0 B11R1.83 CCCc1ccc(cc1)NN AB23596 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.83 CNCc1ccc(cn1)OC AB67556 [0,0,0,0,0,0|2,0,1]=3 2 B11R1.83 CNCc1ccc(nc1)OC AB67058 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.83 COc1ccc(cc1)CC#C AB61379 [0,0,0,0,0,0|0,0,3]=3 4 B11R1.83 COc1ccc(cc1)CC=O AB11810 [0,0,0,0,0,0|1,0,1]=2 5 B11R1.83 COc1ccc(cc1)CCO AB00284 [0,0,0,0,0,0|1,0,2]=3 6 B11R1.83 COc1ccc(cc1)CNN PB19937 [0,0,0,0,0,0|2,0,1]=3 7 B11R1.83 COc1ccc(cc1)\C=C\Br AB06149 [0,0,0,0,0,0|1,0,0]=1 8 B11R1.83 COc1ccc(cn1)CC#C AB69167 [0,0,0,0,0,0|1,0,3]=4 9 B11R1.83 COc1ccc(cn1)CCBr AB72327 [0,0,0,0,0,0|2,0,2]=4 10 B11R1.83 COc1ccc(cn1)CCN AB45430 [0,0,0,0,0,0|2,0,2]=4 11 B11R1.83 COc1ccc(cn1)N=C=O AB74207 [0,0,0,0,0,0|3,0,1]=4 12 B11R1.83 COc1ccc(nc1)CC#C AB73241 [0,0,0,0,0,0|1,0,3]=4 13 B11R1.83 COc1ccc(nc1)CC#N AB65289 [0,0,0,0,0,0|2,0,2]=4 14 B11R1.83 COc1ccc(nc1)CCBr AB73197 [0,0,0,0,0,0|2,0,2]=4 15 B11R1.83 COc1ccc(nc1)CCN AB65488 [0,0,0,0,0,0|2,0,2]=4 16 B10R1.1 Cc1ccc(cc1)CC=O AB02059 [1,0,0,0,0,0|1,0,1]=3 17 B10R1.1 Cc1ccc(cc1)\C=C\Br AB73509 [1,0,0,0,0,0|1,0,0]=2 18 B10R1.1 Cc1ccc(cn1)CNC AB63786 [1,0,0,0,0,0|2,0,1]=4 19 B10R1.1 Cc1ccc(nc1)CNC AB67504 [1,0,0,0,0,0|2,0,1]=4 20 B10R1.1 Cc1ccc(nc1)\C=N\O AB72002 [1,0,0,0,0,0|3,0,0]=4 21 B10R1.1 c1cc(ccc1CC=O)Br AB11790 [1,0,0,0,0,0|2,0,1]=4 22 B10R1.1 c1cc(ccc1CC=O)Cl AB11793 [1,0,0,0,0,0|2,0,1]=4 23 B10R1.1 c1cc(ccc1CC=O)F AB11805 [1,0,0,0,0,0|2,0,1]=4 24 B10R1.1 c1cc(ccc1CC=O)N AB27688 [1,0,0,0,0,0|2,0,1]=4 25 B10R1.1 c1cc(ccc1\C=C\Br)Br AB32162 [1,0,0,0,0,0|2,0,0]=3 26 B10R1.1 c1cc(ccc1\C=C\Br)Cl AB32165 [1,0,0,0,0,0|2,0,0]=3 27 B10R1.1 c1cc(ccc1\C=C\Br)F AB66443 [1,0,0,0,0,0|2,0,0]=3 28 B10R1.1 c1cc(ccc1\C=N\O)Br AB06151 [1,0,0,0,0,0|3,0,0]=4 29 B10R1.3 C#Cc1ccc(cc1)C=O AB22364 [1,0,0,0,0,0|2,0,1]=4 30 B10R1.3 CCc1ccc(cc1)NN AB10141 [1,0,0,0,0,0|2,0,1]=4 31 B10R1.3 CNc1ccc(nc1)OC AB60608 [1,0,0,0,0,0|2,0,0]=3 32 B10R1.3 COc1ccc(cc1)C#N AB00162 [1,0,0,0,0,0|1,0,1]=3 33 B10R1.3 COc1ccc(cc1)NN AB11940 [1,0,0,0,0,0|2,0,0]=3 34 B10R1.3 COc1ccc(cn1)C#C PB23831 [1,0,0,0,0,0|1,0,2]=4 35 B10R1.3 COc1ccc(cn1)C#N AB03173 [1,0,0,0,0,0|2,0,1]=4 36 B10R1.3 COc1ccc(cn1)CCl AB59942 [1,0,0,0,0,0|2,0,1]=4 37 B10R1.3 COc1ccc(cn1)CCl AB59945 [1,0,0,0,0,0|2,0,1]=4 38 B10R1.3 COc1ccc(cn1)CN PB34107 [1,0,0,0,0,0|2,0,1]=4 39 B10R1.3 COc1ccc(cn1)CO PB17339 [1,0,0,0,0,0|2,0,1]=4 40 B10R1.3 COc1ccc(cn1)NN AB50207 [1,0,0,0,0,0|3,0,0]=4 41 B10R1.3 COc1ccc(nc1)C#C AB68974 [1,0,0,0,0,0|1,0,2]=4 42 B10R1.3 COc1ccc(nc1)C#N PB32629 [1,0,0,0,0,0|2,0,1]=4 43 B10R1.3 COc1ccc(nc1)C=O PB17495 [1,0,0,0,0,0|2,0,0]=3 44 B10R1.3 COc1ccc(nc1)CCl AB59864 [1,0,0,0,0,0|2,0,1]=4 45 B10R1.3 COc1ccc(nc1)CCl PB31547 [1,0,0,0,0,0|2,0,1]=4 46 B10R1.3 COc1ccc(nc1)CN AB59858 [1,0,0,0,0,0|2,0,1]=4 47 B10R1.3 COc1ccc(nc1)CO PB32580 [1,0,0,0,0,0|2,0,1]=4 48 B10R1.3 COc1ccc(nn1)C=O AB61123 [1,0,0,0,0,0|3,0,0]=4 49 B10R1.3 COc1cnc(cn1)C=O AB60467 [1,0,0,0,0,0|3,0,0]=4 50 B10R1.3 COc1cnc(nc1)C=O AB59742 [1,0,0,0,0,0|3,0,0]=4 51 B10R1.3 COc1ncc(cn1)C=O AB15446 [1,0,0,0,0,0|3,0,0]=4 52 B10R1.3 CSc1ccc(cc1)CCl AB05549 [1,0,0,0,0,0|1,1,1]=4 53 B10R1.3 CSc1ccc(cc1)CO AB00982 [1,0,0,0,0,0|1,1,1]=4 54 B12R1.4 CC(=O)Cc1ccc(cc1)OC AB00957 [0,1,0,0,0,0|0,0,1]=2 55 B12R1.4 CC(Cc1ccc(cc1)OC)N MB01555 [0,1,0,0,0,0|0,0,2]=3 56 B12R1.4 COc1ccc(cc1)CC(=N)N AB09931 [0,1,0,0,0,0|1,0,1]=3 57 B12R1.4 COc1ccc(cn1)CC(=O)O AB55204 [0,1,0,0,0,0|2,0,1]=4 58 B12R1.4 C[C@@H](Cc1ccc(cc1)OC)N AB70588 [0,1,0,0,0,0|0,0,2]=3 59 B12R1.4 C[C@H](Cc1ccc(cc1)OC)N AB51426 [0,1,0,0,0,0|0,0,2]=3 60 B12R1.5 CCc1ccc(cc1)C(=O)C=O AB48659 [0,1,0,0,0,0|2,0,0]=3 61 B12R1.5 COC(=N)c1ccc(cc1)C=O AB60994 [0,1,0,0,0,0|3,0,0]=4 62 B12R1.5 COC(=O)c1ccc(cc1)C#C AB04259 [0,1,0,0,0,0|2,0,1]=4 63 B12R1.5 COc1ccc(cc1)C(=N)OC AB04684 [0,1,0,0,0,0|1,0,0]=2 64 B12R1.5 COc1ccc(cc1)C(=O)C#N MB03942 [0,1,0,0,0,0|1,0,1]=3 65 B12R1.5 COc1ccc(cc1)C(=O)C=O AB05250 [0,1,0,0,0,0|1,0,0]=2 66 B12R1.5 COc1ccc(cc1)C(=O)C=O AB05286 [0,1,0,0,0,0|1,0,0]=2 67 B12R1.5 COc1ccc(cn1)C(=O)OC PB33918 [0,1,0,0,0,0|2,0,0]=3 68 B12R1.5 COc1ccc(nc1)C(=O)OC PB10973 [0,1,0,0,0,0|2,0,0]=3 69 B12R1.5 CSc1ccc(cc1)C(=O)C=O AB48690 [0,1,0,0,0,0|1,1,0]=3 70 B12R1.5 C[C@H](CN)c1ccc(cc1)OC AB85099 [0,1,0,0,0,0|1,0,2]=4 71 B12R1.5 c1cc(ccc1C#N)C(=O)C=O AB14104 [0,1,0,0,0,0|3,0,0]=4 72 B12R1.5 c1cc(ccc1C#N)C(=O)C=O AB44430 [0,1,0,0,0,0|3,0,0]=4 73 B12R1.5 c1cc(ccc1CN)C(=O)C=O AB23361 [0,1,0,0,0,0|3,0,0]=4 74 B12R1.71 CCc1ccc(cc1)CCCN AB38698 [0,1,0,0,0,0|1,0,2]=4 75 B12R1.71 CNCCc1ccc(cc1)OC AB07595 [0,1,0,0,0,0|0,0,2]=3 76 B12R1.71 CNCCc1ccc(cn1)OC AB73196 [0,1,0,0,0,0|1,0,2]=4 77 B12R1.71 