0 B10R1.13 B(c1ccc(cc1)Br)(O)O AB00202 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.13 B(c1ccc(cc1)C)(O)O AB01767 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.13 B(c1ccc(cc1)Cl)(O)O AB01763 [0,0,0,0,0,0|2,0,1]=3 3 B10R1.13 B(c1ccc(cc1)F)(O)O AB01761 [0,0,0,0,0,0|2,0,1]=3 4 B10R1.13 B(c1ccc(cc1)I)(O)O AB08832 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.13 B(c1ccc(cc1)N)(O)O AB08102 [0,0,0,0,0,0|1,0,1]=2 6 B10R1.13 B(c1ccc(cc1)O)(O)O AB08076 [0,0,0,0,0,0|2,0,1]=3 7 B10R1.13 B(c1ccc(cc1)S)(O)O AB13276 [0,0,0,0,0,0|2,0,1]=3 8 B10R1.13 B(c1ccc(cn1)Br)(O)O AB48603 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.13 B(c1ccc(cn1)C)(O)O AB06946 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.13 B(c1ccc(cn1)Cl)(O)O AB32111 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.13 B(c1ccc(cn1)F)(O)O AB48605 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.13 B(c1ccc(cn1)N)(O)O AB43322 [0,0,0,0,0,0|2,0,1]=3 13 B10R1.13 B(c1ccc(nc1)Br)(O)O AB14131 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.13 B(c1ccc(nc1)C)(O)O AB30208 [0,0,0,0,0,0|3,0,1]=4 15 B10R1.13 B(c1ccc(nc1)Cl)(O)O AB13412 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.13 B(c1ccc(nc1)F)(O)O AB14135 [0,0,0,0,0,0|3,0,1]=4 17 B10R1.13 B(c1ccc(nc1)N)(O)O PB31438 [0,0,0,0,0,0|2,0,1]=3 18 B10R1.13 B(c1ccc(nc1)O)(O)O AB54706 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.13 B(c1ccc(nn1)N)(O)O AB45592 [0,0,0,0,0,0|3,0,1]=4 20 B10R1.13 B(c1cnc(cn1)N)(O)O AB45597 [0,0,0,0,0,0|3,0,1]=4 21 B10R1.13 B(c1cnc(nc1)N)(O)O PB34211 [0,0,0,0,0,0|3,0,1]=4 22 B10R1.13 CC(=C)c1ccc(cc1)O CB10241 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.13 CC(=O)c1ccc(cn1)Br AB21518 [0,0,0,0,0,0|3,0,0]=3 24 B10R1.13 CC(=O)c1ccc(cn1)Cl AB41101 [0,0,0,0,0,0|3,0,0]=3 25 B10R1.13 CC(=O)c1ccc(cn1)F AB62503 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.13 CC(=O)c1ccc(cn1)N AB60315 [0,0,0,0,0,0|2,0,0]=2 27 B10R1.13 CC(=O)c1ccc(cn1)O AB60308 [0,0,0,0,0,0|3,0,0]=3 28 B10R1.13 CC(=O)c1ccc(nc1)Br AB21520 [0,0,0,0,0,0|3,0,0]=3 29 B10R1.13 CC(=O)c1ccc(nc1)Cl AB14033 [0,0,0,0,0,0|3,0,0]=3 30 B10R1.13 CC(=O)c1ccc(nc1)F AB41115 [0,0,0,0,0,0|3,0,0]=3 31 B10R1.13 CC(=O)c1ccc(nc1)N AB49552 [0,0,0,0,0,0|2,0,0]=2 32 B10R1.13 CC(=O)c1ccc(nc1)O AB60297 [0,0,0,0,0,0|3,0,0]=3 33 B10R1.13 CC(=O)c1ccc(nn1)Cl PB20488 [0,0,0,0,0,0|4,0,0]=4 34 B10R1.13 CC(=O)c1cnc(cn1)Cl AB65450 [0,0,0,0,0,0|4,0,0]=4 35 B10R1.13 CC(=O)c1cnc(nc1)Cl AB59098 [0,0,0,0,0,0|4,0,0]=4 36 B10R1.13 CC(=O)c1ncc(cn1)Br PB34979 [0,0,0,0,0,0|4,0,0]=4 37 B10R1.13 CC(=O)c1ncc(cn1)F PB24344 [0,0,0,0,0,0|4,0,0]=4 38 B10R1.13 CC(C)c1ccc(cn1)N PB22166 [0,0,0,0,0,0|3,0,1]=4 39 B10R1.13 CN(C)c1ccc(cc1)O CB10546 [0,0,0,0,0,0|4,0,0]=4 40 B10R1.13 CN(C)c1ccc(cc1)O MB02001 [0,0,0,0,0,0|4,0,0]=4 41 B10R1.13 CN(C)c1ccc(cn1)N PB31328 [0,0,0,0,0,0|4,0,0]=4 42 B10R1.13 Cc1ccc(cc1)C(=N)N AB01792 [0,0,0,0,0,0|3,0,0]=3 43 B10R1.13 Cc1ccc(cc1)C(=S)N AB04365 [0,0,0,0,0,0|2,1,0]=3 44 B10R1.13 Cc1ccc(cn1)C(=O)C AB03568 [0,0,0,0,0,0|3,0,0]=3 45 B10R1.13 Cc1ccc(cn1)C(=O)Cl AB44670 [0,0,0,0,0,0|3,0,0]=3 46 B10R1.13 Cc1ccc(cn1)C(=O)O AB00723 [0,0,0,0,0,0|2,0,0]=2 47 B10R1.13 Cc1ccc(cn1)[N+](=O)[O-] PB18660 [0,0,0,0,0,0|3,0,1]=4 48 B10R1.13 Cc1ccc(nc1)C(=O)C AB25779 [0,0,0,0,0,0|3,0,0]=3 49 B10R1.13 Cc1ccc(nc1)C(=O)O AB09798 [0,0,0,0,0,0|2,0,0]=2 50 B10R1.13 Cc1ccc(nn1)C(=O)C AB75459 [0,0,0,0,0,0|4,0,0]=4 51 B10R1.13 Cc1ccc(nn1)C(=O)O AB52759 [0,0,0,0,0,0|3,0,0]=3 52 B10R1.13 Cc1cnc(cn1)C(=O)C AB02269 [0,0,0,0,0,0|4,0,0]=4 53 B10R1.13 Cc1cnc(cn1)C(=O)N CB10282 [0,0,0,0,0,0|4,0,0]=4 54 B10R1.13 Cc1cnc(cn1)C(=O)O PB12995 [0,0,0,0,0,0|3,0,0]=3 55 B10R1.13 Cc1cnc(nc1)C(=O)O PB29748 [0,0,0,0,0,0|3,0,0]=3 56 B10R1.13 Cc1ncc(cn1)C(=O)O PB27884 [0,0,0,0,0,0|3,0,0]=3 57 B10R1.13 c1c(cnc(n1)Br)C(=O)N MB14155 [0,0,0,0,0,0|4,0,0]=4 58 B10R1.13 c1c(cnc(n1)C(=O)N)Br MB01294 [0,0,0,0,0,0|4,0,0]=4 59 B10R1.13 c1c(cnc(n1)C(=O)O)Br PB33902 [0,0,0,0,0,0|3,0,0]=3 60 B10R1.13 c1c(cnc(n1)C(=O)O)Cl PB13081 [0,0,0,0,0,0|3,0,0]=3 61 B10R1.13 c1c(cnc(n1)C(=O)O)F PB31127 [0,0,0,0,0,0|3,0,0]=3 62 B10R1.13 c1c(cnc(n1)C(=O)O)N PB34128 [0,0,0,0,0,0|2,0,0]=2 63 B10R1.13 c1c(cnc(n1)Cl)C(=O)O PB24941 [0,0,0,0,0,0|3,0,0]=3 64 B10R1.13 c1c(cnc(n1)N)C(=O)O AB22915 [0,0,0,0,0,0|2,0,0]=2 65 B10R1.13 c1c(cnc(n1)N)[N+](=O)[O-] AB00586 [0,0,0,0,0,0|3,0,1]=4 66 B10R1.13 c1c(cnc(n1)O)C(=O)O PB14569 [0,0,0,0,0,0|3,0,0]=3 67 B10R1.13 c1c(ncc(n1)Br)C(=O)N MB14265 [0,0,0,0,0,0|4,0,0]=4 68 B10R1.13 c1c(ncc(n1)Br)C(=O)O AB54768 [0,0,0,0,0,0|3,0,0]=3 69 B10R1.13 c1c(ncc(n1)Cl)C(=O)O PB34349 [0,0,0,0,0,0|3,0,0]=3 70 B10R1.13 c1c(ncc(n1)N)C(=O)O PB32499 [0,0,0,0,0,0|2,0,0]=2 71 B10R1.13 c1c(ncc(n1)O)C(=O)O PB32161 [0,0,0,0,0,0|3,0,0]=3 72 B10R1.13 c1c[n+](ccc1[N+](=O)[O-])[O-] AB00617 [0,0,0,0,0,0|3,0,1]=4 73 B10R1.13 c1cc(ccc1C(=N)N)Br AB06234 [0,0,0,0,0,0|3,0,0]=3 74 B10R1.13 c1cc(ccc1C(=N)N)Cl AB03527 [0,0,0,0,0,0|3,0,0]=3 75 B10R1.13 c1cc(ccc1C(=N)N)F AB18284 [0,0,0,0,0,0|3,0,0]=3 76 B10R1.13 c1cc(ccc1C(=N)N)I AB18403 [0,0,0,0,0,0|3,0,0]=3 77 B10R1.13 c1cc(ccc1C(=N)N)N AB01119 [0,0,0,0,0,0|2,0,0]=2 78 B10R1.13 c1cc(ccc1C(=N)N)O AB03766 [0,0,0,0,0,0|3,0,0]=3 79 B10R1.13 c1cc(ccc1C(=S)N)Br AB18142 [0,0,0,0,0,0|2,1,0]=3 80 B10R1.13 c1cc(ccc1C(=S)N)Cl AB01841 [0,0,0,0,0,0|2,1,0]=3 81 B10R1.13 c1cc(ccc1C(=S)N)F AB08498 [0,0,0,0,0,0|2,1,0]=3 82 B10R1.13 c1cc(ccc1C(=S)N)N AB01833 [0,0,0,0,0,0|1,1,0]=2 83 B10R1.13 c1cc(ccc1C(=S)N)O AB21285 [0,0,0,0,0,0|2,1,0]=3 84 B10R1.13 c1cc(ncc1Br)C(=O)O PB32197 [0,0,0,0,0,0|2,0,0]=2 85 B10R1.13 c1cc(ncc1Br)C(=O)[O-] AB42654 [0,0,0,0,0,0|2,0,1]=3 86 B10R1.13 c1cc(ncc1Br)[N+](=O)[O-] AB04221 [0,0,0,0,0,0|3,0,1]=4 