0,0]=4 1607 B12R1.112 COC1=C(C=CC(=C1)F)CCN Z5577629908 [0,2,0,0,0,0|2,0,0]=4 1608 B12R1.112 COCC1=C(C=C(C=C1)N)C#N Z1551937747 [0,2,0,0,0,0|2,0,0]=4 1609 B12R1.112 COCC1=C(C=C(C=C1)N)OC Z1551924555 [0,2,0,0,0,0|2,0,0]=4 1610 B12R1.114 C#CC1=CC(=C(C=C1)OCC)F Z1650045861 [0,2,0,0,0,0|2,0,0]=4 1611 B12R1.114 CCOC1=C(C=C(C=C1)C#N)Cl Z57756799 [0,2,0,0,0,0|2,0,0]=4 1612 B12R1.114 CCOC1=C(C=C(C=C1)C#N)F Z445161840 [0,2,0,0,0,0|2,0,0]=4 1613 B12R1.114 CCOC1=C(C=C(C=C1)C#N)N Z425853644 [0,2,0,0,0,0|2,0,0]=4 1614 B12R1.114 CCOC1=C(C=C(C=C1)C=O)F Z335440274 [0,2,0,0,0,0|1,0,1]=4 1615 B12R1.114 CCOC1=C(C=C(C=C1)C=O)O Z1198155327 [0,2,0,0,0,0|1,0,1]=4 1616 B12R1.114 CCOC1=C(C=C(C=C1)CN)C Z606260618 [0,2,0,0,0,0|2,0,0]=4 1617 B12R1.114 CCOC1=C(C=C(C=C1)CN)F Z362597728 [0,2,0,0,0,0|2,0,0]=4 1618 B12R1.114 CCOC1=C(C=C(C=C1)OC)N Z239604774 [0,2,0,0,0,0|1,0,0]=3 1619 B12R1.114 COC1=CC(=C(C=C1)CC=O)C Z1198313230 [0,2,0,0,0,0|1,0,1]=4 1620 B12R1.114 COC1=CC(=C(C=C1)CCN)Cl Z1198183309 [0,2,0,0,0,0|1,0,0]=3 1621 B12R1.114 COCC1=C(C=C(C=C1)CN)F Z285164108 [0,2,0,0,0,0|2,0,0]=4 1622 B12R1.544 CC1=C(C=CC(=C1Cl)Cl)CCN Z4970349053 [0,2,0,0,0,0|2,0,0]=4 1623 B12R1.544 CNCC1=C(C(=C(C=C1)Cl)Cl)C Z4926579520 [0,2,0,0,0,0|2,0,0]=4 1624 B12R1.1095 CC1=CC(=CC(=C1CCN)C)Br Z3032947815 [0,2,0,0,0,0|2,0,0]=4 1625 B12R1.1095 CCOC1=C(C=C(C=C1Cl)N)Cl Z398428264 [0,2,0,0,0,0|2,0,0]=4 1626 B12R1.1095 CCOC1=C(C=C(C=C1N)Cl)Br Z227829266 [0,2,0,0,0,0|2,0,0]=4 1627 B12R1.1095 CNCC1=C(C=C(C=C1C)Br)C Z3400696477 [0,2,0,0,0,0|2,0,0]=4 1628 B12R1.1095 CNCC1=C(C=C(C=C1C)C)C Z4934900266 [0,2,0,0,0,0|2,0,0]=4 1629 B12R1.1095 CNCC1=C(C=C(C=C1Cl)Cl)Cl Z6011547735 [0,2,0,0,0,0|2,0,0]=4 1630 B12R1.1095 CNCC1=C(C=C(C=C1F)F)F Z4581163242 [0,2,0,0,0,0|2,0,0]=4 1631 B12R1.1095 NCCC1=C(C=C(C=C1F)O)F Z1255445332 [0,2,0,0,0,0|1,0,0]=3 1632 B12R1.1123 CNCC1=C(C=C(C(=C1)C)C)C Z5470466430 [0,2,0,0,0,0|2,0,0]=4 1633 B12R1.1123 CNCC1=C(C=C(C(=C1)F)Br)F Z5161345118 [0,2,0,0,0,0|2,0,0]=4 1634 B12R1.113 CCCC1=CC=C(C=C1)B(O)O Z336079950 [0,2,0,0,0,0|0,0,0]=2 1635 B12R1.113 CCCC1=CC=C(C=C1)C(=O)O Z285150282 [0,2,0,0,0,0|0,0,0]=2 1636 B12R1.113 CCCC1=CC=C(C=C1)[C@@H](C)O Z360056068 [0,2,0,0,0,0|0,0,0]=2 1637 B12R1.113 CCNC1=CC=C(C=C1)C(=O)O Z381340222 [0,2,0,0,0,0|1,0,0]=3 1638 B12R1.113 CCOC1=CC=C(C=C1)B(O)O Z336079910 [0,2,0,0,0,0|1,0,0]=3 1639 B12R1.113 CCOC1=CC=C(C=C1)C(=N)N Z1262327405 [0,2,0,0,0,0|2,0,0]=4 1640 B12R1.113 CCOC1=CC=C(C=C1)C(=O)C Z53832961 [0,2,0,0,0,0|1,0,1]=4 1641 B12R1.113 CCOC1=CC=C(C=C1)C(=O)N Z33546681 [0,2,0,0,0,0|1,0,1]=4 1642 B12R1.113 CCOC1=CC=C(C=C1)C(=O)O Z56759338 [0,2,0,0,0,0|1,0,0]=3 1643 B12R1.113 CCOC1=CC=C(C=C1)C(=S)N Z56953071 [0,2,0,0,0,0|1,1,0]=4 1644 B12R1.113 CCOC1=CC=C(C=C1)C(C)N Z203884180 [0,2,0,0,0,0|2,0,0]=4 1645 B12R1.113 CCOC1=CC=C(C=C1)S(=O)[O-] Z2111525259 [0,2,0,0,0,0|1,0,1]=4 1646 B12R1.113 CCOC1=CC=C(C=C1)[C@@H](C)O Z360055638 [0,2,0,0,0,0|1,0,0]=3 1647 B12R1.113 CCOC1=CC=C(C=C1)[C@H](C)O Z360055632 [0,2,0,0,0,0|1,0,0]=3 1648 B12R1.113 CCOC1=NC=C(C=C1)C(=O)O Z240114982 [0,2,0,0,0,0|2,0,0]=4 1649 B12R1.113 CCSC1=CC=C(C=C1)C(=O)C Z332382324 [0,2,0,0,0,0|1,0,1]=4 1650 B12R1.113 CCSC1=CC=C(C=C1)C(=O)O Z228030812 [0,2,0,0,0,0|1,0,0]=3 1651 B12R1.113 CCSC1=CC=C(C=C1)C(C)N Z332384546 [0,2,0,0,0,0|2,0,0]=4 1652 B12R1.113 CCSC1=NC=C(C=C1)C(=O)O Z332377502 [0,2,0,0,0,0|2,0,0]=4 