COc1ccc(cc1)CCC=O AB06888 [0,1,0,0,0,0|1,0,1]=3 78 B12R1.71 COc1ccc(cc1)CCCN AB07604 [0,1,0,0,0,0|0,0,2]=3 79 B12R1.71 COc1ccc(cc1)CCCO AB00287 [0,1,0,0,0,0|0,0,2]=3 80 B12R1.71 COc1ccc(cn1)CCCN AB55109 [0,1,0,0,0,0|1,0,2]=4 81 B12R1.113 CN(C)c1ccc(cc1)CC=O AB48491 [0,1,0,0,0,0|2,0,1]=4 82 B12R1.113 c1cc(ccc1\C=C\Br)[N+](=O)[O-] AB04153 [0,1,0,0,0,0|3,0,0]=4 83 B12R1.288 CNCc1ccc(c(c1)Cl)OC AB55520 [0,1,0,0,0,0|1,0,1]=3 84 B12R2.44 COC1=CC2C=CN=C2C=C1 AB00488 [0,0,0,1,0,0|1,0,2]=4 85 B12R2.44 COC1=CN=C2C=CN=C2C1 PB19328 [0,0,0,1,0,0|2,0,1]=4 86 B12R2.44 COC1=NC=C2C=CN=C2C1 PB31322 [0,0,0,1,0,0|2,0,1]=4 87 B12R2.44 COc1cc2c(nc1)CNC2 AB74658 [0,0,0,1,0,0|2,0,1]=4 88 B12R2.44 COc1cc2c(nc1)NCC2 AB26242 [0,0,0,1,0,0|2,0,1]=4 89 B12R2.44 COc1ccc2c(c1)CNC2 AB30381 [0,0,0,1,0,0|1,0,1]=3 90 B12R2.44 COc1ccc2c(c1)N=CC2 AB01327 [0,0,0,1,0,0|1,0,1]=3 91 B12R2.44 COc1ccc2c(c1)N=NC2 PB23628 [0,0,0,1,0,0|2,0,1]=4 92 B12R2.44 COc1ccc2c(c1)NCC2 AB32628 [0,0,0,1,0,0|1,0,2]=4 93 B12R2.44 COc1ccc2c(c1)scn2 AB10586 [0,0,0,1,0,0|2,0,0]=3 94 B12R2.44 COc1ccc2c(n1)CCN2 AB73735 [0,0,0,1,0,0|2,0,1]=4 95 B12R2.44 COc1ccc2c(n1)CNC2 AB74755 [0,0,0,1,0,0|2,0,1]=4 96 B12R2.44 COc1ccc2c(n1)N=CC2 PB18740 [0,0,0,1,0,0|2,0,1]=4 97 B12R2.44 c1cc(cc2c1cco2)C#N MB09726 [0,0,0,1,0,0|3,0,0]=4 98 B12R2.44 c1cc(cc2c1cco2)C=O MB06876 [0,0,0,1,0,0|3,0,0]=4 99 B9R1.1 CCc1ccc(cn1)O MB03842 [2,0,0,0,0,0|1,0,1]=4 100 B9R1.1 CNc1ccc(cn1)O AB69733 [2,0,0,0,0,0|2,0,0]=4 101 B9R1.1 COc1cc[n+](cc1)[O-] AB00619 [2,0,0,0,0,0|2,0,0]=4 102 B9R1.1 COc1ccc(cn1)Br AB08771 [2,0,0,0,0,0|2,0,0]=4 103 B9R1.1 COc1ccc(cn1)Cl AB23682 [2,0,0,0,0,0|2,0,0]=4 104 B9R1.1 COc1ccc(cn1)F AB13611 [2,0,0,0,0,0|2,0,0]=4 105 B9R1.1 COc1ccc(cn1)N PB27370 [2,0,0,0,0,0|2,0,0]=4 106 B9R1.1 COc1ccc(cn1)O CB10969 [2,0,0,0,0,0|2,0,0]=4 107 B9R1.1 COc1ccc(nc1)Br PB22062 [2,0,0,0,0,0|2,0,0]=4 108 B9R1.1 COc1ccc(nc1)Cl AB25956 [2,0,0,0,0,0|2,0,0]=4 109 B9R1.1 COc1ccc(nc1)F AB66773 [2,0,0,0,0,0|2,0,0]=4 110 B9R1.1 COc1ccc(nc1)I AB11726 [2,0,0,0,0,0|2,0,0]=4 111 B9R1.1 COc1ccc(nc1)N PB14487 [2,0,0,0,0,0|2,0,0]=4 112 B9R1.1 CSc1ccc(cn1)O MB25590 [2,0,0,0,0,0|2,0,0]=4 113 B9R1.1 Cc1ccc(cn1)C=C PB17233 [2,0,0,0,0,0|1,0,0]=3 114 B9R1.1 Cc1ccc(cn1)C=O PB17503 [2,0,0,0,0,0|2,0,0]=4 115 B9R1.1 Cc1ccc(cn1)OC AB52739 [2,0,0,0,0,0|1,0,0]=3 116 