87 B10R1.13 c1cc(ncc1C(=N)N)F PB38856 [0,0,0,0,0,0|4,0,0]=4 88 B10R1.13 c1cc(ncc1C(=O)Cl)F AB42627 [0,0,0,0,0,0|3,0,0]=3 89 B10R1.13 c1cc(ncc1C(=O)N)Br MB01098 [0,0,0,0,0,0|3,0,0]=3 90 B10R1.13 c1cc(ncc1C(=O)O)Br PB18554 [0,0,0,0,0,0|2,0,0]=2 91 B10R1.13 c1cc(ncc1C(=O)O)Cl AB00659 [0,0,0,0,0,0|2,0,0]=2 92 B10R1.13 c1cc(ncc1C(=O)O)F AB09999 [0,0,0,0,0,0|2,0,0]=2 93 B10R1.13 c1cc(ncc1C(=O)O)N AB17940 [0,0,0,0,0,0|1,0,0]=1 94 B10R1.13 c1cc(ncc1C(=O)O)N PB21621 [0,0,0,0,0,0|1,0,0]=1 95 B10R1.13 c1cc(ncc1C(=O)O)O PB17040 [0,0,0,0,0,0|2,0,0]=2 96 B10R1.13 c1cc(ncc1C(F)F)N AB74782 [0,0,0,0,0,0|3,0,1]=4 97 B10R1.13 c1cc(ncc1Cl)C(=N)N PB16514 [0,0,0,0,0,0|4,0,0]=4 98 B10R1.13 c1cc(ncc1Cl)C(=O)O AB17962 [0,0,0,0,0,0|2,0,0]=2 99 B10R1.13 c1cc(ncc1F)C(=N)N PB33102 [0,0,0,0,0,0|4,0,0]=4 100 B10R1.13 c1cc(ncc1F)C(=O)O AB17969 [0,0,0,0,0,0|2,0,0]=2 101 B10R1.13 c1cc(ncc1N)C(=O)O AB12645 [0,0,0,0,0,0|1,0,0]=1 102 B10R1.13 c1cc(ncc1N)C(F)F AB75496 [0,0,0,0,0,0|3,0,1]=4 103 B10R1.13 c1cc(ncc1O)C(=O)N MB11444 [0,0,0,0,0,0|3,0,0]=3 104 B10R1.13 c1cc(ncc1O)C(=O)O PB26027 [0,0,0,0,0,0|2,0,0]=2 105 B10R1.13 c1cc(ncc1[N+](=O)[O-])Br PB21612 [0,0,0,0,0,0|3,0,1]=4 106 B10R1.13 c1cc(ncc1[N+](=O)[O-])Cl AB00655 [0,0,0,0,0,0|3,0,1]=4 107 B10R1.13 c1cc(ncc1[N+](=O)[O-])F AB13439 [0,0,0,0,0,0|3,0,1]=4 108 B10R1.13 c1cc(nnc1C(=O)O)Cl PB27458 [0,0,0,0,0,0|3,0,0]=3 109 B10R1.13 c1cc(nnc1C(=O)O)N PB30836 [0,0,0,0,0,0|2,0,0]=2 110 B10R1.13 c1cc(nnc1C(=O)O)O PB20339 [0,0,0,0,0,0|3,0,0]=3 111 B9R1.1 C#Cc1ccc(cc1)Cl PB21668 [1,0,0,0,0,0|2,0,1]=4 112 B9R1.1 C#Cc1ccc(nc1)N AB66565 [1,0,0,0,0,0|2,0,1]=4 113 B9R1.1 C=Cc1cnc(nc1)N MB09950 [1,0,0,0,0,0|3,0,0]=4 114 B9R1.1 CCc1ccc(cn1)N AB63590 [1,0,0,0,0,0|2,0,1]=4 115 B9R1.1 COc1ccc(cn1)N PB27370 [1,0,0,0,0,0|3,0,0]=4 116 B9R1.1 COc1ccc(nc1)N PB14487 [1,0,0,0,0,0|3,0,0]=4 117 B9R1.1 Cc1ccc(cn1)C=C PB17233 [1,0,0,0,0,0|3,0,0]=4 118 B9R1.1 Cc1ccc(cn1)C=O PB17503 [1,0,0,0,0,0|2,0,0]=3 119 B9R1.1 Cc1ccc(nc1)C=O AB31466 [1,0,0,0,0,0|2,0,0]=3 120 B9R1.1 Cc1ccc(nn1)C=O AB44106 [1,0,0,0,0,0|3,0,0]=4 121 B9R1.1 Cc1cnc(cn1)C=O PB23818 [1,0,0,0,0,0|3,0,0]=4 122 B9R1.1 Cc1cnc(nc1)C=O PB31489 [1,0,0,0,0,0|3,0,0]=4 123 B9R1.1 Cc1ncc(cn1)C=O PB13046 [1,0,0,0,0,0|3,0,0]=4 124 B9R1.1 [C-]#[N+]c1ccc(cc1)Cl MB03556 [1,0,0,0,0,0|3,0,0]=4 125 B9R1.1 c1c(cnc(n1)C=O)Br AB59082 [1,0,0,0,0,0|3,0,0]=4 126 B9R1.1 c1c(cnc(n1)C=O)Cl PB22417 [1,0,0,0,0,0|3,0,0]=4 127 B9R1.1 c1c(cnc(n1)C=O)F PB26883 [1,0,0,0,0,0|3,0,0]=4 128 B9R1.1 c1c(cnc(n1)C=O)N AB58984 [1,0,0,0,0,0|2,0,0]=3 129 B9R1.1 c1c(cnc(n1)C=O)O AB59744 [1,0,0,0,0,0|3,0,0]=4 130 B9R1.1 c1c(cnc(n1)Cl)C=O PB31481 [1,0,0,0,0,0|3,0,0]=4 131 B9R1.1 c1c(cnc(n1)N)C=O PB12291 [1,0,0,0,0,0|2,0,0]=3 132 B9R1.1 c1c(cnc(n1)N)CO PB23785 [1,0,0,0,0,0|2,0,1]=4 133 B9R1.1 c1c(cnc(n1)O)C=O AB58472 [1,0,0,0,0,0|3,0,0]=4 134 B9R1.1 c1c(ncc(n1)Cl)C=O PB20478 [1,0,0,0,0,0|3,0,0]=4 135 B9R1.1 c1cc(ccc1CBr)Br AB00113 [1,0,0,0,0,0|2,0,1]=4 136 B9R1.1 c1cc(ccc1CBr)Cl AB01810 [1,0,0,0,0,0|2,0,1]=4 137 B9R1.1 c1cc(ccc1CI)O MB06957 [1,0,0,0,0,0|2,0,1]=4 138 B9R1.1 c1cc(ccc1CN)O AB11678 [1,0,0,0,0,0|2,0,1]=4 139 B9R1.1 c1cc(ncc1Br)C=O PB30785 [1,0,0,0,0,0|2,0,0]=3 140 B9R1.1 c1cc(ncc1Br)CO AB66533 [1,0,0,0,0,0|2,0,1]=4 141 B9R1.1 c1cc(ncc1Br)CO PB18645 [1,0,0,0,0,0|2,0,1]=4 142 B9R1.1 c1cc(ncc1C=O)Br PB27654 [1,0,0,0,0,0|2,0,0]=3 143 B9R1.1 c1cc(ncc1C=O)Cl PB18586 [1,0,0,0,0,0|2,0,0]=3 144 B9R1.1 c1cc(ncc1C=O)F PB23560 [1,0,0,0,0,0|2,0,0]=3 145 B9R1.1 c1cc(ncc1C=O)N PB19003 [1,0,0,0,0,0|1,0,0]=2 146 B9R1.1 c1cc(ncc1CCl)N AB59930 [1,0,0,0,0,0|2,0,1]=4 147 B9R1.1 c1cc(ncc1CO)Br PB14409 [1,0,0,0,0,0|2,0,1]=4 148 B9R1.1 c1cc(ncc1CO)Cl PB17199 [1,0,0,0,0,0|2,0,1]=4 149 B9R1.1 c1cc(ncc1CO)F PB14327 [1,0,0,0,0,0|2,0,1]=4 150 B9R1.1 c1cc(ncc1CO)N PB26211 [1,0,0,0,0,0|1,0,1]=3 151 B9R1.1 c1cc(ncc1Cl)C=O AB44880 [1,0,0,0,0,0|2,0,0]=3 152 B9R1.1 c1cc(ncc1Cl)CO AB56068 [1,0,0,0,0,0|2,0,1]=4 153 B9R1.1 c1cc(ncc1F)C=O AB42648 [1,0,0,0,0,0|2,0,0]=3 154 B9R1.1 c1cc(ncc1F)CO PB22210 [1,0,0,0,0,0|2,0,1]=4 155 B9R1.1 c1cc(ncc1N)C#N PB14307 [1,0,0,0,0,0|2,0,1]=4 156 B9R1.1 c1cc(ncc1N)C=O AB67740 [1,0,0,0,0,0|1,0,0]=2 157 B9R1.1 c1cc(ncc1N)CN AB23447 [1,0,0,0,0,0|2,0,1]=4 158 B9R1.1 c1cc(ncc1N)CO AB31872 [1,0,0,0,0,0|1,0,1]=3 159 B9R1.1 c1cc(ncc1O)C=O AB59867 [1,0,0,0,0,0|2,0,0]=3 160 B9R1.1 c1cc(nnc1C=O)Cl PB13298 [1,0,0,0,0,0|3,0,0]=4 161 B9R1.6 B(c1cccnc1)(O)O AB17635 [1,0,0,0,0,0|2,0,1]=4 162 B9R1.6 B(c1cccnc1)(O)O PB14187 [1,0,0,0,0,0|2,0,1]=4 163 B9R1.6 B(c1ccncc1)(O)O AB23111 [1,0,0,0,0,0|2,0,1]=4 164 B9R1.6 B(c1ccncc1)(O)O PB29133 [1,0,0,0,0,0|2,0,1]=4 165 B9R1.6 C=C(c1ccccn1)Br AB31950 [1,0,0,0,0,0|3,0,0]=4 166 B9R1.6 CC(=O)c1ccccn1 AB00686 [1,0,0,0,0,0|2,0,0]=3 167 B9R1.6 CC(=O)c1cccnc1 AB00750 [1,0,0,0,0,0|2,0,0]=3 168 B9R1.6 CC(=O)c1cccnn1 PB16551 [1,0,0,0,0,0|3,0,0]=4 169 B9R1.6 CC(=O)c1ccncc1 AB00760 [1,0,0,0,0,0|2,0,0]=3 170 B9R1.6 CC(=O)c1ccncn1 PB17606 [1,0,0,0,0,0|3,0,0]=4 171 B9R1.6 CC(=O)c1ccnnc1 PB26895 [1,0,0,0,0,0|3,0,0]=4 172 B9R1.6 CC(=O)c1cnccn1 AB00602 [1,0,0,0,0,0|3,0,0]=4 173 B9R1.6 CC(=O)c1cncnc1 PB20327 [1,0,0,0,0,0|3,0,0]=4 174 B9R1.6 CC(=O)c1ncccn1 PB34295 [1,0,0,0,0,0|3,0,0]=4 175 B9R1.6 CC(c1ccccc1)Cl AB01249 [1,0,0,0,0,0|2,0,1]=4 176 B9R1.6 c1c(cncn1)C(=O)O PB23195 [1,0,0,0,0,0|2,0,0]=3 177 B9R1.6 c1c(ncnn1)C(=O)O AB72448 [1,0,0,0,0,0|3,0,0]=4 178 B9R1.6 c1cc(nnc1)C(=O)O PB21767 [1,0,0,0,0,0|2,0,0]=3 179 B9R1.6 c1ccc(cc1)C(=N)N AB01943 [1,0,0,0,0,0|2,0,0]=3 180 B9R1.6 c1ccnc(c1)C(=N)N MB00460 [1,0,0,0,0,0|3,0,0]=4 181 B9R1.6 c1ccnc(c1)C(=O)O AB00685 [1,0,0,0,0,0|1,0,0]=2 182 B9R1.6 c1ccnc(c1)C(=S)N AB03215 [1,0,0,0,0,0|2,1,0]=4 183 B9R1.6 c1cnc(cn1)C(=O)O PB27363 [1,0,0,0,0,0|2,0,0]=3 184 B9R1.6 c1cnc(nc1)C(=O)O PB18516 [1,0,0,0,0,0|2,0,0]=3 185 B9R1.6 c1cnccc1C(=N)N MB02852 [1,0,0,0,0,0|3,0,0]=4 186 B9R1.6 c1cnccc1C(=O)O AB00757 [1,0,0,0,0,0|1,0,0]=2 187 B9R1.6 c1cnccc1C(=S)N AB00764 [1,0,0,0,0,0|2,1,0]=4 188 B9R1.6 c1cncnc1C(=O)O PB29023 [1,0,0,0,0,0|2,0,0]=3 189 B9R1.6 c1cnnc(n1)C(=O)O AB48886 [1,0,0,0,0,0|3,0,0]=4 190 B9R1.6 c1cnncc1C(=O)O PB17054 [1,0,0,0,0,0|2,0,0]=3 191 B9R1.6 c1ncnc(n1)C(=O)O AB60791 [1,0,0,0,0,0|3,0,0]=4 192 B11R1.3 B(=O)c1ccc(cc1)C(=O)Cl AB30049 [0,1,0,0,0,0|2,0,0]=3 193 B11R1.3 B(c1ccc(cc1)C#C)(O)O AB48280 [0,1,0,0,0,0|2,0,1]=4 194 B11R1.3 B(c1ccc(cc1)C#N)(O)O AB08783 [0,1,0,0,0,0|1,0,2]=4 195 B11R1.3 B(c1ccc(cc1)C=C)(O)O AB05462 [0,1,0,0,0,0|2,0,1]=4 196 B11R1.3 B(c1ccc(cc1)C=O)(O)O AB03995 [0,1,0,0,0,0|2,0,1]=4 197 B11R1.3 B(c1ccc(cc1)CBr)(O)O AB08630 [0,1,0,0,0,0|2,0,1]=4 198 B11R1.3 B(c1ccc(cc1)CC)(O)O AB07463 [0,1,0,0,0,0|2,0,1]=4 199 B11R1.3 B(c1ccc(cc1)CCl)(O)O AB30901 [0,1,0,0,0,0|2,0,1]=4 200 B11R1.3 B(c1ccc(cc1)CN)(O)O AB09461 [0,1,0,0,0,0|1,0,1]=3 201 B11R1.3 B(c1ccc(cc1)CO)(O)O AB07121 [0,1,0,0,0,0|2,0,1]=4 202 B11R1.3 B(c1ccc(cc1)OC)(O)O AB01770 [0,1,0,0,0,0|2,0,1]=4 203 B11R1.3 B(c1ccc(cc1)SC)(O)O AB03347 [0,1,0,0,0,0|2,0,1]=4 204 B11R1.3 C#Cc1ccc(cc1)[N+](=O)[O-] AB01446 [0,1,0,0,0,0|2,0,1]=4 205 B11R1.3 CC(=O)c1ccc(cc1)C#C AB21444 [0,1,0,0,0,0|2,0,0]=3 206 B11R1.3 CC(=O)c1ccc(cn1)C#N AB67713 [0,1,0,0,0,0|2,0,1]=4 207 B11R1.3 CC(=O)c1ccc(cn1)OC PB14835 [0,1,0,0,0,0|3,0,0]=4 208 B11R1.3 CC(=O)c1ccc(nc1)C#N AB25372 [0,1,0,0,0,0|2,0,1]=4 209 B11R1.3 CC(=O)c1ccc(nc1)OC AB22367 [0,1,0,0,0,0|3,0,0]=4 210 B11R1.3 CCc1ccc(cc1)C(=S)N AB23762 [0,1,0,0,0,0|2,1,0]=4 211 B11R1.3 CNc1ccc(cn1)[N+](=O)[O-] AB04049 [0,1,0,0,0,0|2,0,1]=4 212 B11R1.3 CNc1ncc(cn1)C(=O)O AB43554 [0,1,0,0,0,0|2,0,0]=3 213 B11R1.3 COc1ccc(cc1)C(=N)N AB06258 [0,1,0,0,0,0|3,0,0]=4 214 B11R1.3 COc1ccc(cc1)C(=O)N AB00908 [0,1,0,0,0,0|2,0,0]=3 215 B11R1.3 COc1ccc(cc1)C(=S)N AB01847 [0,1,0,0,0,0|2,1,0]=4 216 B11R1.3 COc1ccc(cn1)C(=O)O PB30805 [0,1,0,0,0,0|2,0,0]=3 217 B11R1.3 COc1ccc(nc1)C(=O)O PB17398 [0,1,0,0,0,0|2,0,0]=3 218 B11R1.3 COc1ccc(nn1)C(=O)O AB52589 [0,1,0,0,0,0|3,0,0]=4 219 B11R1.3 COc1cnc(cn1)C(=O)O AB60459 [0,1,0,0,0,0|3,0,0]=4 220 B11R1.3 COc1ncc(cn1)C(=O)O AB43547 [0,1,0,0,0,0|3,0,0]=4 221 B11R1.3 CSc1ncc(cn1)C(=O)O PB17421 [0,1,0,0,0,0|3,0,0]=4 222 B11R1.3 c1c(cnc(n1)C#N)C(=O)O PB24031 [0,1,0,0,0,0|2,0,1]=4 223 B11R1.3 c1cc(ccc1C=O)C(=N)N AB11535 [0,1,0,0,0,0|3,0,0]=4 224 B11R1.3 c1cc(ncc1C#N)C(=O)O AB49711 [0,1,0,0,0,0|1,0,1]=3 225 B11R1.3 c1cc(ncc1C(=O)O)C#N AB08639 [0,1,0,0,0,0|1,0,1]=3 226 B11R1.3 c1cc(ncc1C(=O)O)CN AB23462 [0,1,0,0,0,0|1,0,0]=2 227 B11R1.3 c1cc(ncc1C(=O)O)NN PB27614 [0,1,0,0,0,0|1,0,0]=2 228 B11R1.3 c1cc(ncc1C=O)C(=O)O AB63121 [0,1,0,0,0,0|2,0,0]=3 229 B11R1.3 c1cc(ncc1[N+](=O)[O-])CN AB31865 [0,1,0,0,0,0|2,0,1]=4 230 B11R1.19 CS(=O)(=O)c1ccc(cc1)Br AB01453 [0,1,0,0,0,0|2,0,1]=4 231 B11R1.19 CS(=O)(=O)c1ccc(cc1)I AB07768 [0,1,0,0,0,0|2,0,1]=4 232 B11R1.19 CS(=O)(=O)c1ccc(cc1)N AB01467 [0,1,0,0,0,0|1,0,1]=3 233 B11R1.19 CS(=O)(=O)c1ccc(cc1)O AB02067 [0,1,0,0,0,0|2,0,1]=4 234 B11R1.19 c1cc(ccc1S(=O)(=O)N)Br AB02163 [0,1,0,0,0,0|2,0,1]=4 235 B11R1.19 c1cc(ncc1Br)S(=O)(=O)O MB13729 [0,1,0,0,0,0|3,0,0]=4 236 B11R1.19 c1cc(ncc1S(=O)(=O)O)Br MB03760 [0,1,0,0,0,0|3,0,0]=4 237 B11R1.21 B(c1cc(c(nc1)N)Cl)(O)O AB76827 [0,1,0,0,0,0|2,0,1]=4 238 B11R1.21 B(c1ccc(c(c1)C)C)(O)O AB07958 [0,1,0,0,0,0|2,0,1]=4 239 B11R1.21 B(c1ccc(c(c1)C)Cl)(O)O AB12318 [0,1,0,0,0,0|2,0,1]=4 240 B11R1.21 B(c1ccc(c(c1)C)F)(O)O AB10389 [0,1,0,0,0,0|2,0,1]=4 241 B11R1.21 B(c1ccc(c(c1)Cl)C)(O)O AB17244 [0,1,0,0,0,0|2,0,1]=4 242 B11R1.21 B(c1ccc(c(c1)Cl)Cl)(O)O AB08089 [0,1,0,0,0,0|2,0,1]=4 243 B11R1.21 B(c1ccc(c(c1)Cl)F)(O)O AB02143 [0,1,0,0,0,0|2,0,1]=4 244 B11R1.21 B(c1ccc(c(c1)F)Br)(O)O AB10753 [0,1,0,0,0,0|2,0,1]=4 245 B11R1.21 B(c1ccc(c(c1)F)Cl)(O)O AB08827 [0,1,0,0,0,0|2,0,1]=4 246 B11R1.21 B(c1ccc(c(c1)F)F)(O)O AB07331 [0,1,0,0,0,0|2,0,1]=4 247 B11R1.21 B(c1ccc(c(c1)F)N)(O)O AB60801 [0,1,0,0,0,0|1,0,1]=3 248 B11R1.21 B(c1ccc(c(c1)F)O)(O)O AB26445 [0,1,0,0,0,0|2,0,1]=4 249 B11R1.21 B(c1ccc(c(c1)N)C)(O)O AB08081 [0,1,0,0,0,0|2,0,1]=4 250 B11R1.21 B(c1ccc(c(c1)N)C)(O)O AB09464 [0,1,0,0,0,0|2,0,1]=4 251 B11R1.21 B(c1ccc(c(c1)N)Cl)(O)O AB13618 [0,1,0,0,0,0|2,0,1]=4 252 B11R1.21 B(c1ccc(c(c1)N)Cl)(O)O AB20318 [0,1,0,0,0,0|2,0,1]=4 253 B11R1.21 B(c1ccc(c(c1)N)F)(O)O AB13157 [0,1,0,0,0,0|2,0,1]=4 254 B11R1.21 B(c1ccc(c(c1)O)C)(O)O AB08101 [0,1,0,0,0,0|2,0,1]=4 255 B11R1.21 B(c1ccc(c(c1)O)Cl)(O)O AB59548 [0,1,0,0,0,0|2,0,1]=4 256 B11R1.21 B(c1ccc(c(c1)O)F)(O)O AB48248 [0,1,0,0,0,0|2,0,1]=4 257 B11R1.21 CC(=O)c1cc(c(cn1)Cl)Cl AB73180 [0,1,0,0,0,0|3,0,0]=4 258 B11R1.21 CC(=O)c1cc(c(cn1)Cl)F AB82986 [0,1,0,0,0,0|3,0,0]=4 259 B11R1.21 CC(=O)c1cc(c(cn1)Cl)N AB83914 [0,1,0,0,0,0|3,0,0]=4 260 B11R1.21 CC(=O)c1cc(c(cn1)Cl)O AB75003 [0,1,0,0,0,0|3,0,0]=4 261 B11R1.21 CC(=O)c1cc(c(cn1)F)Cl AB83156 [0,1,0,0,0,0|3,0,0]=4 262 B11R1.21 CC(=O)c1cc(c(cn1)N)Cl AB83892 [0,1,0,0,0,0|2,0,0]=3 263 B11R1.21 CC(=O)c1cc(c(cn1)O)Cl AB75001 [0,1,0,0,0,0|3,0,0]=4 264 B11R1.21 CC(=O)c1cc(c(nc1)Cl)Cl AB60291 [0,1,0,0,0,0|3,0,0]=4 265 B11R1.21 CC(=O)c1cc(c(nc1)Cl)F AB74574 [0,1,0,0,0,0|3,0,0]=4 266 B11R1.21 CC(=O)c1cc(c(nc1)Cl)N AB83970 [0,1,0,0,0,0|3,0,0]=4 267 B11R1.21 CC(=O)c1cc(c(nc1)Cl)O AB74793 [0,1,0,0,0,0|3,0,0]=4 268 B11R1.21 CC(=O)c1cc(c(nc1)F)Cl AB75049 [0,1,0,0,0,0|3,0,0]=4 269 B11R1.21 CC(=O)c1cc(c(nc1)N)Cl AB74572 [0,1,0,0,0,0|2,0,0]=3 270 B11R1.21 CC(=O)c1cc(c(nc1)N)N AB60288 [0,1,0,0,0,0|2,0,0]=3 271 B11R1.21 CC(=O)c1cc(c(nc1)O)Cl AB84068 [0,1,0,0,0,0|3,0,0]=4 272 B11R1.21 