1653 B12R1.113 CN(C)C1=CC=C(C=C1)CCN Z285143748 [0,2,0,0,0,0|2,0,0]=4 1654 B12R1.113 CNCC1=CC=C(C=C1)C(=O)N Z316170532 [0,2,0,0,0,0|1,0,1]=4 1655 B12R1.113 CNCC1=CC=C(C=C1)C(C)C Z56951193 [0,2,0,0,0,0|2,0,0]=4 1656 B12R1.113 CNCC1=CC=C(C=C1)N(C)C Z57327129 [0,2,0,0,0,0|2,0,0]=4 1657 B12R1.113 CNCC1=CC=C(C=C1)S(=O)C Z1262607272 [0,2,0,0,0,0|1,0,1]=4 1658 B12R1.113 CNCC1=CC=C(C=C1)[N+](=O)[O-] Z102766816 [0,2,0,0,0,0|1,0,1]=4 1659 B12R1.113 CNCC1=NC=C(C=C1)C(=O)O Z1255404522 [0,2,0,0,0,0|2,0,0]=4 1660 B12R1.113 COCC1=CC=C(C=C1)B(O)O Z823983404 [0,2,0,0,0,0|1,0,0]=3 1661 B12R1.113 COCC1=CC=C(C=C1)C(=O)N Z52214428 [0,2,0,0,0,0|1,0,1]=4 1662 B12R1.113 COCC1=CC=C(C=C1)C(=O)O Z57981093 [0,2,0,0,0,0|1,0,0]=3 1663 B12R1.113 COCC1=NC=C(C=C1)C(=O)O Z1255402225 [0,2,0,0,0,0|2,0,0]=4 1664 B12R1.113 CSCC1=CC=C(C=C1)C(=O)O Z51581091 [0,2,0,0,0,0|1,0,0]=3 1665 B12R1.113 N#CCC1=CC=C(C=C1)C(=O)O Z274531454 [0,2,0,0,0,0|1,0,1]=4 1666 B12R1.113 NCCC1=CC=C(C=C1)B(O)O Z3244520031 [0,2,0,0,0,0|1,0,0]=3 1667 B12R1.113 NCCC1=CC=C(C=C1)C(=O)O Z104341512 [0,2,0,0,0,0|1,0,0]=3 1668 B12R1.113 NCCC1=CC=C(C=C1)C(F)F Z4652528870 [0,2,0,0,0,0|2,0,0]=4 1669 B12R1.113 NCCC1=CN=C(C=C1)C(=O)O Z5777724066 [0,2,0,0,0,0|2,0,0]=4 1670 B12R1.113 O=C(O)C1=CC=C(C=C1)CCO Z1198159608 [0,2,0,0,0,0|1,0,0]=3 1671 B12R1.116 CCOC1=CC=C(C=C1)/C=N/O Z49568529 [0,2,0,0,0,0|1,0,0]=3 1672 B12R1.116 CNCC1=CC=C(C=C1)CNC Z5600604489 [0,2,0,0,0,0|2,0,0]=4 1673 B12R1.116 NCCC1=CC=C(C=C1)CCN Z3025680672 [0,2,0,0,0,0|2,0,0]=4 1674 B12R1.288 CC1=C(C=CC(=C1)CCN)C#N Z3571126634 [0,2,0,0,0,0|2,0,0]=4 1675 B12R1.288 CCCC1=CC(=C(C=C1)OC)O Z87001810 [0,2,0,0,0,0|0,0,0]=2 1676 B12R1.288 CCNC1=CC(=C(C=C1)C#N)Cl Z391897754 [0,2,0,0,0,0|2,0,0]=4 1677 B12R1.288 CCNC1=CC(=C(C=C1)C=O)O Z1262605772 [0,2,0,0,0,0|1,0,1]=4 1678 B12R1.288 CCOC1=CC(=C(C=C1)C=O)C Z1198168460 [0,2,0,0,0,0|1,0,1]=4 1679 B12R1.288 CCOC1=CC(=C(C=C1)C=O)Cl Z1511766843 [0,2,0,0,0,0|1,0,1]=4 1680 B12R1.288 CCOC1=CC(=C(C=C1)C=O)O Z56862355 [0,2,0,0,0,0|1,0,1]=4 1681 B12R1.288 CCOC1=CC(=C(C=C1)CN)C Z5009842923 [0,2,0,0,0,0|2,0,0]=4 1682 B12R1.288 CNCC1=CC(=C(C=C1)OC)Br Z3243654223 [0,2,0,0,0,0|1,0,0]=3 1683 B12R1.288 CNCC1=CC(=C(C=C1)OC)C Z1101435075 [0,2,0,0,0,0|1,0,0]=3 1684 B12R1.288 CNCC1=CC(=C(C=C1)OC)Cl Z839166898 [0,2,0,0,0,0|1,0,0]=3 1685 B12R1.288 CNCC1=CC(=C(C=C1)OC)F Z85956704 [0,2,0,0,0,0|1,0,0]=3 1686 B12R1.288 CNCC1=CC(=C(C=C1)OC)O Z57842333 [0,2,0,0,0,0|1,0,0]=3 1687 B12R1.288 COC1=C(C=C(C=C1)CC#N)F Z96091881 [0,2,0,0,0,0|1,0,1]=4 1688 B12R1.288 COC1=C(C=C(C=C1)CCN)Br Z5122698103 [0,2,0,0,0,0|1,0,0]=3 1689 B12R1.288 COC1=C(C=C(C=C1)CCN)Cl Z3295464152 [0,2,0,0,0,0|1,0,0]=3 1690 B12R1.288 COC1=C(C=C(C=C1)CCN)F Z382820754 [0,2,0,0,0,0|1,0,0]=3 1691 B12R1.288 COC1=C(C=C(C=C1)CCO)O Z1198339386 [0,2,0,0,0,0|1,0,0]=3 1692 B12R1.44 CC1=CC(=CC(=C1O)C)CCN Z1809367687 [0,2,0,0,0,0|1,0,0]=3 1693 B12R1.44 NCCC1=CC(=C(C(=C1)F)F)F Z1682072427 [0,2,0,0,0,0|2,0,0]=4 1694 B12R1.44 OCCC1=CC(=C(C(=C1)Br)O)Br Z1860411848 [0,2,0,0,0,0|1,0,0]=3 1695 B12R1.286 C/C=C/C1=CC(=C(C=C1)O)OC Z57953030 [0,2,0,0,0,0|0,0,2]=4 1696 B12R1.286 C=CCC1=CC(=C(C=C1)O)OC Z56347226 [0,2,0,0,0,0|0,0,2]=4 1697 B12R1.286 CC1=C(C=C(C=C1)CCN)C#N Z3614117785 [0,2,0,0,0,0|2,0,0]=4 1698 B12R1.286 CCCC1=CC(=C(C=C1)N)C#N Z1532769937 [0,2,0,0,0,0|1,0,0]=3 1699 B12R1.286 