B9R1.1 Cc1ccc(nc1)C=O AB31466 [2,0,0,0,0,0|2,0,0]=4 117 B9R1.1 Cc1ccc(nn1)OC AB51434 [2,0,0,0,0,0|2,0,0]=4 118 B9R1.1 c1cc(ccc1CI)O MB06957 [2,0,0,0,0,0|1,0,1]=4 119 B9R1.1 c1cc(ccc1CN)O AB11678 [2,0,0,0,0,0|1,0,1]=4 120 B9R1.1 c1cc(ncc1O)C=O AB59867 [2,0,0,0,0,0|2,0,0]=4 121 B9R1.8 c1ccc(cc1)\C=C\Br AB00116 [2,0,0,0,0,0|1,0,0]=3 122 B9R1.8 c1ccc(cc1)\C=N/O AB02488 [2,0,0,0,0,0|2,0,0]=4 123 B11R1.1 Cc1ccc(cc1)CCC=O AB17667 [1,1,0,0,0,0|1,0,1]=4 124 B11R1.1 Cc1ccc(cc1)CCCN AB38682 [1,1,0,0,0,0|0,0,2]=4 125 B11R1.1 Cc1ccc(cc1)CCNC AB27715 [1,1,0,0,0,0|0,0,2]=4 126 B11R1.1 c1cc(ccc1CCC=O)O AB49241 [1,1,0,0,0,0|1,0,1]=4 127 B11R1.1 c1cc(ccc1CCCN)O AB07598 [1,1,0,0,0,0|0,0,2]=4 128 B11R1.20 CC(=O)Oc1ccc(cc1)Cl AB06566 [1,1,0,0,0,0|2,0,0]=4 129 B11R1.20 CC(C)Oc1ccc(cc1)O MB06553 [1,1,0,0,0,0|1,0,1]=4 130 B11R1.20 Cc1ccc(cc1)CC(=N)N AB29086 [1,1,0,0,0,0|1,0,1]=4 131 B11R1.20 Cc1ccc(cc1)CC(C)N MB01961 [1,1,0,0,0,0|0,0,2]=4 132 B11R1.22 CNC(=O)c1ccc(cc1)O MB02709 [1,1,0,0,0,0|1,0,0]=3 133 B11R1.22 CNC(=O)c1ccc(cn1)O MB11446 [1,1,0,0,0,0|2,0,0]=4 134 B11R1.22 COC(=N)c1ccc(cc1)F AB60956 [1,1,0,0,0,0|2,0,0]=4 135 B11R1.22 COC(=N)c1ccc(cc1)N AB60980 [1,1,0,0,0,0|2,0,0]=4 136 B11R1.22 COC(=N)c1ccc(cc1)O AB01949 [1,1,0,0,0,0|1,0,0]=3 137 B11R1.22 COC(=O)c1ccc(cn1)O PB27686 [1,1,0,0,0,0|2,0,0]=4 138 B11R1.22 COC(=O)c1ccc(nc1)O PB34296 [1,1,0,0,0,0|2,0,0]=4 139 B11R1.22 Cc1ccc(cc1)C(=O)C=O AB05249 [1,1,0,0,0,0|1,0,0]=3 140 B11R1.22 Cc1ccc(cc1)C(=O)C=O AB05288 [1,1,0,0,0,0|1,0,0]=3 141 B11R1.22 c1cc(ccc1C(=O)C=O)Br AB07939 [1,1,0,0,0,0|2,0,0]=4 142 B11R1.22 c1cc(ccc1C(=O)C=O)Br AB49987 [1,1,0,0,0,0|2,0,0]=4 143 B11R1.22 c1cc(ccc1C(=O)C=O)Cl AB44429 [1,1,0,0,0,0|2,0,0]=4 144 B11R1.22 c1cc(ccc1C(=O)C=O)F AB09010 [1,1,0,0,0,0|2,0,0]=4 145 B11R1.22 c1cc(ccc1C(=O)C=O)O AB02263 [1,1,0,0,0,0|1,0,0]=3 146 B11R1.3 B(c1ccc(cc1)C=C)(O)O AB05462 [1,1,0,0,0,0|2,0,0]=4 147 B11R1.3 B(c1ccc(cc1)OC)(O)O AB01770 [1,1,0,0,0,0|2,0,0]=4 148 B11R1.3 CC(=O)c1ccc(cc1)C#C AB21444 [1,1,0,0,0,0|1,0,1]=4 149 B11R1.3 CC(=O)c1ccc(cn1)OC PB14835 [1,1,0,0,0,0|1,0,0]=3 150 B11R1.3 CC(=O)c1ccc(nc1)OC AB22367 [1,1,0,0,0,0|1,0,0]=3 151 B11R1.3 CC(=O)c1ccc(nn1)OC AB70140 [1,1,0,0,0,0|2,0,0]=4 152 B11R1.3 CC(=O)c1cnc(cn1)OC AB69890 [1,1,0,0,0,0|2,0,0]=4 153 B11R1.3 CC(c1ccc(nc1)OC)N AB67099 [1,1,0,0,0,0|1,0,1]=4 