CC(=O)c1ccc(c(n1)Cl)F AB75031 [0,1,0,0,0,0|3,0,0]=4 273 B11R1.21 CC(=O)c1ccc(c(n1)Cl)N AB51559 [0,1,0,0,0,0|2,0,0]=3 274 B11R1.21 CC(=O)c1ccc(c(n1)Cl)O AB74855 [0,1,0,0,0,0|3,0,0]=4 275 B11R1.21 CC(=O)c1ccc(c(n1)F)Cl AB72855 [0,1,0,0,0,0|3,0,0]=4 276 B11R1.21 CC(=O)c1ccc(c(n1)N)Cl AB83957 [0,1,0,0,0,0|3,0,0]=4 277 B11R1.21 CC(=O)c1ccc(c(n1)O)Cl AB84085 [0,1,0,0,0,0|3,0,0]=4 278 B11R1.21 CC(C)c1ccc(c(c1)O)N MB22521 [0,1,0,0,0,0|2,0,1]=4 279 B11R1.21 CN(C)c1ccc(c(c1)O)N MB24826 [0,1,0,0,0,0|3,0,0]=4 280 B11R1.21 Cc1c(cc(cn1)C(=O)C)Cl AB74646 [0,1,0,0,0,0|3,0,0]=4 281 B11R1.21 Cc1c(cc(cn1)C(=O)C)F AB83026 [0,1,0,0,0,0|3,0,0]=4 282 B11R1.21 Cc1c(cc(cn1)C(=O)O)Br AB74944 [0,1,0,0,0,0|2,0,0]=3 283 B11R1.21 Cc1c(cc(cn1)C(=O)O)Cl AB74644 [0,1,0,0,0,0|2,0,0]=3 284 B11R1.21 Cc1c(cc(cn1)C(=O)O)F AB71562 [0,1,0,0,0,0|2,0,0]=3 285 B11R1.21 Cc1c(cc(cn1)C(=O)O)N PB30351 [0,1,0,0,0,0|2,0,0]=3 286 B11R1.21 Cc1c(cc(cn1)C(=O)O)O AB74651 [0,1,0,0,0,0|2,0,0]=3 287 B11R1.21 Cc1c(ccc(n1)C(=O)C)Cl AB83319 [0,1,0,0,0,0|3,0,0]=4 288 B11R1.21 Cc1c(ccc(n1)C(=O)C)F AB75156 [0,1,0,0,0,0|3,0,0]=4 289 B11R1.21 Cc1c(ccc(n1)C(=O)O)Cl AB74921 [0,1,0,0,0,0|2,0,0]=3 290 B11R1.21 Cc1c(ccc(n1)C(=O)O)F AB62793 [0,1,0,0,0,0|2,0,0]=3 291 B11R1.21 Cc1c(nc(cn1)C(=O)O)C AB13799 [0,1,0,0,0,0|3,0,0]=4 292 B11R1.21 Cc1c(ncc(n1)C(=O)O)Cl AB71835 [0,1,0,0,0,0|3,0,0]=4 293 B11R1.21 Cc1c(ncc(n1)C(=O)O)F AB85697 [0,1,0,0,0,0|3,0,0]=4 294 B11R1.21 Cc1cc(ccc1O)C(=O)N MB23357 [0,1,0,0,0,0|2,0,0]=3 295 B11R1.21 Cc1cc(cnc1Br)C(=O)O AB62965 [0,1,0,0,0,0|2,0,0]=3 296 B11R1.21 Cc1cc(cnc1C)C(=O)C AB75410 [0,1,0,0,0,0|3,0,0]=4 297 B11R1.21 Cc1cc(cnc1C)C(=O)O AB66691 [0,1,0,0,0,0|2,0,0]=3 298 B11R1.21 Cc1cc(cnc1Cl)C(=O)C AB75129 [0,1,0,0,0,0|3,0,0]=4 299 B11R1.21 Cc1cc(cnc1Cl)C(=O)O AB71754 [0,1,0,0,0,0|2,0,0]=3 300 B11R1.21 Cc1cc(cnc1F)C(=O)C AB75174 [0,1,0,0,0,0|3,0,0]=4 301 B11R1.21 Cc1cc(cnc1F)C(=O)O AB42633 [0,1,0,0,0,0|2,0,0]=3 302 B11R1.21 Cc1cc(cnc1N)[N+](=O)[O-] AB13441 [0,1,0,0,0,0|2,0,1]=4 303 B11R1.21 Cc1cc(ncc1Br)C(=O)O AB41173 [0,1,0,0,0,0|2,0,0]=3 304 B11R1.21 Cc1cc(ncc1C)C(=O)C AB74626 [0,1,0,0,0,0|3,0,0]=4 305 B11R1.21 Cc1cc(ncc1C)C(=O)O AB64943 [0,1,0,0,0,0|2,0,0]=3 306 B11R1.21 Cc1cc(ncc1Cl)C(=O)C AB75107 [0,1,0,0,0,0|3,0,0]=4 307 B11R1.21 Cc1cc(ncc1Cl)C(=O)O AB41176 [0,1,0,0,0,0|2,0,0]=3 308 B11R1.21 Cc1cc(ncc1F)C(=O)O AB74791 [0,1,0,0,0,0|2,0,0]=3 309 B11R1.21 Cc1ccc(cc1C)C(=N)N AB21798 [0,1,0,0,0,0|3,0,0]=4 310 B11R1.21 Cc1ccc(cc1C)C(=S)N AB26899 [0,1,0,0,0,0|2,1,0]=4 311 B11R1.21 Cc1ccc(cc1O)C(=O)N AB63532 [0,1,0,0,0,0|2,0,0]=3 312 B11R1.21 Cc1ccc(cc1O)[N+](=O)[O-] AB01960 [0,1,0,0,0,0|2,0,1]=4 313 B11R1.21 Cc1ccc(nc1C)C(=O)C AB74623 [0,1,0,0,0,0|3,0,0]=4 314 B11R1.21 Cc1ccc(nc1C)C(=O)O AB62927 [0,1,0,0,0,0|2,0,0]=3 315 B11R1.21 Cc1ccc(nc1Cl)C(=O)C AB75095 [0,1,0,0,0,0|3,0,0]=4 316 B11R1.21 Cc1ccc(nc1Cl)C(=O)O AB66617 [0,1,0,0,0,0|2,0,0]=3 317 B11R1.21 Cc1ccc(nc1F)C(=O)C AB75167 [0,1,0,0,0,0|3,0,0]=4 318 B11R1.21 Cc1ccc(nc1F)C(=O)O AB72844 [0,1,0,0,0,0|2,0,0]=3 319 B11R1.21 Cc1cnc(c[n+]1[O-])C(=O)O MB01535 [0,1,0,0,0,0|3,0,0]=4 320 B11R1.21 Cc1cnc(cc1Br)C(=O)O AB70164 [0,1,0,0,0,0|2,0,0]=3 321 B11R1.21 Cc1cnc(cc1Cl)C(=O)C AB83277 [0,1,0,0,0,0|3,0,0]=4 322 B11R1.21 Cc1cnc(cc1Cl)C(=O)O AB65446 [0,1,0,0,0,0|2,0,0]=3 323 B11R1.21 Cc1cnc(cc1F)C(=O)C AB82953 [0,1,0,0,0,0|3,0,0]=4 324 B11R1.21 Cc1cnc(cc1F)C(=O)O AB74895 [0,1,0,0,0,0|2,0,0]=3 325 B11R1.21 Cn1c(=O)ccc(n1)C(=O)O PB12782 [0,1,0,0,0,0|3,0,0]=4 326 B11R1.21 Cn1cc(ccc1=O)C(=O)O PB21634 [0,1,0,0,0,0|2,0,0]=3 327 B11R1.21 Cn1ccc(cc1=O)C(=O)O PB32349 [0,1,0,0,0,0|2,0,0]=3 328 B11R1.21 c1c(c(cnc1C(=O)O)Br)Cl AB67645 [0,1,0,0,0,0|2,0,0]=3 329 B11R1.21 c1c(c(cnc1C(=O)O)Br)N PB21081 [0,1,0,0,0,0|2,0,0]=3 330 B11R1.21 c1c(c(cnc1C(=O)O)Cl)Cl AB63131 [0,1,0,0,0,0|2,0,0]=3 331 B11R1.21 c1c(c(cnc1C(=O)O)Cl)F AB74911 [0,1,0,0,0,0|2,0,0]=3 332 B11R1.21 c1c(c(cnc1C(=O)O)Cl)N AB75270 [0,1,0,0,0,0|2,0,0]=3 333 B11R1.21 c1c(c(cnc1C(=O)O)Cl)O AB74886 [0,1,0,0,0,0|2,0,0]=3 334 B11R1.21 c1c(c(cnc1C(=O)O)F)Cl AB67663 [0,1,0,0,0,0|2,0,0]=3 335 B11R1.21 c1c(c(cnc1C(=O)O)F)F AB73187 [0,1,0,0,0,0|2,0,0]=3 336 B11R1.21 c1c(c(cnc1C(=O)O)N)Cl AB67747 [0,1,0,0,0,0|1,0,0]=2 337 B11R1.21 c1c(c(cnc1C(=O)O)N)F AB73539 [0,1,0,0,0,0|1,0,0]=2 338 B11R1.21 c1c(c(cnc1C(=O)O)O)Cl AB67787 [0,1,0,0,0,0|2,0,0]=3 339 B11R1.21 c1c(cnc(c1Br)Cl)C(=O)O AB10529 [0,1,0,0,0,0|2,0,0]=3 340 B11R1.21 c1c(cnc(c1Br)N)[N+](=O)[O-] AB07738 [0,1,0,0,0,0|2,0,1]=4 341 B11R1.21 c1c(cnc(c1Cl)Cl)C(=O)O PB29008 [0,1,0,0,0,0|2,0,0]=3 342 B11R1.21 c1c(cnc(c1Cl)F)C(=O)O AB15015 [0,1,0,0,0,0|2,0,0]=3 343 B11R1.21 c1c(cnc(c1Cl)N)C(=O)O AB63730 [0,1,0,0,0,0|1,0,0]=2 344 B11R1.21 c1c(cnc(c1Cl)O)C(=O)O AB02225 [0,1,0,0,0,0|2,0,0]=3 345 B11R1.21 c1c(cnc(c1F)Br)C(=O)O AB62700 [0,1,0,0,0,0|2,0,0]=3 346 B11R1.21 c1c(cnc(c1F)Cl)C(=O)O AB64027 [0,1,0,0,0,0|2,0,0]=3 347 B11R1.21 c1c(cnc(c1F)F)C(=O)O PB14646 [0,1,0,0,0,0|2,0,0]=3 348 B11R1.21 c1c(cnc(c1I)N)[N+](=O)[O-] MB04488 [0,1,0,0,0,0|2,0,1]=4 349 B11R1.21 c1c(cnc(c1N)Cl)C(=O)O AB75265 [0,1,0,0,0,0|2,0,0]=3 350 B11R1.21 c1c(cnc(c1N)N)C(=O)O AB60261 [0,1,0,0,0,0|1,0,0]=2 351 B11R1.21 c1c(cnc(c1N)N)[N+](=O)[O-] AB60270 [0,1,0,0,0,0|2,0,1]=4 352 B11R1.21 c1c(cnc(c1O)Cl)C(=O)O AB72035 [0,1,0,0,0,0|2,0,0]=3 353 B11R1.21 c1c(nc(c(n1)N)Br)C(=O)O PB26120 [0,1,0,0,0,0|2,0,0]=3 354 B11R1.21 c1c(nc(c(n1)N)I)C(=O)O PB37460 [0,1,0,0,0,0|2,0,0]=3 355 B11R1.21 c1cc(c(cc1C(=N)N)Br)F AB18332 [0,1,0,0,0,0|3,0,0]=4 356 B11R1.21 c1cc(c(cc1C(=N)N)Cl)F AB06667 [0,1,0,0,0,0|3,0,0]=4 357 B11R1.21 c1cc(c(cc1C(=N)N)F)Br AB39276 [0,1,0,0,0,0|3,0,0]=4 358 B11R1.21 c1cc(c(cc1C(=N)N)F)F AB18316 [0,1,0,0,0,0|3,0,0]=4 359 B11R1.21 c1cc(c(cc1C(=O)N)Br)O