CCCC1=CC(=C(C=C1)O)CO Z1513840121 [0,2,0,0,0,0|0,0,0]=2 1700 B12R1.286 CCOC1=CC(=C(C=C1)Br)C=O Z1269132679 [0,2,0,0,0,0|2,0,0]=4 1701 B12R1.286 CCOC1=CC(=C(C=C1)O)C=O Z56347093 [0,2,0,0,0,0|1,0,0]=3 1702 B12R1.286 CNCC1=CC(=C(C=C1)O)OC Z425387552 [0,2,0,0,0,0|1,0,0]=3 1703 B12R1.286 COC1=C(C=CC(=C1)CCN)C Z1198167712 [0,2,0,0,0,0|2,0,0]=4 1704 B12R1.286 COC1=C(C=CC(=C1)CCN)O Z1268152336 [0,2,0,0,0,0|1,0,0]=3 1705 B12R1.286 N#CCC1=CC(=C(C=C1)O)C=O Z1511891392 [0,2,0,0,0,0|1,0,1]=4 1706 B12R1.286 NCCC1=CC(=C(C=C1)O)CO Z1262658266 [0,2,0,0,0,0|1,0,0]=3 1707 B10R1.2 CCC1=C(C(=CC=C1)O)C Z1255437459 [0,0,1,1,0,0|0,0,2]=4 1708 B10R1.30 CCC1=C(C=CC(=C1)O)O Z1255360449 [0,0,1,1,0,0|1,0,1]=4 1709 B10R1.66 O=C(O)/C=C/C1=CCCC1 Z1198161448 [0,0,1,1,0,0|1,0,0]=3 1710 B10R2.6 C1=CC(=CC=N1)C2CC2 Z3042074264 [1,0,0,1,0,0|1,0,0]=3 1711 B10R2.6 C1=CC(=CC=N1)C2CO2 Z1187818726 [1,0,0,1,0,0|2,0,0]=4 1712 B10R2.6 C1=CC(=CN=C1)C2CO2 Z1187818722 [1,0,0,1,0,0|2,0,0]=4 1713 B10R2.6 C1=CC=C(C=C1)C2CO2 Z104486008 [1,0,0,1,0,0|1,0,0]=3 1714 B10R2.6 C1=CC=C(C=C1)[C@@H]2CO2 Z1255356265 [1,0,0,1,0,0|1,0,0]=3 1715 B10R2.6 C1=CC=C(C=C1)[C@H]2CO2 Z1255390768 [1,0,0,1,0,0|1,0,0]=3 1716 B10R2.6 C1=CN=C(C=C1)C2CO2 Z1187818707 [1,0,0,1,0,0|2,0,0]=4 1717 B10R2.7 C1=CC2=C(C=C1)CC=C2 Z104476162 [1,0,0,1,0,0|0,0,2]=4 1718 B10R2.7 C1=CC2=C(C=C1)CNC2 Z1263820391 [1,0,0,1,0,0|1,0,0]=3 1719 B10R2.7 C1=CC2=C(C=C1)COC2 Z839134770 [1,0,0,1,0,0|1,0,0]=3 1720 B10R2.7 C1=CC2=C(C=C1)NCC2 Z104475582 [1,0,0,1,0,0|1,0,0]=3 1721 B10R2.7 C1=CC2=C(C=C1)OCC2 Z104505448 [1,0,0,1,0,0|1,0,0]=3 1722 B10R2.7 C1=CC2=C(C=N1)CCN2 Z1650168304 [1,0,0,1,0,0|2,0,0]=4 1723 B10R2.7 C1=CC2=C(C=N1)CCO2 Z1681336163 [1,0,0,1,0,0|2,0,0]=4 1724 B10R2.7 C1=CC2=C(C=N1)NCC2 Z1603826893 [1,0,0,1,0,0|2,0,0]=4 1725 B10R2.7 C1=CC2=C(CCN2)N=C1 Z1203748137 [1,0,0,1,0,0|2,0,0]=4 1726 B10R2.7 C1=CC2=C(CNC2)N=C1 Z1741974952 [1,0,0,1,0,0|2,0,0]=4 1727 B10R2.7 C1=CC2=C(N=C1)NCC2 Z979438826 [1,0,0,1,0,0|2,0,0]=4 1728 B10R2.320 NC1CC2=C1C=CC=C2 Z1918018858 [1,0,0,1,0,0|1,0,0]=3 1729 B10R2.14 OC1=NNC(=C1)C2CC2 Z2037267123 [0,0,0,1,1,0|2,0,0]=4 1730 B12R2.24 BrC1=CC2=C(C=C1)CCCC2 Z299596180 [0,1,0,1,0,0|1,0,0]=3 1731 B12R2.24 BrC1=CC2=C(C=C1)CCNC2 Z1117899488 [0,1,0,1,0,0|1,0,0]=3 1732 B12R2.24 BrC1=CC2=C(C=C1)CNCC2 Z1224524500 [0,1,0,1,0,0|1,0,0]=3 1733 B12R2.24 BrC1=CC2=C(C=C1)NCCC2 Z283683538 [0,1,0,1,0,0|1,0,0]=3 1734 B12R2.24 BrC1=CC2=C(C=C1)NCCN2 Z1269212086 [0,1,0,1,0,0|2,0,0]=4 1735 B12R2.24 BrC1=CC2=C(C=C1)NCCO2 Z1741976975 [0,1,0,1,0,0|2,0,0]=4 1736 B12R2.24 BrC1=CC2=C(C=C1)OCCO2 Z56944508 [0,1,0,1,0,0|2,0,0]=4 1737 B12R2.24 BrC1=CC2=C(N=C1)NCCC2 Z1269123899 [0,1,0,1,0,0|2,0,0]=4 1738 B12R2.24 BrC1=CC2=C(N=C1)OCCC2 Z1269108179 [0,1,0,1,0,0|2,0,0]=4 1739 B12R2.24 CC1=CC2=C(C=C1)CCCN2 Z1166113428 [0,1,0,1,0,0|1,0,0]=3 1740 B12R2.24 CC1=CC2=C(C=C1)CNCC2 Z1839475447 [0,1,0,1,0,0|1,0,0]=3 1741 B12R2.24 CC1=CC2=C(C=C1)NCCC2 Z104494706 [0,1,0,1,0,0|1,0,0]=3 1742 B12R2.24 CC1=CC2=C(C=C1)NCCO2 Z1203731551 [0,1,0,1,0,0|2,0,0]=4 1743 B12R2.24 CC1=CC2=C(C=C1)OCCC2 Z939648534 [0,1,0,1,0,0|1,0,0]=3 1744 B12R2.24 CC1=NC2=C(C=C1)CCCN2 Z1198169981 [0,1,0,1,0,0|2,0,0]=4 1745 B12R2.24 CC1=NC2=C(C=C1)NCCC2 Z1203748441 [0,1,0,1,0,0|2,0,0]=4 1746 B12R2.24 ClC1=CC2=C(C=C1)CCCN2 Z3244460786 [0,1,0,1,0,0|1,0,0]=3 1747 B12R2.24 ClC1=CC2=C(C=C1)CCNC2 Z1716481593 [0,1,0,1,0,0|1,0,0]=3 1748 B12R2.24 ClC1=CC2=C(C=C1)NCCC2 Z259727454 [0,1,0,1,0,0|1,0,0]=3 1749 B12R2.24 ClC1=CC2=C(C=C1)OCCN2 Z1198179941 [0,1,0,1,0,0|2,0,0]=4 1750 B12R2.24 ClC1=CC2=C(C=C1)OCCO2 Z382713970 [0,1,0,1,0,0|2,0,0]=4 1751 B12R2.24 ClC1=CC2=C(C=C1)SCCN2 Z361994002 [0,1,0,1,0,0|2,0,0]=4 1752 B12R2.24 ClC1=CC2=C(N=C1)NCCC2 Z1862012742 [0,1,0,1,0,0|2,0,0]=4 1753 B12R2.24 FC1=CC2=C(C=C1)CCNC2 Z979717316 [0,1,0,1,0,0|1,0,0]=3 1754 B12R2.24 FC1=CC2=C(C=C1)CNCC2 Z1198169933 [0,1,0,1,0,0|1,0,0]=3 1755 B12R2.24 FC1=CC2=C(CCCN2)N=C1 Z1255375849 [0,1,0,1,0,0|2,0,0]=4 1756 B12R2.24 IC1=CC2=C(N=C1)OCCC2 Z1486000685 [0,1,0,1,0,0|2,0,0]=4 1757 B12R2.24 NC1=CC2=C(C=C1)CCCC2 Z278204684 [0,1,0,1,0,0|1,0,0]=3 1758 B12R2.24 NC1=CC2=C(C=C1)OCCC2 Z728136682 [0,1,0,1,0,0|1,0,0]=3 1759 B12R2.24 NC1=CC2=C(C=C1)OCCO2 Z56893112 [0,1,0,1,0,0|2,0,0]=4 1760 B12R2.24 NC1=CC2=C(CCOC2)N=C1 Z1255495101 [0,1,0,1,0,0|2,0,0]=4 1761 B12R2.24 NC1=NC2=C(C=C1)CCCC2 Z1198183880 [0,1,0,1,0,0|2,0,0]=4 1762 B12R2.24 NC1=NC2=C(C=C1)CCOC2 Z3005683778 [0,1,0,1,0,0|2,0,0]=4 1763 B12R2.24 NC1=NC=C2CCCCC2=C1 Z1198275331 [0,1,0,1,0,0|2,0,0]=4 1764 B12R2.24 NC1=NC=C2OCCCC2=C1 Z2235790796 [0,1,0,1,0,0|2,0,0]=4 1765 B12R2.24 O=C1C=C2CCCCC2=CN1 Z1203746588 [0,1,0,1,0,0|1,0,1]=4 1766 B12R2.24 O=C1C=C2CCOCC2=CN1 Z1509160870 [0,1,0,1,0,0|1,0,1]=4 1767 B12R2.24 O=C1C=CC2=C(N1)CCCC2 Z1198153259 [0,1,0,1,0,0|1,0,1]=4 1768 B12R2.24 O=C1C=CC2=C(N1)CCNC2 Z3234963668 [0,1,0,1,0,0|1,0,1]=4 1769 B12R2.24 OC1=CC2=C(C=C1)CCCC2 Z57182387 [0,1,0,1,0,0|0,0,0]=2 1770 B12R2.24 OC1=CC2=C(C=C1)CCCN2 Z1198176201 [0,1,0,1,0,0|0,0,0]=2 1771 B12R2.24 OC1=CC2=C(C=C1)CCNC2 Z382690838 [0,1,0,1,0,0|0,0,0]=2 1772 B12R2.24 OC1=CC2=C(C=C1)CCOC2 Z1551961557 [0,1,0,1,0,0|0,0,0]=2 1773 B12R2.24 OC1=CC2=C(C=C1)CNCC2 Z3018438111 [0,1,0,1,0,0|0,0,0]=2 1774 B12R2.24 OC1=CC2=C(C=C1)COCC2 Z1255359696 [0,1,0,1,0,0|0,0,0]=2 1775 B12R2.24 OC1=CC2=C(C=C1)NCCO2 Z4967332209 [0,1,0,1,0,0|1,0,0]=3 1776 B12R2.24 OC1=CC2=C(C=C1)OCCC2 Z1201627010 [0,1,0,1,0,0|0,0,0]=2 1777 B12R2.24 OC1=CC2=C(C=C1)OCCN2 Z3234815231 [0,1,0,1,0,0|1,0,0]=3 1778 B12R2.24 OC1=CC2=C(C=C1)OCCO2 Z168827500 [0,1,0,1,0,0|1,0,0]=3 1779 B12R2.24 OC1=CC2=C(CCCC2)N=C1 Z1255357750 [0,1,0,1,0,0|1,0,0]=3 1780 B12R2.24 OC1=NC2=C(C=C1)NCCC2 Z1618113980 [0,1,0,1,0,0|1,0,0]=3 1781 B12R2.24 OC1=NC2=C(C=N1)CCCC2 Z2756994476 [0,1,0,1,0,0|2,0,0]=4 1782 B12R2.24 OC1=NC2=C(CCCC2)N=C1 Z2306625664 [0,1,0,1,0,0|2,0,0]=4 1783 B12R2.79 CC1=CC=C(C=C1)[C@@H]2C[C@H]2N Z2380468351 [0,1,0,1,0,0|1,0,0]=3 1784 B12R2.79 C[C@@H]1O[C@H]1C2=CC=C(C=C2)Cl Z3074487523 [0,1,0,1,0,0|1,0,0]=3 1785 B12R2.79 C[C@@H]1O[C@H]1C2=CC=C(C=C2)F Z2527567177 [0,1,0,1,0,0|1,0,0]=3 1786 B12R2.79 NC1CC1C2=CC=C(C=C2)F Z1266823169 [0,1,0,1,0,0|1,0,0]=3 1787 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(C=C2)Br Z2298098036 [0,1,0,1,0,0|1,0,0]=3 1788 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(C=C2)Cl Z2298098012 [0,1,0,1,0,0|1,0,0]=3 1789 B12R2.132 CC1=CC2=C(C=C1)CCC2=O Z814904824 [0,1,0,1,0,0|1,0,1]=4 1790 B12R2.132 CC1=CC2=C(C=C1)CCC2N Z1259339087 [0,1,0,1,0,0|1,0,0]=3 1791 B12R2.132 CC1=CC2=C(C=C1)OCC2N Z1431002725 [0,1,0,1,0,0|2,0,0]=4 1792 B12R2.132 CN1C=CC2=C1C=C(C=C2)O Z1255447420 [0,1,0,1,0,0|0,0,2]=4 1793 B12R2.132 CN1CCC2=C1C=C(C=C2)N Z334596086 [0,1,0,1,0,0|1,0,0]=3 1794 B12R2.132 CN1N=NC2=C1C=C(C=C2)O