154 B11R1.3 CCc1ccc(cc1)C(=S)N AB23762 [1,1,0,0,0,0|2,0,0]=4 155 B11R1.3 COc1ccc(cc1)C(=N)N AB06258 [1,1,0,0,0,0|1,0,0]=3 156 B11R1.3 COc1ccc(cc1)C(=O)N AB00908 [1,1,0,0,0,0|1,0,0]=3 157 B11R1.3 COc1ccc(cc1)C(=S)N AB01847 [1,1,0,0,0,0|1,0,0]=3 158 B11R1.3 COc1ccc(cn1)C(=N)N MB05831 [1,1,0,0,0,0|2,0,0]=4 159 B11R1.3 COc1ccc(cn1)C(=O)O PB30805 [1,1,0,0,0,0|2,0,0]=4 160 B11R1.3 COc1ccc(nc1)C(=O)O PB17398 [1,1,0,0,0,0|2,0,0]=4 161 B11R1.279 CCc1ccc(c(c1)O)C=O MB23811 [1,1,0,0,0,0|2,0,0]=4 162 B11R1.279 CCc1ccc(c(c1)O)CC MB23814 [1,1,0,0,0,0|1,0,1]=4 163 B11R1.279 CCc1ccc(c(c1)O)NC MB23854 [1,1,0,0,0,0|1,0,1]=4 164 B11R1.279 CCc1ccc(c(c1)O)OC MB23985 [1,1,0,0,0,0|0,0,1]=3 165 B11R1.279 CCc1ccc(c(c1)O)SC MB23987 [1,1,0,0,0,0|0,1,1]=4 166 B11R1.279 CCc1ccc(cc1O)C=O MB23812 [1,1,0,0,0,0|2,0,0]=4 167 B11R1.279 CCc1ccc(cc1O)NC MB23855 [1,1,0,0,0,0|1,0,1]=4 168 B11R1.279 CCc1ccc(cc1O)OC MB04144 [1,1,0,0,0,0|0,0,1]=3 169 B11R1.279 CCc1ccc(cc1O)SC MB23989 [1,1,0,0,0,0|0,1,1]=4 170 B11R1.279 CNc1ccc(c(c1)O)C=O MB38816 [1,1,0,0,0,0|2,0,0]=4 171 B11R1.279 CNc1ccc(c(c1)O)NC MB27488 [1,1,0,0,0,0|2,0,0]=4 172 B11R1.279 CNc1ccc(c(c1)O)SC MB31040 [1,1,0,0,0,0|1,1,0]=4 173 B11R1.279 CNc1ccc(cc1O)C=O MB01978 [1,1,0,0,0,0|2,0,0]=4 174 B11R1.279 CNc1ccc(cc1O)OC MB36336 [1,1,0,0,0,0|1,0,0]=3 175 B11R1.279 COc1c(cc(cn1)C=O)Br AB70947 [1,1,0,0,0,0|2,0,0]=4 176 B11R1.279 COc1c(cc(cn1)C=O)Cl AB20954 [1,1,0,0,0,0|2,0,0]=4 177 B11R1.279 COc1c(cc(cn1)C=O)F AB17649 [1,1,0,0,0,0|2,0,0]=4 178 B11R1.279 COc1cc(c(cn1)C=O)Br AB67009 [1,1,0,0,0,0|2,0,0]=4 179 B11R1.279 COc1cc(c(cn1)C=O)Cl AB66998 [1,1,0,0,0,0|2,0,0]=4 180 B11R1.279 COc1cc(c(cn1)C=O)N AB83675 [1,1,0,0,0,0|2,0,0]=4 181 B11R1.279 COc1cc(c(cn1)C=O)O AB74871 [1,1,0,0,0,0|2,0,0]=4 182 B11R1.279 COc1cc(c(nc1)C=O)N AB83737 [1,1,0,0,0,0|2,0,0]=4 183 B11R1.279 COc1cc(c(nc1)C=O)O AB84580 [1,1,0,0,0,0|2,0,0]=4 184 B11R1.279 COc1ccc(c(c1)Br)C#N MB06936 [1,1,0,0,0,0|1,0,1]=4 185 B11R1.279 COc1ccc(c(c1)F)CBr AB50043 [1,1,0,0,0,0|1,0,1]=4 186 B11R1.279 COc1ccc(c(c1)F)CN AB20685 [1,1,0,0,0,0|1,0,1]=4 187 B11R1.279 COc1ccc(c(c1)F)CO AB20682 [1,1,0,0,0,0|1,0,1]=4 188 B11R1.279 COc1ccc(c(c1)N)C#N AB21542 [1,1,0,0,0,0|1,0,1]=4 189 B11R1.279 COc1ccc(c(c1)N)C=O AB54699 [1,1,0,0,0,0|1,0,0]=3 190 B11R1.279 COc1ccc(c(c1)O)C#N AB45806 [1,1,0,0,0,0|1,0,1]=4 