MB31615 [0,1,0,0,0,0|2,0,0]=3 360 B11R1.21 c1cc(c(cc1C(=O)N)Cl)O MB09407 [0,1,0,0,0,0|2,0,0]=3 361 B11R1.21 c1cc(c(cc1C(=O)N)F)O MB30803 [0,1,0,0,0,0|2,0,0]=3 362 B11R1.21 c1cc(c(cc1C(=O)N)I)O MB25459 [0,1,0,0,0,0|2,0,0]=3 363 B11R1.21 c1cc(c(cc1C(=O)N)N)F AB51096 [0,1,0,0,0,0|2,0,0]=3 364 B11R1.21 c1cc(c(cc1C(=O)N)N)O MB11674 [0,1,0,0,0,0|2,0,0]=3 365 B11R1.21 c1cc(c(cc1C(=O)N)O)Br MB25480 [0,1,0,0,0,0|2,0,0]=3 366 B11R1.21 c1cc(c(cc1C(=O)N)O)Cl MB27786 [0,1,0,0,0,0|2,0,0]=3 367 B11R1.21 c1cc(c(cc1C(=O)N)O)F MB26081 [0,1,0,0,0,0|2,0,0]=3 368 B11R1.21 c1cc(c(cc1C(=O)N)O)I MB09166 [0,1,0,0,0,0|2,0,0]=3 369 B11R1.21 c1cc(c(cc1C(=O)N)O)N MB25500 [0,1,0,0,0,0|1,0,0]=2 370 B11R1.21 c1cc(c(cc1C(=O)O)Br)F AB01920 [0,1,0,0,0,0|1,0,0]=2 371 B11R1.21 c1cc(c(cc1C(=O)O)F)Br AB06858 [0,1,0,0,0,0|1,0,0]=2 372 B11R1.21 c1cc(c(cc1C(=O)O)F)O AB03853 [0,1,0,0,0,0|1,0,0]=2 373 B11R1.21 c1cc(c(cc1C(=O)O)N)F AB25439 [0,1,0,0,0,0|1,0,0]=2 374 B11R1.21 c1cc(c(cc1C(=O)O)O)Cl AB04116 [0,1,0,0,0,0|1,0,0]=2 375 B11R1.21 c1cc(c(cc1C(=O)O)O)F AB05533 [0,1,0,0,0,0|1,0,0]=2 376 B11R1.21 c1cc(c(cc1C(=O)O)O)I AB10648 [0,1,0,0,0,0|1,0,0]=2 377 B11R1.21 c1cc(c(cc1[N+](=O)[O-])Br)N AB01462 [0,1,0,0,0,0|1,0,1]=3 378 B11R1.21 c1cc(c(cc1[N+](=O)[O-])Cl)Br MB00446 [0,1,0,0,0,0|2,0,1]=4 379 B11R1.21 c1cc(nc(c1Cl)F)C(=O)O AB49341 [0,1,0,0,0,0|2,0,0]=3 380 B11R1.21 c1cc(nc(c1Cl)N)C(=O)O AB74552 [0,1,0,0,0,0|2,0,0]=3 381 B11R1.21 c1cc(nc(c1F)Cl)C(=O)O AB66795 [0,1,0,0,0,0|2,0,0]=3 382 B11R1.21 c1cc(nc(c1F)F)C(=O)O AB49344 [0,1,0,0,0,0|2,0,0]=3 383 B11R1.21 c1cc(nc(c1N)Cl)C(=O)O AB75268 [0,1,0,0,0,0|1,0,0]=2 384 B11R1.21 c1cc(nc(c1O)Cl)C(=O)O AB64506 [0,1,0,0,0,0|2,0,0]=3 385 B11R1.22 CCC(=O)c1ccc(cn1)Br AB68534 [0,1,0,0,0,0|3,0,0]=4 386 B11R1.22 CNC(=O)c1ccc(cc1)O MB02709 [0,1,0,0,0,0|2,0,0]=3 387 B11R1.22 CNC(=O)c1ccc(cn1)O MB11446 [0,1,0,0,0,0|3,0,0]=4 388 B11R1.22 CNC(=O)c1ccc(nc1)Br MB07978 [0,1,0,0,0,0|3,0,0]=4 389 B11R1.22 COC(=N)c1ccc(cc1)F AB60956 [0,1,0,0,0,0|2,0,0]=3 390 B11R1.22 COC(=N)c1ccc(cc1)N AB60980 [0,1,0,0,0,0|1,0,0]=2 391 B11R1.22 COC(=N)c1ccc(cc1)O AB01949 [0,1,0,0,0,0|2,0,0]=3 392 B11R1.22 COC(=O)c1ccc(cn1)Br PB29312 [0,1,0,0,0,0|2,0,0]=3 393 B11R1.22 COC(=O)c1ccc(cn1)Cl AB51080 [0,1,0,0,0,0|2,0,0]=3 394 B11R1.22 COC(=O)c1ccc(cn1)N PB26290 [0,1,0,0,0,0|1,0,0]=2 395 B11R1.22 COC(=O)c1ccc(cn1)O PB27686 [0,1,0,0,0,0|2,0,0]=3 396 B11R1.22 COC(=O)c1ccc(nc1)Br PB29326 [0,1,0,0,0,0|2,0,0]=3 397 B11R1.22 COC(=O)c1ccc(nc1)N PB19892 [0,1,0,0,0,0|1,0,0]=2 398 B11R1.22 COC(=O)c1ccc(nc1)O PB34296 [0,1,0,0,0,0|2,0,0]=3 399 B11R1.22 COC(=O)c1ccc(nn1)Br MB13587 [0,1,0,0,0,0|3,0,0]=4 400 B11R1.22 COC(=O)c1ccc(nn1)Cl PB18925 [0,1,0,0,0,0|3,0,0]=4 401 B11R1.22 COC(=O)c1ccc(nn1)N PB33362 [0,1,0,0,0,0|2,0,0]=3 402 B11R1.22 COC(=O)c1ccc(nn1)O PB13716 [0,1,0,0,0,0|3,0,0]=4 403 B11R1.22 COC(=O)c1cnc(cn1)Br MB08354 [0,1,0,0,0,0|3,0,0]=4 404 B11R1.22 COC(=O)c1cnc(cn1)Cl PB33958 [0,1,0,0,0,0|3,0,0]=4 405 B11R1.22 COC(=O)c1cnc(cn1)N PB12687 [0,1,0,0,0,0|2,0,0]=3 406 B11R1.22 COC(=O)c1cnc(cn1)O PB32586 [0,1,0,0,0,0|3,0,0]=4 407 B11R1.22 COC(=O)c1cnc(nc1)Br MB14326 [0,1,0,0,0,0|3,0,0]=4 408 B11R1.22 COC(=O)c1cnc(nc1)Cl PB17570 [0,1,0,0,0,0|3,0,0]=4 409 B11R1.22 COC(=O)c1cnc(nc1)N PB27896 [0,1,0,0,0,0|2,0,0]=3 410 B11R1.22 COC(=O)c1ncc(cn1)Br PB26634 [0,1,0,0,0,0|3,0,0]=4 411 B11R1.22 COC(=O)c1ncc(cn1)N PB10524 [0,1,0,0,0,0|2,0,0]=3 412 B11R1.22 COC(=O)c1ncc(cn1)N PB37109 [0,1,0,0,0,0|2,0,0]=3 413 B11R1.22 COS(=O)c1ccc(cc1)Cl AB45287 [0,1,0,0,0,0|2,0,0]=3 414 B11R1.22 Cc1ccc(cc1)C(=O)C=O AB05249 [0,1,0,0,0,0|1,0,1]=3 415 B11R1.22 Cc1ccc(cc1)C(=O)C=O AB05288 [0,1,0,0,0,0|1,0,1]=3 416 B11R1.22 Cc1cnc(nc1)C(=O)OC PB28603 [0,1,0,0,0,0|3,0,0]=4 417 B11R1.22 Cc1ncc(cn1)C(=O)OC PB10888 [0,1,0,0,0,0|3,0,0]=4 418 B11R1.22 c1cc(ccc1C(=O)C#N)Br MB00883 [0,1,0,0,0,0|2,0,0]=3 419 B11R1.22 c1cc(ccc1C(=O)C=O)Br AB07939 [0,1,0,0,0,0|1,0,1]=3 420 B11R1.22 c1cc(ccc1C(=O)C=O)Br AB49987 [0,1,0,0,0,0|1,0,1]=3 421 B11R1.22 c1cc(ccc1C(=O)C=O)Cl AB44429 [0,1,0,0,0,0|1,0,1]=3 422 B11R1.22 c1cc(ccc1C(=O)C=O)F AB09010 [0,1,0,0,0,0|1,0,1]=3 423 B11R1.22 c1cc(ccc1C(=O)C=O)O AB02263 [0,1,0,0,0,0|1,0,1]=3 424 B11R1.22 c1cc(ccc1C(=O)CN)Br CB10172 [0,1,0,0,0,0|2,0,0]=3 425 B11R1.22 c1cc(ccc1C(=O)CO)F MB02453 [0,1,0,0,0,0|1,0,0]=2 426 B11R1.22 c1cc(ncc1Br)C(=O)CBr AB69651 [0,1,0,0,0,0|3,0,0]=4 427 B11R1.22 c1cc(ncc1C(=O)CBr)Cl AB13128 [0,1,0,0,0,0|3,0,0]=4 428 B11R1.22 c1cc(ncc1Cl)C(=O)CBr AB60184 [0,1,0,0,0,0|3,0,0]=4 429 B11R1.166 B(c1ccc(cc1C)Br)(O)O AB71470 [0,1,0,0,0,0|2,0,1]=4 430 B11R1.166 B(c1ccc(cc1C)C)(O)O AB12317 [0,1,0,0,0,0|2,0,1]=4 431 B11R1.166 B(c1ccc(cc1C)Cl)(O)O AB12322 [0,1,0,0,0,0|2,0,1]=4 432 B11R1.166 B(c1ccc(cc1C)F)(O)O AB10764 [0,1,0,0,0,0|2,0,1]=4 433 B11R1.166 B(c1ccc(cc1C)O)(O)O AB16000 [0,1,0,0,0,0|2,0,1]=4 434 B11R1.166 B(c1ccc(cc1Cl)C)(O)O AB14287 [0,1,0,0,0,0|2,0,1]=4 435 B11R1.166 B(c1ccc(cc1Cl)Cl)(O)O AB01132 [0,1,0,0,0,0|2,0,1]=4 436 B11R1.166 B(c1ccc(cc1Cl)F)(O)O AB12605 [0,1,0,0,0,0|2,0,1]=4 437 B11R1.166 B(c1ccc(cc1Cl)O)(O)O AB12627 [0,1,0,0,0,0|2,0,1]=4 438 B11R1.166 B(c1ccc(cc1F)Br)(O)O AB08626 [0,1,0,0,0,0|2,0,1]=4 439 B11R1.166 B(c1ccc(cc1F)C)(O)O PB26163 [0,1,0,0,0,0|2,0,1]=4 440 B11R1.166 B(c1ccc(cc1F)Cl)(O)O AB12601 [0,1,0,0,0,0|2,0,1]=4 441 B11R1.166 B(c1ccc(cc1F)F)(O)O AB08813 [0,1,0,0,0,0|2,0,1]=4 442 B11R1.166 B(c1ccc(cc1F)I)(O)O AB10768 [0,1,0,0,0,0|2,0,1]=4 443 B11R1.166 B(c1ccc(cc1F)N)(O)O AB59538 [0,1,0,0,0,0|1,0,1]=3 444 B11R1.166 B(c1ccc(cc1N)Br)(O)O AB27555 [0,1,0,0,0,0|2,0,1]=4 445 B11R1.166 B(c1ccc(cc1O)C)(O)O PB11677 [0,1,0,0,0,0|2,0,1]=4 446 B11R1.166 B(c1ccc(cc1O)F)(O)O AB20352 [0,1,0,0,0,0|2,0,1]=4 447 B11R1.166 