Z4966740129 [0,1,0,1,0,0|2,0,0]=4 1795 B12R2.132 NC1=CC2=C(C=C1)CCC2=O Z1201619096 [0,1,0,1,0,0|1,0,1]=4 1796 B12R2.132 NC1=CC2=C(C=C1)CCC2O Z1203584428 [0,1,0,1,0,0|1,0,0]=3 1797 B12R2.132 NC1CCC2=C1C=C(C=C2)Cl Z2692095081 [0,1,0,1,0,0|1,0,0]=3 1798 B12R2.132 NC1CCC2=C1C=C(C=C2)F Z1263820321 [0,1,0,1,0,0|1,0,0]=3 1799 B12R2.132 NC1CCC2=C1C=C(C=C2)O Z1198165276 [0,1,0,1,0,0|0,0,0]=2 1800 B12R2.132 NC1COC2=C1C=C(C=C2)Br Z3241275758 [0,1,0,1,0,0|2,0,0]=4 1801 B12R2.132 NC1COC2=C1C=C(C=C2)Cl Z1431002566 [0,1,0,1,0,0|2,0,0]=4 1802 B12R2.132 NC1COC2=C1C=C(C=C2)F Z1698549696 [0,1,0,1,0,0|2,0,0]=4 1803 B12R2.132 NC1CSC2=C1C=C(C=C2)Br Z431545436 [0,1,0,1,0,0|2,0,0]=4 1804 B12R2.132 O=C1CCC2=C1C=C(C=C2)F Z814904728 [0,1,0,1,0,0|1,0,1]=4 1805 B12R2.132 O=C1CCC2=C1C=C(C=C2)I Z1269230336 [0,1,0,1,0,0|1,0,1]=4 1806 B12R2.132 O=C1NCC2=C1C=C(C=C2)O Z1198177071 [0,1,0,1,0,0|1,0,1]=4 1807 B12R2.132 O=C1OCC2=C1C=C(C=C2)O Z1198181162 [0,1,0,1,0,0|1,0,1]=4 1808 B12R2.132 OB1OCC2=C1C=C(C=C2)O Z1513809260 [0,1,0,1,0,0|2,0,0]=4 1809 B12R2.132 OC1CCC2=C1C=C(C=C2)F Z815114600 [0,1,0,1,0,0|1,0,0]=3 1810 B12R2.294 BrC1=CC=C(C=C1)CC2CO2 Z2523466484 [0,1,0,1,0,0|1,0,0]=3 1811 B12R2.294 FC1=CC=C(C=C1)CC2CO2 Z1495386285 [0,1,0,1,0,0|1,0,0]=3 1812 B12R2.294 OC1=CC=C(C=C1)OC2CC2 Z1255401633 [0,1,0,1,0,0|0,0,0]=2 1813 B12R2.1728 N#CC1CC2=C1C=C(C=C2)F Z1216846090 [0,1,0,1,0,0|1,0,1]=4 1814 B12R2.2302 BrC1=CN=C(C=C1)C2CCC2 Z1269236361 [0,1,0,1,0,0|2,0,0]=4 1815 B12R2.2302 ClC1=CC=C(C=C1)C2CCN2 Z1267773691 [0,1,0,1,0,0|1,0,0]=3 1816 B12R2.2302 ClC1=CC=C(C=C1)C2CNC2 Z3244745362 [0,1,0,1,0,0|1,0,0]=3 1817 B12R2.2302 ClC1=CN=C(C=C1)C2CNC2 Z3069013257 [0,1,0,1,0,0|2,0,0]=4 1818 B12R2.2302 NC1=CC=C(C=C1)C2CCC2 Z1203579606 [0,1,0,1,0,0|1,0,0]=3 1819 B12R2.2302 NC1=NC=C(C=C1)C2CCC2 Z1255447265 [0,1,0,1,0,0|2,0,0]=4 1820 B12R2.2302 OC1=CC=C(C=C1)C2CCC2 Z1486032779 [0,1,0,1,0,0|0,0,0]=2 1821 B12R2.606 CC1=CC2=C(N1)C=CC(=C2)O Z1198147837 [0,1,0,1,0,0|1,0,1]=4 1822 B12R2.606 CC1=NC2=C(N1)C=CC(=C2)O Z1255462447 [0,1,0,1,0,0|1,0,1]=4 1823 B12R2.606 CC1=NC2=C(O1)C=C(C=C2)O Z1201620245 [0,1,0,1,0,0|1,0,1]=4 1824 B12R2.606 CC1=NC2=C(S1)C=CC(=C2)O Z1203159861 [0,1,0,1,0,0|1,0,1]=4 1825 B12R2.606 CC1CC2=C(N1)C=CC(=C2)Br Z5212090742 [0,1,0,1,0,0|2,0,0]=4 1826 B12R2.606 CC1CC2=C(O1)C=CC(=C2)Br Z409451514 [0,1,0,1,0,0|2,0,0]=4 1827 B12R2.606 CC1CC2=C(O1)C=CC(=C2)N Z2888802910 [0,1,0,1,0,0|2,0,0]=4 1828 B12R2.606 CC1CC2=C(O1)C=CC(=C2)O Z1513815985 [0,1,0,1,0,0|1,0,0]=3 1829 B12R2.606 CN1C=C2C=C(C=CC2=N1)O Z1198343475 [0,1,0,1,0,0|2,0,0]=4 1830 B12R2.606 CN1CC2=C(C1)C=C(C=C2)N Z406357890 [0,1,0,1,0,0|2,0,0]=4 1831 B12R2.606 NC1=CC2=C(C=C1)CC(C2)O Z1203581059 [0,1,0,1,0,0|1,0,0]=3 1832 B12R2.606 NC1CC2=C(C1)C=C(C=C2)Br Z1741978324 [0,1,0,1,0,0|1,0,0]=3 1833 B12R2.606 NC1CC2=C(C1)N=CC(=C2)Br Z3466011318 [0,1,0,1,0,0|2,0,0]=4 1834 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)O Z1198147431 [0,1,0,1,0,0|1,0,1]=4 1835 B12R2.606 OC1=CC2=C(C=C1)CC(C2)O Z1198729229 [0,1,0,1,0,0|0,0,0]=2 1836 B12R2.606 OC1CC2=C(C1)C=C(C=C2)Cl Z1489210921 [0,1,0,1,0,0|1,0,0]=3 1837 B12R2.606 OC1CC2=C(C1)C=C(C=C2)F Z1862026143 [0,1,0,1,0,0|1,0,0]=3 1838 B12R2.290 CC1(CC1)C2=CC=C(C=C2)N Z3033960685 [0,1,0,1,0,0|1,0,0]=3 1839 B12R2.290 CC1(CO1)C2=CC=C(C=C2)F Z1020684130 [0,1,0,1,0,0|2,0,0]=4 1840 B12R2.290 