191 B11R1.279 COc1ccc(c(c1)O)CN MB05065 [1,1,0,0,0,0|1,0,1]=4 192 B11R1.279 COc1ccc(c(c1)O)OC MB00643 [1,1,0,0,0,0|1,0,0]=3 193 B11R1.279 COc1ccc(c(c1)O)SC MB25870 [1,1,0,0,0,0|1,0,0]=3 194 B11R1.279 COc1ccc(c(n1)Br)C=O AB68201 [1,1,0,0,0,0|2,0,0]=4 195 B11R1.279 COc1ccc(c(n1)Cl)C=O AB59889 [1,1,0,0,0,0|2,0,0]=4 196 B11R1.279 COc1ccc(c(n1)F)C=O AB71338 [1,1,0,0,0,0|2,0,0]=4 197 B11R1.279 COc1ccc(c(n1)N)C=O AB76143 [1,1,0,0,0,0|2,0,0]=4 198 B11R1.279 COc1ccc(c(n1)O)C=O AB84537 [1,1,0,0,0,0|2,0,0]=4 199 B11R1.279 COc1ccc(cc1Br)C#N AB03835 [1,1,0,0,0,0|1,0,1]=4 200 B11R1.279 COc1ccc(cc1Cl)CN CB10485 [1,1,0,0,0,0|1,0,1]=4 201 B11R1.279 COc1ccc(cc1F)C#N AB04880 [1,1,0,0,0,0|1,0,1]=4 202 B11R1.279 COc1ccc(cc1O)C#N MB02393 [1,1,0,0,0,0|1,0,1]=4 203 B11R1.279 COc1ccc(cc1O)SC MB37214 [1,1,0,0,0,0|1,0,0]=3 204 B11R1.279 COc1cnc(cc1Cl)C=O AB67540 [1,1,0,0,0,0|2,0,0]=4 205 B11R1.279 CSc1ccc(c(c1)O)C=O MB32919 [1,1,0,0,0,0|1,1,0]=4 206 B11R1.279 CSc1ccc(cc1O)C=O MB32965 [1,1,0,0,0,0|1,1,0]=4 207 B11R1.279 Cc1cc(cnc1OC)C=O AB64858 [1,1,0,0,0,0|2,0,0]=4 208 B13R1.4 CC(C)(Cc1ccc(cc1)OC)N AB54584 [0,2,0,0,0,0|0,0,2]=4 209 B13R1.5 CC(CN)Oc1ccc(cc1)OC AB12551 [0,2,0,0,0,0|1,0,1]=4 210 B13R1.5 COc1ccc(cc1)CC(=N)OC AB60937 [0,2,0,0,0,0|0,0,1]=3 211 B13R1.35 CC(C)Oc1ccc(c(c1)O)OC MB37143 [0,2,0,0,0,0|1,0,1]=4 212 B13R1.35 COc1ccc(cc1O)NC(=S)N AB53235 [0,2,0,0,0,0|2,0,0]=4 213 B13R1.36 COc1ccc(cc1)C(C(=O)O)N PB10070 [0,2,0,0,0,0|1,0,1]=4 214 B13R1.36 COc1ccc(cc1)[C@@H](C(=O)O)N AB32877 [0,2,0,0,0,0|1,0,1]=4 215 B13R1.36 COc1ccc(cc1)[C@H](C(=O)O)N AB32874 [0,2,0,0,0,0|1,0,1]=4 216 B13R1.653 CC(=O)Nc1ccc(cc1Br)OC AB63495 [0,2,0,0,0,0|1,0,0]=3 217 B13R1.653 COc1ccc(c(c1)N)CC(=O)O AB26287 [0,2,0,0,0,0|1,0,1]=4 218 B13R1.95 CCc1ccc(c(c1)O)C(=O)NC MB23786 [0,2,0,0,0,0|2,0,0]=4 219 B13R1.95 CNC(=O)c1ccc(cc1O)OC MB09393 [0,2,0,0,0,0|1,0,0]=3 220 B13R1.95 CNC(=O)c1ccc(cc1O)SC MB28267 [0,2,0,0,0,0|1,1,0]=4 221 B13R1.95 COc1ccc(c(c1)F)C(=O)C=O AB49791 [0,2,0,0,0,0|1,0,0]=3 222 B13R1.95 COc1ccc(c(n1)Cl)C(=O)OC AB44747 [0,2,0,0,0,0|2,0,0]=4 223 B13R1.139 CCOc1ccc(cc1)C(=O)C=O AB45359 [0,2,0,0,0,0|1,0,0]=3 224 B13R1.139 CCOc1ccc(cc1)C(=O)C=O AB48696 [0,2,0,0,0,0|1,0,0]=3 225 B13R1.139 COC(=O)c1ccc(cc1)CCBr CB11804 [0,2,0,0,0,0|2,0,0]=4 226 B13R1.452 COc1ccc(cc1)C(CCO)N AB10350 [0,2,0,0,0,0|0,0,2]=4 227 B13R1.537 CN(C)c1ccc(cc1)C(=O)C=O AB05269 [0,2,0,0,0,0|2,0,0]=4 228 B13R1.3088 CCc1ccc(cc1O)C(=O)NC MB23816 [0,2,0,0,0,0|2,0,0]=4 229 B13R1.3088 CNC(=O)c1ccc(c(c1)O)OC MB28716 [0,2,0,0,0,0|1,0,0]=3 230 B13R1.3088 CNc1ccc(cc1O)C(=O)NC MB29739 [0,2,0,0,0,0|2,0,0]=4 231 B13R1.3088 COc1c(cc(cn1)C(=O)OC)N AB76549 [0,2,0,0,0,0|2,0,0]=4 232 B13R1.3 B(\C=C\c1ccc(cc1)OC)(O)O AB17446 [0,2,0,0,0,0|1,0,0]=3 233 B13R1.3 CC(=O)COc1ccc(cc1)OC AB16833 [0,2,0,0,0,0|0,0,1]=3 234 B13R1.3 COc1ccc(cc1)CCC(=O)O AB00265 [0,2,0,0,0,0|1,0,1]=4 235 B13R1.371 CNCCCc1ccc(cc1)OC AB38807 [0,2,0,0,0,0|0,0,2]=4 236 B13R1.371 COc1ccc(cc1)CCCCN AB07612 [0,2,0,0,0,0|0,0,2]=4 237 B11R1.267 CCc1cccc(c1O)OC MB24092 [0,0,1,1,0,0|1,0,1]=4 238 B11R1.267 CNc1cccc(c1O)OC MB37936 [0,0,1,1,0,0|2,0,0]=4 239 B11R1.267 COc1cccc(c1F)C=O AB14344 [0,0,1,1,0,0|2,0,0]=4 240 B11R1.267 COc1cccc(c1N)C=O AB55845 [0,0,1,1,0,0|2,0,0]=4 241 B11R1.280 CCc1cc(ccc1O)OC MB23776 [0,0,1,1,0,0|1,0,1]=4 242 B11R1.280 CNc1cc(ccc1O)OC MB34517 [0,0,1,1,0,0|2,0,0]=4 243 B11R1.280 COc1ccc(c(c1)C=O)N AB58425 [0,0,1,1,0,0|2,0,0]=4 244 B11R1.280 COc1ccc(c(c1)OC)O MB00503 [0,0,1,1,0,0|2,0,0]=4 245 B11R1.280 COc1ccc(c(c1)SC)O MB25475 [0,0,1,1,0,0|2,0,0]=4 246 B11R2.36 C1C=C2C=CN=C2C=C1O AB04037 [1,0,0,1,0,0|1,0,1]=4 247 B11R2.36 Cc1ccc2c(c1)CNC2 AB49687 [1,0,0,1,0,0|1,0,1]=4 248 B11R2.36 Cc1ccc2c(c1)N=CC2 PB25888 [1,0,0,1,0,0|1,0,1]=4 249 B11R2.36 Cc1ccc2c(c1)cco2 MB00739 [1,0,0,1,0,0|1,0,1]=4 250 B11R2.36 Cc1ccc2c(c1)scn2 AB09070 [1,0,0,1,0,0|2,0,0]=4 251 B11R2.36 c1cc(cc2c1cco2)Br PB12534 [1,0,0,1,0,0|2,0,0]=4 252 B11R2.36 c1cc(cc2c1cco2)N MB09331 [1,0,0,1,0,0|2,0,0]=4 253 B11R2.36 c1cc(cc2c1cco2)O MB06436 [1,0,0,1,0,0|1,0,0]=3 254 B11R2.36 c1cc(cc2c1ccs2)Br MB09702 [1,0,0,1,0,0|2,0,0]=4 255 B11R2.36 c1cc2c(cco2)cc1O MB08821 [1,0,0,1,0,0|1,0,1]=4 256 B13R2.16 COc1ccc(cc1)[C@@H]2C[C@H]2N MB69384 [0,1,0,1,0,0|0,0,2]=4 257 B13R2.184 COc1ccc(cc1)OC2CC2 MB35609 [0,1,0,1,0,0|0,0,2]=4 258 B13R2.2121 CC1=NC2=C(=N1)C=CC(=C2)OC AB07058 [0,1,0,1,0,0|1,0,1]=4 259 B13R2.2121 COc1cc2c(cn1)NC(=O)C2 AB62587 [0,1,0,1,0,0|2,0,0]=4 260 B13R2.2121 COc1cc2c(nc1)NC(=O)C2 AB66479 [0,1,0,1,0,0|2,0,0]=4 261 B13R2.2121 COc1ccc2c(c1)CC(=O)N2 AB10027 [0,1,0,1,0,0|1,0,0]=3 262 B13R2.2121 COc1ccc2c(c1)CC(C2)N AB43715 [0,1,0,1,0,0|0,0,2]=4 