B(c1cnc(cc1C)N)(O)O AB67856 [0,1,0,0,0,0|2,0,1]=4 448 B11R1.166 CC(=O)c1c(cc(cn1)Br)Br AB43404 [0,1,0,0,0,0|3,0,0]=4 449 B11R1.166 CC(=O)c1c(cc(cn1)Br)N AB77139 [0,1,0,0,0,0|3,0,0]=4 450 B11R1.166 CC(=O)c1c(cc(cn1)Br)O AB84315 [0,1,0,0,0,0|3,0,0]=4 451 B11R1.166 CC(=O)c1c(cc(cn1)Cl)F AB75038 [0,1,0,0,0,0|3,0,0]=4 452 B11R1.166 CC(=O)c1c(cc(cn1)Cl)N AB73056 [0,1,0,0,0,0|3,0,0]=4 453 B11R1.166 CC(=O)c1c(cc(cn1)Cl)O AB75011 [0,1,0,0,0,0|3,0,0]=4 454 B11R1.166 CC(=O)c1c(cc(cn1)F)Cl AB74653 [0,1,0,0,0,0|3,0,0]=4 455 B11R1.166 CC(=O)c1c(cc(cn1)F)N AB77154 [0,1,0,0,0,0|3,0,0]=4 456 B11R1.166 CC(=O)c1c(cc(cn1)N)N AB83853 [0,1,0,0,0,0|2,0,0]=3 457 B11R1.166 CC(=O)c1c(cc(cn1)N)O AB84318 [0,1,0,0,0,0|2,0,0]=3 458 B11R1.166 CC(=O)c1ccc(cc1F)Br MB02747 [0,1,0,0,0,0|2,0,0]=3 459 B11R1.166 CC(=O)c1ccc(cc1F)N MB05492 [0,1,0,0,0,0|1,0,0]=2 460 B11R1.166 CC(=O)c1ccc(cc1O)Br AB15427 [0,1,0,0,0,0|2,0,0]=3 461 B11R1.166 CC(=O)c1ccc(nc1Cl)Cl AB64664 [0,1,0,0,0,0|3,0,0]=4 462 B11R1.166 CC(=O)c1ccc(nc1F)Br AB72629 [0,1,0,0,0,0|3,0,0]=4 463 B11R1.166 CC(=O)c1ccc(nc1F)Cl AB72627 [0,1,0,0,0,0|3,0,0]=4 464 B11R1.166 CC(=O)c1ccc(nc1N)Br AB83837 [0,1,0,0,0,0|3,0,0]=4 465 B11R1.166 CC(=O)c1ccc(nc1N)Cl AB75425 [0,1,0,0,0,0|3,0,0]=4 466 B11R1.166 CC(=O)c1ccc(nc1N)N AB83840 [0,1,0,0,0,0|2,0,0]=3 467 B11R1.166 CC(=O)c1ccc(nc1O)Br AB84273 [0,1,0,0,0,0|3,0,0]=4 468 B11R1.166 CC(=O)c1ccc(nc1O)Cl AB72633 [0,1,0,0,0,0|3,0,0]=4 469 B11R1.166 CC(=O)c1ccc(nc1O)N AB84276 [0,1,0,0,0,0|2,0,0]=3 470 B11R1.166 CC(=O)c1cnc(cc1Cl)Cl AB13863 [0,1,0,0,0,0|3,0,0]=4 471 B11R1.166 CC(=O)c1cnc(cc1Cl)F AB71566 [0,1,0,0,0,0|3,0,0]=4 472 B11R1.166 CC(=O)c1cnc(cc1N)Br AB63704 [0,1,0,0,0,0|3,0,0]=4 473 B11R1.166 CC(=O)c1cnc(cc1N)Cl AB83812 [0,1,0,0,0,0|3,0,0]=4 474 B11R1.166 CC(=O)c1cnc(cc1O)Br AB72643 [0,1,0,0,0,0|3,0,0]=4 475 B11R1.166 CC(=O)c1cnc(cc1O)Cl AB84198 [0,1,0,0,0,0|3,0,0]=4 476 B11R1.166 CC(=O)c1cnc(cc1O)N AB84199 [0,1,0,0,0,0|2,0,0]=3 477 B11R1.166 CC(C)c1ccc(cc1O)N MB22522 [0,1,0,0,0,0|2,0,1]=4 478 B11R1.166 CN(C)c1ccc(cc1O)N MB24828 [0,1,0,0,0,0|3,0,0]=4 479 B11R1.166 Cc1c(ccc(n1)Br)C(=O)O AB66864 [0,1,0,0,0,0|2,0,0]=3 480 B11R1.166 Cc1c(ccc(n1)Cl)C(=O)C AB11952 [0,1,0,0,0,0|3,0,0]=4 481 B11R1.166 Cc1c(ccc(n1)Cl)C(=O)O AB53710 [0,1,0,0,0,0|2,0,0]=3 482 B11R1.166 Cc1c(ccc(n1)F)C(=O)O AB21743 [0,1,0,0,0,0|2,0,0]=3 483 B11R1.166 Cc1c(ccc(n1)N)C(=O)O AB49780 [0,1,0,0,0,0|1,0,0]=2 484 B11R1.166 Cc1c(ccc(n1)N)[N+](=O)[O-] AB02246 [0,1,0,0,0,0|2,0,1]=4 485 B11R1.166 Cc1c(ccc(n1)O)C(=O)O AB54497 [0,1,0,0,0,0|2,0,0]=3 486 B11R1.166 Cc1c(cnc(n1)C)C(=O)O AB41920 [0,1,0,0,0,0|3,0,0]=4 487 B11R1.166 Cc1c(cnc(n1)Cl)C(=O)O AB53772 [0,1,0,0,0,0|3,0,0]=4 488 B11R1.166 Cc1c(ncc(n1)Br)C(=O)O AB85708 [0,1,0,0,0,0|3,0,0]=4 489 B11R1.166 Cc1c(ncc(n1)Cl)C(=O)O AB85679 [0,1,0,0,0,0|3,0,0]=4 490 B11R1.166 Cc1cc(c(cn1)C(=O)C)Cl AB64940 [0,1,0,0,0,0|3,0,0]=4 491 B11R1.166 Cc1cc(c(cn1)C(=O)C)F AB83044 [0,1,0,0,0,0|3,0,0]=4 492 B11R1.166 Cc1cc(c(cn1)C(=O)C)N AB50225 [0,1,0,0,0,0|3,0,0]=4 493 B11R1.166 Cc1cc(c(cn1)C(=O)C)O AB75251 [0,1,0,0,0,0|3,0,0]=4 494 B11R1.166 Cc1cc(c(cn1)C(=O)O)Br AB66861 [0,1,0,0,0,0|2,0,0]=3 495 B11R1.166 Cc1cc(c(cn1)C(=O)O)Cl PB14950 [0,1,0,0,0,0|2,0,0]=3 496 B11R1.166 Cc1cc(c(cn1)C(=O)O)F AB66872 [0,1,0,0,0,0|2,0,0]=3 497 B11R1.166 Cc1cc(c(cn1)C(=O)O)N PB15110 [0,1,0,0,0,0|2,0,0]=3 498 B11R1.166 Cc1cc(c(cn1)C(=O)O)O AB17044 [0,1,0,0,0,0|2,0,0]=3 499 B11R1.166 Cc1cc(c(nc1)C(=O)C)C AB50219 [0,1,0,0,0,0|3,0,0]=4 500 B11R1.166 Cc1cc(c(nc1)C(=O)C)Cl AB75090 [0,1,0,0,0,0|3,0,0]=4 501 B11R1.166 Cc1cc(c(nc1)C(=O)C)F AB75164 [0,1,0,0,0,0|3,0,0]=4 502 B11R1.166 Cc1cc(c(nc1)C(=O)C)N AB77150 [0,1,0,0,0,0|3,0,0]=4 503 B11R1.166 Cc1cc(c(nc1)C(=O)C)O AB75244 [0,1,0,0,0,0|3,0,0]=4 504 B11R1.166 Cc1cc(c(nc1)C(=O)O)C AB53520 [0,1,0,0,0,0|2,0,0]=3 505 B11R1.166 Cc1cc(c(nc1)C(=O)O)Cl AB74925 [0,1,0,0,0,0|2,0,0]=3 506 B11R1.166 Cc1cc(c(nc1)C(=O)O)F PB30310 [0,1,0,0,0,0|2,0,0]=3 507 B11R1.166 Cc1cc(c(nc1)C(=O)O)N AB66555 [0,1,0,0,0,0|2,0,0]=3 508 B11R1.166 Cc1cc(ccc1C(=N)N)Br AB18383 [0,1,0,0,0,0|3,0,0]=4 509 B11R1.166 Cc1cc(ccc1C(=O)N)O MB23401 [0,1,0,0,0,0|2,0,0]=3 510 B11R1.166 Cc1cc(ccc1[N+](=O)[O-])Br MB00735 [0,1,0,0,0,0|2,0,1]=4 511 B11R1.166 Cc1cc(cnc1C(=O)C)Cl AB75124 [0,1,0,0,0,0|3,0,0]=4 512 B11R1.166 Cc1cc(cnc1C(=O)C)F AB74622 [0,1,0,0,0,0|3,0,0]=4 513 B11R1.166 Cc1cc(cnc1C(=O)O)Br AB41227 [0,1,0,0,0,0|2,0,0]=3 514 B11R1.166 Cc1cc(cnc1C(=O)O)Cl AB41233 [0,1,0,0,0,0|2,0,0]=3 515 B11R1.166 Cc1cc(cnc1C(=O)O)F AB74795 [0,1,0,0,0,0|2,0,0]=3 516 B11R1.166 Cc1cc(cnc1C(=O)O)N AB41220 [0,1,0,0,0,0|1,0,0]=2 517 B11R1.166 Cc1cc(ncc1C(=O)C)C AB50221 [0,1,0,0,0,0|3,0,0]=4 518 B11R1.166 Cc1cc(ncc1C(=O)C)Cl AB83349 [0,1,0,0,0,0|3,0,0]=4 519 B11R1.166 Cc1cc(ncc1C(=O)C)F AB83065 [0,1,0,0,0,0|3,0,0]=4 520 B11R1.166 Cc1cc(ncc1C(=O)O)Br AB67818 [0,1,0,0,0,0|2,0,0]=3 521 B11R1.166 Cc1cc(ncc1C(=O)O)C AB05232 [0,1,0,0,0,0|2,0,0]=3 522 B11R1.166 Cc1cc(ncc1C(=O)O)Cl AB65755 [0,1,0,0,0,0|2,0,0]=3 523 B11R1.166 Cc1cc(ncc1C(=O)O)F AB49982 [0,1,0,0,0,0|2,0,0]=3 524 B11R1.166 Cc1cc(ncc1C(=O)O)N AB53293 [0,1,0,0,0,0|1,0,0]=2 525 B11R1.166 Cc1cc(ncc1C(=O)O)O AB65757 [0,1,0,0,0,0|2,0,0]=3 526 B11R1.166 Cc1cc(ncc1[N+](=O)[O-])N CB10077 [0,1,0,0,0,0|2,0,1]=4 527 B11R1.166 Cc1ccc(c(c1)C)C(=N)N AB18393 [0,1,0,0,0,0|3,0,0]=4 528 B11R1.166 Cc1ccc(c(c1)Cl)C(=N)N AB18279 [0,1,0,0,0,0|3,0,0]=4 529 B11R1.166 Cc1ccc(c(c1)O)C(=O)N MB02488 [0,1,0,0,0,0|2,0,0]=3 530 B11R1.166 Cc1ccc(c(n1)Br)C(=O)O AB68156 [0,1,0,0,0,0|2,0,0]=3 531 B11R1.166 Cc1ccc(c(n1)C)C(=O)O AB27627 [0,1,0,0,0,0|2,0,0]=3 532 B11R1.166 Cc1ccc(c(n1)Cl)C(=O)C AB64666 [0,1,0,0,0,0|3,0,0]=4 533 B11R1.166 Cc1ccc(c(n1)Cl)C(=O)O PB24611 [0,1,0,0,0,0|2,0,0]=3 534 B11R1.166 Cc1ccc(c(n1)N)C(=O)C AB83843 [0,1,0,0,0,0|3,0,0]=4 535 B11R1.166 Cc1ccc(c(n1)N)C(=O)O PB33689 [0,1,0,0,0,0|2,0,0]=3 536 B11R1.166 Cc1ccc(c(n1)O)C(=O)C AB84278 [0,1,0,0,0,0|3,0,0]=4 537 B11R1.166 Cc1cnc(c(n1)C)C(=O)O AB71826 [0,1,0,0,0,0|3,0,0]=4 538 B11R1.166 Cc1cnc(c(n1)O)C(=O)O AB48562 [0,1,0,0,0,0|3,0,0]=4 539 B11R1.166 Cc1ncc(c(n1)Cl)C(=O)O AB56016 [0,1,0,0,0,0|3,0,0]=4 540 B11R1.166 Cc1ncc(c(n1)N)C(=O)O AB04459 [0,1,0,0,0,0|3,0,0]=4 541 B11R1.166 Cc1ncc(c(n1)O)C(=O)O AB48543 [0,1,0,0,0,0|3,0,0]=4 542 B11R1.166 c1c(c(cnc1Br)C(=O)O)Cl AB67976 [0,1,0,0,0,0|2,0,0]=3 543 B11R1.166 c1c(c(cnc1Br)C(=O)O)F AB68043 [0,1,0,0,0,0|2,0,0]=3 544 B11R1.166 c1c(c(cnc1Br)C(=O)O)N AB67268 [0,1,0,0,0,0|2,0,0]=3 545 B11R1.166 c1c(c(cnc1Br)C(=O)O)O AB72394 [0,1,0,0,0,0|2,0,0]=3 546 B11R1.166 c1c(c(cnc1Cl)C(=O)O)Cl AB05151 [0,1,0,0,0,0|2,0,0]=3 547 B11R1.166 c1c(c(cnc1Cl)C(=O)O)F AB68037 [0,1,0,0,0,0|2,0,0]=3 548 B11R1.166 c1c(c(cnc1Cl)C(=O)O)N PB12156 [0,1,0,0,0,0|2,0,0]=3 549 B11R1.166 c1c(c(cnc1Cl)C(=O)O)O AB69324 [0,1,0,0,0,0|2,0,0]=3 550 B11R1.166 c1c(c(cnc1F)C(=O)O)Cl AB74908 [0,1,0,0,0,0|2,0,0]=3 551 B11R1.166 c1c(c(cnc1F)C(=O)O)F AB49331 [0,1,0,0,0,0|2,0,0]=3 552 B11R1.166 c1c(c(cnc1F)C(=O)O)N PB19556 [0,1,0,0,0,0|2,0,0]=3 553 B11R1.166 c1c(c(cnc1N)C(=O)O)Cl AB67979 [0,1,0,0,0,0|1,0,0]=2 554 B11R1.166 c1c(c(cnc1N)C(=O)O)N AB71881 [0,1,0,0,0,0|1,0,0]=2 555 B11R1.166 c1c(c(cnc1N)[N+](=O)[O-])Br PB18120 [0,1,0,0,0,0|2,0,1]=4 556 B11R1.166 c1c(c(cnc1N)[N+](=O)[O-])Cl PB12821 [0,1,0,0,0,0|2,0,1]=4 557 B11R1.166 c1c(c(cnc1O)C(=O)O)Cl AB67983 [0,1,0,0,0,0|2,0,0]=3 558 B11R1.166 c1c(c(nc(n1)Cl)Cl)C(=O)O AB55826 [0,1,0,0,0,0|3,0,0]=4 559 B11R1.166 c1c(cnc(c1Br)C(=O)O)Br AB25162 [0,1,0,0,0,0|2,0,0]=3 560 B11R1.166 c1c(cnc(c1Cl)C(=O)O)Cl AB13812 [0,1,0,0,0,0|2,0,0]=3 561 B11R1.166 c1c(cnc(c1Cl)C(=O)O)F AB66800 [0,1,0,0,0,0|2,0,0]=3 562 B11R1.166 c1c(cnc(c1Cl)C(=O)O)N AB73535 [0,1,0,0,0,0|1,0,0]=2 563 B11R1.166 c1c(cnc(c1F)C(=O)N)Br AB65704 [0,1,0,0,0,0|3,0,0]=4 564 B11R1.166 c1c(cnc(c1F)C(=O)O)Br PB15891 [0,1,0,0,0,0|2,0,0]=3 565 B11R1.166 c1c(cnc(c1F)C(=O)O)Cl AB66361 [0,1,0,0,0,0|2,0,0]=3 566 B11R1.166 c1c(cnc(c1F)C(=O)O)N AB73541 [0,1,0,0,0,0|1,0,0]=2 567 B11R1.166 c1c(cnc(c1N)C(=O)N)Br PB28226 [0,1,0,0,0,0|3,0,0]=4 568 B11R1.166 c1c(cnc(c1N)C(=O)O)Br PB25268 [0,1,0,0,0,0|2,0,0]=3 569 B11R1.166 c1c(cnc(c1N)C(=O)O)Cl PB13238 [0,1,0,0,0,0|2,0,0]=3 570 B11R1.166 c1c(cnc(c1N)C(=O)O)Cl PB25748 [0,1,0,0,0,0|2,0,0]=3 571 B11R1.166 c1c(cnc(c1N)C(=O)O)N AB83569 [0,1,0,0,0,0|1,0,0]=2 572 B11R1.166 c1c(nc(c(n1)C(=O)O)Cl)Cl PB29742 [0,1,0,0,0,0|3,0,0]=4 573 B11R1.166 c1c(nc(c(n1)C(=O)O)N)Cl AB73168 [0,1,0,0,0,0|3,0,0]=4 574 B11R1.166 c1cc(c(cc1Br)Br)C(=O)O AB05197 [0,1,0,0,0,0|1,0,0]=2 575 B11R1.166 c1cc(c(cc1Br)F)C(=N)N AB18335 [0,1,0,0,0,0|3,0,0]=4 576 B11R1.166 c1cc(c(cc1Br)F)C(=O)O AB03858 [0,1,0,0,0,0|1,0,0]=2 577 B11R1.166 c1cc(c(cc1Br)F)[N+](=O)[O-] AB10547 [0,1,0,0,0,0|2,0,1]=4 578 B11R1.166 c1cc(c(cc1Br)N)C(=O)N AB65645 [0,1,0,0,0,0|2,0,0]=3 579 B11R1.166 c1cc(c(cc1Br)N)C(=O)O MB02895 [0,1,0,0,0,0|1,0,0]=2 580 B11R1.166 c1cc(c(cc1Br)N)[N+](=O)[O-] MB07034 [0,1,0,0,0,0|2,0,1]=4 581 B11R1.166 c1cc(c(cc1Br)O)C(=O)N MB04760 [0,1,0,0,0,0|2,0,0]=3 582 B11R1.166 c1cc(c(cc1Br)O)[N+](=O)[O-] MB02640 [0,1,0,0,0,0|2,0,1]=4 583 B11R1.166 c1cc(c(cc1Cl)Cl)C(=N)N AB18390 [0,1,0,0,0,0|3,0,0]=4 584 B11R1.166 c1cc(c(cc1Cl)F)C(=N)N AB18342 [0,1,0,0,0,0|3,0,0]=4 585 B11R1.166 c1cc(c(cc1Cl)O)C(=O)N MB09408 [0,1,0,0,0,0|2,0,0]=3 586 B11R1.166 c1cc(c(cc1F)Br)C(=O)O AB02279 [0,1,0,0,0,0|1,0,0]=2 587 B11R1.166 c1cc(c(cc1F)Cl)C(=N)N AB18354 [0,1,0,0,0,0|3,0,0]=4 588 B11R1.166 c1cc(c(cc1F)F)C(=N)N AB18346 [0,1,0,0,0,0|3,0,0]=4 589 B11R1.166 c1cc(c(cc1F)F)C(=O)O AB01069 [0,1,0,0,0,0|1,0,0]=2 590 B11R1.166 c1cc(c(cc1F)O)C(=O)N MB25529 [0,1,0,0,0,0|2,0,0]=3 591 B11R1.166 c1cc(c(cc1F)O)[N+](=O)[O-] AB00840 [0,1,0,0,0,0|2,0,1]=4 592 B11R1.166 c1cc(c(cc1I)O)C(=O)N MB37556 [0,1,0,0,0,0|2,0,0]=3 593 B11R1.166 c1cc(c(cc1N)O)C(=O)N MB25620 [0,1,0,0,0,0|1,0,0]=2 594 B11R1.166 c1cc(c(cc1O)Br)C(=O)O MB28859 [0,1,0,0,0,0|1,0,0]=2 595 B11R1.166 c1cc(c(cc1O)Br)[N+](=O)[O-] MB08147 [0,1,0,0,0,0|2,0,1]=4 596 B11R1.166 c1cc(c(cc1O)Cl)C(=O)N MB04155 [0,1,0,0,0,0|2,0,0]=3 597 B11R1.166 c1cc(c(cc1O)Cl)[N+](=O)[O-] MB01255 [0,1,0,0,0,0|2,0,1]=4 598 B11R1.166 c1cc(c(cc1O)F)C(=O)N MB08417 [0,1,0,0,0,0|2,0,0]=3 599 B11R1.166 c1cc(c(cc1O)F)[N+](=O)[O-] AB01868 [0,1,0,0,0,0|2,0,1]=4 600 B11R1.166 c1cc(c(cc1O)I)C(=O)N MB32997 [0,1,0,0,0,0|2,0,0]=3 601 B11R1.166 c1cc(c(cc1O)I)C(=O)O MB31618 [0,1,0,0,0,0|1,0,0]=2 602 B11R1.166 c1cc(c(cc1O)N)C(=O)N MB00909 [0,1,0,0,0,0|2,0,0]=3 603 B11R1.166 c1cc(c(cc1O)N)C(=O)O MB00542 [0,1,0,0,0,0|1,0,0]=2 604 B11R1.166 c1cc(nc(c1C(=O)N)N)Cl AB65210 [0,1,0,0,0,0|3,0,0]=4 605 B11R1.166 c1cc(nc(c1C(=O)O)Br)Br PB17862 [0,1,0,0,0,0|2,0,0]=3 606 B11R1.166 c1cc(nc(c1C(=O)O)Br)Cl AB66786 [0,1,0,0,0,0|2,0,0]=3 607 B11R1.166 c1cc(nc(c1C(=O)O)Cl)Br AB64863 [0,1,0,0,0,0|2,0,0]=3 608 B11R1.166 c1cc(nc(c1C(=O)O)Cl)Cl PB10074 [0,1,0,0,0,0|2,0,0]=3 609 B11R1.166 c1cc(nc(c1C(=O)O)Cl)N AB53397 [0,1,0,0,0,0|1,0,0]=2 610 B11R1.166 c1cc(nc(c1C(=O)O)F)F AB43522 [0,1,0,0,0,0|2,0,0]=3 611 B11R1.166 c1cc(nc(c1C(=O)O)F)N AB76881 [0,1,0,0,0,0|1,0,0]=2 612 B11R1.166 c1cc(nc(c1C(=O)O)N)Br AB69713 [0,1,0,0,0,0|2,0,0]=3 613 B11R1.166 c1cc(nc(c1C(=O)O)N)Cl PB26608 [0,1,0,0,0,0|2,0,0]=3 614 B11R1.166 c1cc(nc(c1C(=O)O)N)N AB67450 [0,1,0,0,0,0|1,0,0]=2 615 B9R1.35 C1=C(N=CC1N)C(=O)O AB43641 [0,0,0,0,1,0|1,0,1]=3 616 B9R1.35 C1=C(N=NC1C(=O)O)N AB09167 [0,0,0,0,1,0|2,0,1]=4 617 B9R1.35 C1=NC(=NC1N)C(=O)O AB07902 [0,0,0,0,1,0|2,0,1]=4 