CC1=CC=C(C=C1)C2(CO2)C Z1020684066 [0,1,0,1,0,0|2,0,0]=4 1841 B12R2.290 NC1(CC1)C2=CC=C(C=C2)Br Z600428582 [0,1,0,1,0,0|1,0,0]=3 1842 B12R2.290 NC1(CC1)C2=CC=C(C=C2)Cl Z381654482 [0,1,0,1,0,0|1,0,0]=3 1843 B12R2.290 NC1(CC1)C2=CC=C(C=C2)F Z381654558 [0,1,0,1,0,0|1,0,0]=3 1844 B12R2.290 NC1(CC1)C2=CC=C(C=C2)I Z2751942844 [0,1,0,1,0,0|1,0,0]=3 1845 B12R2.290 NC1(CC1)C2=CN=C(C=C2)O Z4521497699 [0,1,0,1,0,0|1,0,0]=3 1846 B12R2.612 CC1=CC2=C(C=C1)C(=O)CC2 Z318770612 [0,1,0,1,0,0|1,0,1]=4 1847 B12R2.612 CC1=CC2=C(C=C1)C(CC2)N Z802665938 [0,1,0,1,0,0|1,0,0]=3 1848 B12R2.612 CN1CCC2=C1C=CC(=C2)N Z992717374 [0,1,0,1,0,0|2,0,0]=4 1849 B12R2.612 CN1CCC2=C1C=CC(=C2)O Z2238129691 [0,1,0,1,0,0|1,0,0]=3 1850 B12R2.612 NC1=CC2=C(C=C1)C(=O)CC2 Z57109500 [0,1,0,1,0,0|1,0,1]=4 1851 B12R2.612 NC1=CC2=C(C=C1)C(CC2)N Z2526714445 [0,1,0,1,0,0|1,0,0]=3 1852 B12R2.612 NC1CCC2=C1C=CC(=C2)Br Z802671682 [0,1,0,1,0,0|1,0,0]=3 1853 B12R2.612 NC1CCC2=C1C=CC(=C2)Cl Z802665886 [0,1,0,1,0,0|1,0,0]=3 1854 B12R2.612 NC1CCC2=C1C=CC(=C2)F Z802671620 [0,1,0,1,0,0|1,0,0]=3 1855 B12R2.612 NC1COC2=C1C=CC(=C2)Br Z1269171640 [0,1,0,1,0,0|2,0,0]=4 1856 B12R2.612 NC1COC2=C1C=CC(=C2)Cl Z3244818242 [0,1,0,1,0,0|2,0,0]=4 1857 B12R2.612 NC1COC2=C1C=CC(=C2)F Z3014279399 [0,1,0,1,0,0|2,0,0]=4 1858 B12R2.612 O=C1CCC2=C1C=CC(=C2)Br Z318770638 [0,1,0,1,0,0|1,0,1]=4 1859 B12R2.612 O=C1CCC2=C1C=CC(=C2)Cl Z318770634 [0,1,0,1,0,0|1,0,1]=4 1860 B12R2.612 O=C1CCC2=C1C=CC(=C2)F Z318770630 [0,1,0,1,0,0|1,0,1]=4 1861 B12R2.612 O=C1CCC2=C1C=CC(=C2)O Z1255457932 [0,1,0,1,0,0|0,0,1]=3 1862 B12R2.612 O=C1COC2=C1C=CC(=C2)O Z111875098 [0,1,0,1,0,0|1,0,1]=4 1863 B12R2.612 O=C1NCC2=C1C=CC(=C2)O Z1198272536 [0,1,0,1,0,0|1,0,1]=4 1864 B12R2.612 O=C1OCC2=C1C=CC(=C2)O Z1198162647 [0,1,0,1,0,0|1,0,1]=4 1865 B12R2.612 OC1CCC2=C1C=CC(=C2)Br Z756050350 [0,1,0,1,0,0|1,0,0]=3 1866 B12R2.612 OC1CCC2=C1C=CC(=C2)F Z1198318486 [0,1,0,1,0,0|1,0,0]=3 1867 B12R2.612 OC1CCC2=C1N=CC(=C2)Br Z1269195934 [0,1,0,1,0,0|2,0,0]=4 1868 B12R2.612 OC1COC2=C1C=CC(=C2)Br Z1362940613 [0,1,0,1,0,0|2,0,0]=4 1869 B12R2.612 OC1COC2=C1C=CC(=C2)Cl Z1362956560 [0,1,0,1,0,0|2,0,0]=4 1870 B12R2.612 OC1CSC2=C1C=CC(=C2)Br Z1862026249 [0,1,0,1,0,0|2,0,0]=4 1871 B12R2.612 O[C@@H]1CCC2=C1C=CC(=C2)Br Z1269146008 [0,1,0,1,0,0|1,0,0]=3 1872 B12R2.612 O[C@@H]1CCC2=C1C=CC(=C2)Cl Z959151848 [0,1,0,1,0,0|1,0,0]=3 1873 B12R2.612 O[C@@H]1CCC2=C1C=CC(=C2)F Z959151860 [0,1,0,1,0,0|1,0,0]=3 1874 B12R2.612 O[C@H]1CCC2=C1C=CC(=C2)Cl Z959151850 [0,1,0,1,0,0|1,0,0]=3 1875 B12R2.612 O[C@H]1CCC2=C1C=CC(=C2)F Z959151856 [0,1,0,1,0,0|1,0,0]=3 1876 B12R2.246 CC1=C2CCCC2=CC(=N1)O Z4657503375 [0,1,0,1,0,0|1,0,0]=3 1877 B12R2.246 CC1=C2NCCC2=CC(=C1)F Z4462017493 [0,1,0,1,0,0|2,0,0]=4 1878 B12R2.246 CC1=CC(=C2CCNC2=C1)C Z259726288 [0,1,0,1,0,0|2,0,0]=4 1879 B12R2.246 CC1=CC(=O)NC2=C1CCC2 Z57123329 [0,1,0,1,0,0|1,0,1]=4 1880 B12R2.246 ClC1=CC(=C2NCCC2=C1)Br Z2010009897 [0,1,0,1,0,0|2,0,0]=4 1881 B12R2.246 FC1=C2NCCC2=CC(=C1)Br Z259726272 [0,1,0,1,0,0|2,0,0]=4 1882 B12R2.246 FC1=CC(=C2CCNC2=C1)F Z259726152 [0,1,0,1,0,0|2,0,0]=4 1883 B12R2.246 FC1=CC(=C2NCCC2=C1)F Z235537080 [0,1,0,1,0,0|2,0,0]=4 1884 B12R2.246 NC1=C2OCCC2=CC(=C1)Cl Z1695822064 [0,1,0,1,0,0|2,0,0]=4 1885 B12R2.246 NC1=CC(=O)NC2=C1CCC2 Z2205958518 [0,1,0,1,0,0|1,0,1]=4 1886 B12R2.246 OC1=CC(=C2OCCC2=C1)Br Z2733023909 [0,1,0,1,0,0|1,0,0]=3 1887 B12R2.246 OC1=CC(=C2OCOC2=C1)Cl Z2681245806 [0,1,0,1,0,0|2,0,0]=4 1888 B12R2.1317 CC1=C(C=CC(=C1)Br)C2CO2 Z2238811633 [0,1,0,1,0,0|2,0,0]=4 1889 B12R2.1317 CC1=C(C=CC(=C1)F)C2CO2 Z1020679774 [0,1,0,1,0,0|2,0,0]=4 1890 B12R2.1317 CC1=C(C=CC(=C1)N)C2CC2 Z992239704 [0,1,0,1,0,0|1,0,0]=3 1891 B12R2.1317 CC1=CC(=C(C=C1)C2CC2)N Z5779348196 [0,1,0,1,0,0|1,0,0]=3 1892 B12R2.1317 CC1=CC(=C(C=C1)C2CO2)C Z278165274 [0,1,0,1,0,0|2,0,0]=4 1893 B12R2.1317 ClC1=CC(=C(C=C1)C2CO2)Cl Z278165236 [0,1,0,1,0,0|2,0,0]=4 1894 B12R2.1317 FC1=CC(=C(C=C1)C2CO2)Cl Z1222418185 [0,1,0,1,0,0|2,0,0]=4 1895 B12R2.1317 FC1=CC(=C(C=C1)C2CO2)F Z278165286 [0,1,0,1,0,0|2,0,0]=4 1896 B12R2.1317 FC1=CC(=C(C=C1)[C@@H]2CO2)F Z1574937231 [0,1,0,1,0,0|2,0,0]=4 1897 B12R2.1317 FC1=CC(=C(C=C1)[C@H]2CO2)F Z1574937263 [0,1,0,1,0,0|2,0,0]=4 1898 B12R2.1317 NC1=C(C=CC(=C1)F)C2CC2 Z4738544941 [0,1,0,1,0,0|1,0,0]=3 1899 B12R2.9 CCC1=CC=C(C=C1)C2CO2 Z285186478 [0,1,0,1,0,0|2,0,0]=4 1900 B12R2.9 COC1=CC=C(C=C1)C2CO2 Z278165224 [0,1,0,1,0,0|1,0,0]=3 1901 B12R2.9 N#CC1=CC=C(C=C1)C2CO2 Z278165196 [0,1,0,1,0,0|2,0,0]=4 1902 B12R2.9 N#CC1=CN=C(C=C1)C2CC2 Z1255386311 [0,1,0,1,0,0|2,0,0]=4 1903 B12R2.9 NCC1=CC=C(C=C1)C2CC2 Z992239712 [0,1,0,1,0,0|1,0,0]=3 1904 B12R2.9 O=CC1=CC=C(C=C1)C2CC2 Z992239772 [0,1,0,1,0,0|0,0,1]=3 1905 B12R2.9 O=CC1=CN=C(C=C1)C2CC2 Z1255503250 [0,1,0,1,0,0|1,0,1]=4 1906 B12R2.44 CCC1=CC2=C(C=C1)NCC2 Z1270207865 [0,1,0,1,0,0|2,0,0]=4 1907 B12R2.44 COC1=CC2=C(C=C1)NCC2 Z235539064 [0,1,0,1,0,0|1,0,0]=3 1908 B12R2.44 COC1=NC2=C(C=C1)CCN2 Z1255390060 [0,1,0,1,0,0|2,0,0]=4 1909 B12R2.44 N#CC1=CC2=C(C=C1)CCC2 Z1079178836 [0,1,0,1,0,0|1,0,0]=3 1910 B12R2.44 N#CC1=CC2=C(C=C1)CCN2 Z1198179940 [0,1,0,1,0,0|2,0,0]=4 1911 B12R2.44 N#CC1=CC2=C(C=C1)CCO2 Z1255394026 [0,1,0,1,0,0|2,0,0]=4 1912 B12R2.44 N#CC1=CC2=C(C=C1)CNC2 Z2488962478 [0,1,0,1,0,0|2,0,0]=4 1913 B12R2.44 N#CC1=CC2=C(C=C1)NCC2 Z1095349984 [0,1,0,1,0,0|2,0,0]=4 1914 B12R2.44 N#CC1=CC2=C(C=C1)OCC2 Z448237308 [0,1,0,1,0,0|2,0,0]=4 1915 B12R2.44 NCC1=CC2=C(C=C1)CCC2 Z425449738 [0,1,0,1,0,0|1,0,0]=3 1916 B12R2.44 NCC1=CC2=C(C=C1)CNC2 Z1723549285 [0,1,0,1,0,0|2,0,0]=4 1917 B12R2.44 NCC1=CC2=C(C=C1)COC2 Z970077252 [0,1,0,1,0,0|2,0,0]=4 1918 B12R2.44 NCC1=CC2=C(C=C1)OCC2 Z448237126 [0,1,0,1,0,0|2,0,0]=4 1919 B12R2.44 O=CC1=CC2=C(C=C1)CCC2 Z385369954 [0,1,0,1,0,0|0,0,1]=3 1920 B12R2.44 O=CC1=CC2=C(C=C1)CCO2 Z1255367296 [0,1,0,1,0,0|1,0,1]=4 1921 B12R2.44 O=CC1=CC2=C(C=C1)COC2 Z1154372748 [0,1,0,1,0,0|1,0,1]=4 1922 B12R2.44 O=CC1=CC2=C(C=C1)OCC2 Z362120102 [0,1,0,1,0,0|1,0,1]=4 1923 B12R2.44 O=CC1=CC2=C(CCC2)N=C1 Z1504670007 [0,1,0,1,0,0|1,0,1]=4 1924 B12R2.44 O=CC1=NC2=C(C=C1)CCC2 Z1551929683 [0,1,0,1,0,0|1,0,1]=4 1925 B12R2.44 OCC1=CC2=C(C=C1)CCC2 Z385370372 [0,1,0,1,0,0|0,0,0]=2 1926 B12R2.44 OCC1=CC2=C(C=C1)COC2 Z1154371719 [0,1,0,1,0,0|1,0,0]=3 1927 B12R2.44 OCC1=CC2=C(C=C1)OCO2 Z104477372 [0,1,0,1,0,0|2,0,0]=4 1928 B12R2.82 CC1=C(C2=C(C=C1)CCC2)O Z1255490620 [0,1,0,1,0,0|1,0,0]=3 1929 B12R2.82 CC1=C(C2=C(C=C1)CCN2)Br Z4966512463 [0,1,0,1,0,0|2,0,0]=4 1930 B12R2.82 CC1=C(C2=C(C=C1)CNC2)Br Z1681348552 [0,1,0,1,0,0|2,0,0]=4 1931 B12R2.82 CC1=C(C=CC2=C1NCC2)Br Z1509171355 [0,1,0,1,0,0|2,0,0]=4 1932 B12R2.82 ClC1=C(C2=C(C=C1)CNC2)Cl Z4926579019 [0,1,0,1,0,0|2,0,0]=4 1933 B12R2.82 FC1=C(C2=C(C=C1)CCN2)F Z2235823250 [0,1,0,1,0,0|2,0,0]=4 1934 B12R2.100 CC1=C(C=C2CCOC2=C1)N Z1416160381 [0,1,0,1,0,0|2,0,0]=4 1935 B12R2.100 CC1=C(C=C2NCCC2=C1)C Z1203734724 [0,1,0,1,0,0|2,0,0]=4 1936 B12R2.100 ClC1=C(C=C2CCCC2=C1)Br Z2617652037 [0,1,0,1,0,0|1,0,0]=3 1937 B12R2.100 ClC1=C(C=C2CCCC2=C1)I Z4151692158 [0,1,0,1,0,0|1,0,0]=3 1938 B12R2.100 ClC1=C(C=C2CCNC2=C1)Br Z2327128596 [0,1,0,1,0,0|2,0,0]=4 1939 B12R2.100 ClC1=C(C=C2OCCC2=C1)Br Z1551957154 [0,1,0,1,0,0|2,0,0]=4 1940 B12R2.100 FC1=C(C=C2CCNC2=C1)Br Z5063074443 [0,1,0,1,0,0|2,0,0]=4 1941 B12R2.100 FC1=C(C=C2CCNC2=C1)Cl Z5076484958 [0,1,0,1,0,0|2,0,0]=4 1942 B12R2.100 NC1=C(C=C2CCCC2=C1)Br Z1509386718 [0,1,0,1,0,0|1,0,0]=3 1943 B12R2.100 NC1=C(C=C2CNCC2=C1)Br Z1192340873 [0,1,0,1,0,0|2,0,0]=4 1944 B12R2.100 NC1=C(C=C2COCC2=C1)Cl Z4198297745 [0,1,0,1,0,0|2,0,0]=4 1945 B12R2.100 OC1=C(C=C2COCC2=C1)O Z3243446774 [0,1,0,1,0,0|1,0,0]=3 1946 B12R2.100 OC1=C(C=C2OCOC2=C1)Cl Z1416158322 [0,1,0,1,0,0|2,0,0]=4 1947 B12R2.291 CC1=C(C=C(C=C1)C2CO2)C Z285186472 [0,1,0,1,0,0|2,0,0]=4 1948 B12R2.291 CC1=C(C=NC(=C1)C2CC2)Br Z2959352073 [0,1,0,1,0,0|2,0,0]=4 1949 B12R2.291 ClC1=C(C=C(C=C1)[C@@H]2CO2)Cl Z1575341659 [0,1,0,1,0,0|2,0,0]=4 1950 B12R2.291 ClC1=C(C=C(C=C1)[C@H]2CO2)Cl Z1575341772 [0,1,0,1,0,0|2,0,0]=4 1951 B12R2.291 FC1=C(C=C(C=C1)C2CO2)Br Z1020680002 [0,1,0,1,0,0|2,0,0]=4 1952 B12R2.291 FC1=C(C=C(C=C1)C2CO2)Cl Z335438012 [0,1,0,1,0,0|2,0,0]=4 1953 B12R2.291 FC1=C(C=C(C=C1)C2CO2)F Z278165284 [0,1,0,1,0,0|2,0,0]=4 1954 B12R2.291 FC1=C(C=C(C=C1)[C@@H]2CO2)F Z1574937230 [0,1,0,1,0,0|2,0,0]=4 1955 B12R2.291 FC1=C(C=C(C=C1)[C@H]2CO2)F Z1574937262 [0,1,0,1,0,0|2,0,0]=4 1956 B12R2.291 FC1=C(C=CC(=C1)C2CO2)Br Z1450935318 [0,1,0,1,0,0|2,0,0]=4 1957 B12R2.291 FC1=C(C=CC(=C1)C2CO2)Cl Z1020679832 [0,1,0,1,0,0|2,0,0]=4 1958 B12R2.291 NC1=C(C=C(C=C1)C2CC2)F Z2738366539 [0,1,0,1,0,0|1,0,0]=3 1959 B12R2.291 NC1=C(C=C(C=C1)C2CC2)N Z1203652960 [0,1,0,1,0,0|1,0,0]=3 1960 B12R2.291 NC1=C(C=CC(=C1)C2CC2)Cl Z1037551094 [0,1,0,1,0,0|1,0,0]=3 1961 B12R2.291 NC1=C(C=CC(=C1)C2CC2)F Z4777520691 [0,1,0,1,0,0|1,0,0]=3 1962 B12R2.291 OC1=C(C=C(C=C1)C2CC2)Cl Z1575344265 [0,1,0,1,0,0|0,0,0]=2 1963 B8R0.5 CCC/C(=C/C(=O)O)/C Z352746820 [0,0,1,0,1,0|1,0,1]=4 1964 B8R1.1 CCC1=CC(=CS1)Br Z1255374735 [1,0,0,0,1,0|2,0,0]=4 1965 B8R1.1 CCC1=CC(=NN1)O Z1198163105 [1,0,0,0,1,0|2,0,0]=4 1966 B8R1.1 CCN1C=C(C=N1)O Z1165304366 [1,0,0,0,1,0|2,0,0]=4 1967 B8R1.1 CCN1C=CC(=N1)O Z2941655720 [1,0,0,0,1,0|2,0,0]=4 1968 B8R1.8 CCCC1=CNN=C1 Z1263714332 [1,0,0,0,1,0|2,0,0]=4 1969 B8R1.8 CCCC1=NC=CN1 Z1201043633 [1,0,0,0,1,0|2,0,0]=4 1970 B8R1.8 CNCC1=CC=CN1 Z102767010 [1,0,0,0,1,0|2,0,0]=4 1971 B8R1.8 CNCC1=CC=CO1 Z57051072 [1,0,0,0,1,0|2,0,0]=4 1972 B8R1.8 CNCC1=CC=CS1 Z56948283 [1,0,0,0,1,0|2,0,0]=4 1973 B8R1.8 CNCC1=COC=C1 Z385447092 [1,0,0,0,1,0|2,0,0]=4 1974 B8R1.8 CNCC1=CSC=C1 Z57206125 [1,0,0,0,1,0|2,0,0]=4 1975 B8R1.8 NCCC1=CC=CN1 Z810507730 [1,0,0,0,1,0|2,0,0]=4 1976 B8R1.8 NCCC1=CC=CO1 Z1694636467 [1,0,0,0,1,0|2,0,0]=4 1977 B8R1.8 NCCC1=CC=CS1 Z90662945 [1,0,0,0,1,0|2,0,0]=4 1978 B8R1.8 NCCC1=COC=C1 Z2310701825 [1,0,0,0,1,0|2,0,0]=4 1979 B8R1.8 OCCC1=CC=CO1 Z1179944660 [1,0,0,0,1,0|2,0,0]=4 1980 B8R1.8 OCCC1=CC=CS1 Z397587354 [1,0,0,0,1,0|2,0,0]=4 1981 B8R1.8 OCCC1=COC=C1 Z1179944659 [1,0,0,0,1,0|2,0,0]=4 1982 B8R1.8 OCCC1=CSC=C1 Z397587098 [1,0,0,0,1,0|2,0,0]=4