263 B13R2.2121 COc1ccc2c(c1)NC(=O)C2 AB05458 [0,1,0,1,0,0|1,0,1]=4 264 B13R2.2121 COc1ccc2c(c1)nc(o2)Cl AB63673 [0,1,0,1,0,0|2,0,0]=4 265 B13R2.2121 COc1ccc2c(c1)oc(n2)Cl AB73086 [0,1,0,1,0,0|2,0,0]=4 266 B13R2.2121 COc1ccc2c(c1)sc(n2)Cl AB06750 [0,1,0,1,0,0|2,0,0]=4 267 B13R2.2121 COc1ccc2c(n1)CC(=O)N2 AB11411 [0,1,0,1,0,0|2,0,0]=4 268 B13R2.186 COc1ccc(cc1)C2(CC2)N AB32582 [0,1,0,1,0,0|0,0,2]=4 269 B13R2.2130 COc1cc2c(cn1)C(=O)NC2 AB77330 [0,1,0,1,0,0|2,0,0]=4 270 B13R2.2130 COc1ccc2c(c1)CC[C@H]2N AB29114 [0,1,0,1,0,0|0,0,2]=4 271 B13R2.2130 COc1ccc2c(c1)CNC2=O AB45189 [0,1,0,1,0,0|1,0,0]=3 272 B13R2.2130 COc1ccc2c(c1)OCC2=O AB11637 [0,1,0,1,0,0|1,0,1]=4 273 B13R2.2130 COc1ccc2c(c1)onc2Cl AB72260 [0,1,0,1,0,0|2,0,0]=4 274 B13R2.2130 COc1ccc2c(n1)CCC2=O AB70088 [0,1,0,1,0,0|1,0,1]=4 275 B13R2.2130 COc1ccn2c(c1)ncc2Br AB61193 [0,1,0,1,0,0|2,0,0]=4 276 B13R2.57 COc1ccc2c(c1)CCNC2 AB09837 [0,1,0,1,0,0|0,0,2]=4 277 B13R2.57 COc1ccc2c(c1)CNCC2 AB09126 [0,1,0,1,0,0|0,0,2]=4 278 B13R2.57 COc1ccc2c(c1)NCCC2 MB06336 [0,1,0,1,0,0|0,0,2]=4 279 B13R2.57 COc1ccc2c(c1)NCCO2 AB43971 [0,1,0,1,0,0|1,0,1]=4 280 B13R2.57 COc1ccc2c(c1)OCCN2 MB09263 [0,1,0,1,0,0|1,0,1]=4 281 B13R2.57 COc1ccc2c(c1)OCCN2 MB11317 [0,1,0,1,0,0|1,0,1]=4 282 B13R2.57 COc1ccc2cnccc2c1 AB19119 [0,1,0,1,0,0|0,0,1]=3 283 B13R2.669 CC1=NN=C2=C1C=C(C=C2)OC MB19208 [0,1,0,1,0,0|1,0,1]=4 284 B13R2.669 COc1ccc2c(c1)C(=O)CO2 AB45799 [0,1,0,1,0,0|1,0,1]=4 285 B13R2.669 COc1ccc2c(c1)C(=O)N=N2 AB60845 [0,1,0,1,0,0|2,0,0]=4 286 B13R2.669 COc1ccc2c(c1)C(=O)OC2 MB00644 [0,1,0,1,0,0|1,0,1]=4 287 B13R2.669 COc1ccc2c(c1)C(CC2)N AB21023 [0,1,0,1,0,0|0,0,2]=4 288 B13R2.669 COc1ccc2c(c1)C(CC2)N AB30593 [0,1,0,1,0,0|0,0,2]=4 289 B13R2.669 COc1ccc2c(c1)C(CO2)N AB49134 [0,1,0,1,0,0|1,0,1]=4 290 B13R2.669 COc1ccc2c(c1)[C@@H](CC2)N PB26238 [0,1,0,1,0,0|0,0,2]=4 291 B13R2.669 COc1ccc2c(c1)[C@H](CC2)N PB18777 [0,1,0,1,0,0|0,0,2]=4 292 B13R2.669 COc1ccc2c(c1)c(no2)Cl AB72257 [0,1,0,1,0,0|2,0,0]=4 293 B13R2.654 COC1=CC(=C2C=CN=C2C1)Br AB13576 [0,1,0,1,0,0|1,0,1]=4 294 B13R2.654 COc1cc2ccoc2c(c1)Br MB07007 [0,1,0,1,0,0|1,0,1]=4 295 B13R2.654 COc1cc2ccoc2c(c1)Cl MB10423 [0,1,0,1,0,0|1,0,1]=4 296 B13R2.449 c1cc2c(cc1\C=C\Br)OCO2 AB49370 [0,1,0,1,0,0|1,0,0]=3 297 B13R2.84 COc1ccc2ccoc2c1Br MB06986 [0,1,0,1,0,0|1,0,0]=3