618 B9R1.35 C1=NC(=O)N=C1C(=O)O AB09197 [0,0,0,0,1,0|3,0,0]=4 619 B9R1.35 C1C=C(N=C1Br)C(=O)O MB19809 [0,0,0,0,1,0|2,0,1]=4 620 B9R1.35 C1CC(=O)C=C1C(=O)O CB11482 [0,0,0,0,1,0|1,0,2]=4 621 B9R1.35 C1[C@@H](C=C[C@@H]1N)C(=O)O MB00931 [0,0,0,0,1,0|0,0,3]=4 622 B9R1.35 CC(=O)c1cc(cs1)Cl PB13009 [0,0,0,0,1,0|3,0,0]=4 623 B9R1.35 CC(=O)c1cc(sc1)Br AB71462 [0,0,0,0,1,0|3,0,0]=4 624 B9R1.35 CC(=O)c1cc(sc1)Cl PB18443 [0,0,0,0,1,0|3,0,0]=4 625 B9R1.35 CC(=O)c1ccc(o1)Br AB25597 [0,0,0,0,1,0|3,0,0]=4 626 B9R1.35 CC(=O)c1ccc(s1)Br PB24550 [0,0,0,0,1,0|3,0,0]=4 627 B9R1.35 CC(=O)c1ccc(s1)Cl PB11578 [0,0,0,0,1,0|3,0,0]=4 628 B9R1.35 CC(=O)c1cnc(o1)N AB54806 [0,0,0,0,1,0|3,0,0]=4 629 B9R1.35 CC(=O)c1cnc(s1)N AB07075 [0,0,0,0,1,0|3,0,0]=4 630 B9R1.35 Cc1[nH]c(cn1)C(=O)O AB05025 [0,0,0,0,1,0|3,0,0]=4 631 B9R1.35 Cc1cc(cs1)C(=O)O PB14265 [0,0,0,0,1,0|2,0,0]=3 632 B9R1.35 Cc1cc(no1)C(=O)O CB10494 [0,0,0,0,1,0|3,0,0]=4 633 B9R1.35 Cc1cc(sc1)C(=O)O PB14117 [0,0,0,0,1,0|2,0,0]=3 634 B9R1.35 Cc1ccc(s1)C(=O)C AB01148 [0,0,0,0,1,0|3,0,0]=4 635 B9R1.35 Cc1ccc(s1)C(=O)O AB00425 [0,0,0,0,1,0|2,0,0]=3 636 B9R1.35 Cc1cnc(o1)C(=O)O AB53258 [0,0,0,0,1,0|3,0,0]=4 637 B9R1.35 Cc1cnc(s1)C(=O)O AB43204 [0,0,0,0,1,0|3,0,0]=4 638 B9R1.35 Cc1coc(n1)C(=O)O PB31618 [0,0,0,0,1,0|3,0,0]=4 639 B9R1.35 Cc1csc(n1)C(=O)O PB26270 [0,0,0,0,1,0|3,0,0]=4 640 B9R1.35 Cc1nc(co1)C(=O)O AB05124 [0,0,0,0,1,0|3,0,0]=4 641 B9R1.35 Cc1nc(cs1)C(=O)O AB14027 [0,0,0,0,1,0|3,0,0]=4 642 B9R1.35 Cc1ncc(s1)C(=O)O PB12949 [0,0,0,0,1,0|3,0,0]=4 643 B9R1.35 Cn1cc(cn1)C(=O)O PB27447 [0,0,0,0,1,0|3,0,0]=4 644 B9R1.35 Cn1cc(nc1)C(=O)O PB21172 [0,0,0,0,1,0|3,0,0]=4 645 B9R1.35 Cn1ccc(n1)C(=O)O PB29090 [0,0,0,0,1,0|3,0,0]=4 646 B9R1.35 c1c(coc1Br)C(=O)O AB45895 [0,0,0,0,1,0|2,0,0]=3 647 B9R1.35 c1c(coc1C(=O)N)Br AB65725 [0,0,0,0,1,0|3,0,0]=4 648 B9R1.35 c1c(coc1C(=O)O)Br AB03318 [0,0,0,0,1,0|2,0,0]=3 649 B9R1.35 c1c(csc1Br)C(=O)O PB20302 [0,0,0,0,1,0|2,0,0]=3 650 B9R1.35 c1c(csc1C(=O)N)Br AB53759 [0,0,0,0,1,0|3,0,0]=4 651 B9R1.35 c1c(csc1C(=O)O)Br PB29256 [0,0,0,0,1,0|2,0,0]=3 652 B9R1.35 c1c(csc1C(=O)O)Cl PB25964 [0,0,0,0,1,0|2,0,0]=3 653 B9R1.35 c1c(csc1Cl)C(=O)N AB09992 [0,0,0,0,1,0|3,0,0]=4 654 B9R1.35 c1c(csc1Cl)C(=O)O PB17106 [0,0,0,0,1,0|2,0,0]=3 655 B9R1.35 c1c(csc1F)C(=O)O PB18609 [0,0,0,0,1,0|2,0,0]=3 656 B9R1.35 c1c(nc(o1)Br)C(=O)O PB14959 [0,0,0,0,1,0|3,0,0]=4 657 B9R1.35 c1c(nc(o1)C(=O)O)Br AB59761 [0,0,0,0,1,0|3,0,0]=4 658 B9R1.35 c1c(nc(o1)Cl)C(=O)O PB20528 [0,0,0,0,1,0|3,0,0]=4 659 B9R1.35 c1c(nc(o1)N)C(=O)O PB31410 [0,0,0,0,1,0|2,0,0]=3 660 B9R1.35 c1c(nc(s1)Br)C(=O)O AB20482 [0,0,0,0,1,0|3,0,0]=4 661 B9R1.35 c1c(nc(s1)C(=O)O)Br PB32743 [0,0,0,0,1,0|3,0,0]=4 662 B9R1.35 c1c(nc(s1)Cl)C(=O)O CB11341 [0,0,0,0,1,0|3,0,0]=4 663 B9R1.35 c1c(nc(s1)N)C(=O)O AB07466 [0,0,0,0,1,0|2,0,0]=3 664 B9R1.35 c1c(onc1Br)C(=O)O AB32047 [0,0,0,0,1,0|3,0,0]=4 665 B9R1.35 c1c(sc(n1)Br)C(=O)O PB12322 [0,0,0,0,1,0|3,0,0]=4 666 B9R1.35 c1c(sc(n1)C(=O)O)Br PB31583 [0,0,0,0,1,0|3,0,0]=4 667 B9R1.35 c1c(sc(n1)C(=O)O)Cl PB26550 [0,0,0,0,1,0|3,0,0]=4 668 B9R1.35 c1c(sc(n1)C(=O)O)N PB33442 [0,0,0,0,1,0|2,0,0]=3 669 B9R1.35 c1c(sc(n1)C(=O)O)N PB37974 [0,0,0,0,1,0|2,0,0]=3 670 B9R1.35 c1c(sc(n1)N)C(=O)O AB23200 [0,0,0,0,1,0|2,0,0]=3 671 B9R1.35 c1cc(sc1C(=O)Cl)Cl AB01959 [0,0,0,0,1,0|3,0,0]=4 672 B9R1.35 c1cc(sc1C(=O)O)Br PB21666 [0,0,0,0,1,0|2,0,0]=3 673 B9R1.35 c1cc(sc1C(=O)O)Cl PB12047 [0,0,0,0,1,0|2,0,0]=3 674 B9R1.35 c1cc(sc1C(=O)O)F PB22097 [0,0,0,0,1,0|2,0,0]=3 675 B9R1.35 c1cc(sc1C(=O)O)N MB07244 [0,0,0,0,1,0|1,0,0]=2 676 B11R1.20 CC(=O)Nc1ccc(cn1)I AB08522 [0,0,0,0,0,1|3,0,0]=4 677 B11R1.20 CC(=O)Nc1ccc(cn1)N AB04216 [0,0,0,0,0,1|2,0,0]=3 678 B11R1.20 CC(=O)Nc1ccc(nc1)Br AB30811 [0,0,0,0,0,1|3,0,0]=4 679 B11R1.20 CC(=O)Oc1ccc(cc1)Cl AB06566 [0,0,0,0,0,1|2,0,0]=3 680 B11R1.20 CN(C)Cc1ccc(cc1)N AB01571 [0,0,0,0,0,1|3,0,0]=4 681 B11R1.20 Cc1ccc(cc1)CC(=N)N AB29086 [0,0,0,0,0,1|3,0,0]=4 682 B11R1.20 Cc1ccc(cn1)CC(=O)O AB04515 [0,0,0,0,0,1|2,0,0]=3 683 B11R1.20 Cc1ccc(nc1)CC(=O)O AB55198 [0,0,0,0,0,1|2,0,0]=3 684 B11R1.20 Cc1cnc(cn1)CC(=O)O AB69910 [0,0,0,0,0,1|3,0,0]=4 685 B11R1.20 c1c(cnc(n1)CC(=O)O)Br PB16211 [0,0,0,0,0,1|3,0,0]=4 686 B11R1.20 c1c(cnc(n1)CC(=O)O)Cl AB59161 [0,0,0,0,0,1|3,0,0]=4 687 B11R1.20 c1c(cnc(n1)CC(=O)O)F AB68737 [0,0,0,0,0,1|3,0,0]=4 688 B11R1.20 c1c(ncc(n1)Cl)CC(=O)O AB69911 [0,0,0,0,0,1|3,0,0]=4 689 B11R1.20 c1cc(ccc1CC(=N)N)Br AB48908 [0,0,0,0,0,1|3,0,0]=4 690 B11R1.20 c1cc(ccc1CC(=N)N)Cl AB29080 [0,0,0,0,0,1|3,0,0]=4 691 B11R1.20 c1cc(ccc1CC(=N)N)F AB29082 [0,0,0,0,0,1|3,0,0]=4 692 B11R1.20 c1cc(ccc1CC(=O)O)Br AB00367 [0,0,0,0,0,1|1,0,0]=2 693 B11R1.20 c1cc(ccc1N=C(N)N)Cl AB04678 [0,0,0,0,0,1|3,0,0]=4 694 B11R1.20 c1cc(ncc1Br)CC(=O)O PB31471 [0,0,0,0,0,1|2,0,0]=3 695 B11R1.20 c1cc(ncc1CC(=O)O)Br AB71018 [0,0,0,0,0,1|2,0,0]=3 696 B11R1.20 c1cc(ncc1CC(=O)O)Cl AB10318 [0,0,0,0,0,1|2,0,0]=3 697 B11R1.20 c1cc(ncc1CC(=O)O)F AB55206 [0,0,0,0,0,1|2,0,0]=3 698 B11R1.20 c1cc(ncc1F)CC(=O)O AB55200 [0,0,0,0,0,1|2,0,0]=3 699 B11R1.20 c1cc(ncc1I)CC(=O)O PB21451 [0,0,0,0,0,1|2,0,0]=3 700 B11R1.20 c1cc(ncc1N)NC(=N)N AB31874 [0,0,0,0,0,1|3,0,0]=4 701 B8R1.2 c1c(cncn1)C=O PB32342 [2,0,0,0,0,0|2,0,0]=4 702 B8R1.2 c1cc(cnc1)C=O AB00744 [2,0,0,0,0,0|1,0,0]=3 703 B8R1.2 c1cc(nnc1)C=O PB20119 [2,0,0,0,0,0|2,0,0]=4 704 B8R1.2 c1ccnc(c1)C=O AB00680 [2,0,0,0,0,0|1,0,0]=3 705 B8R1.2 c1cnc(cn1)C=O PB19982 [2,0,0,0,0,0|2,0,0]=4 706 B8R1.2 c1cnc(nc1)C=O PB34235 [2,0,0,0,0,0|2,0,0]=4 707 B8R1.2 c1cnccc1C=O AB00754 [2,0,0,0,0,0|1,0,0]=3 708 B8R1.2 c1cncnc1C=O AB16150 [2,0,0,0,0,0|2,0,0]=4 709 B8R1.2 c1cnncc1C=O PB17346 [2,0,0,0,0,0|2,0,0]=4 710 B8R1.3 Cc1ccc(cn1)N PB32227 [2,0,0,0,0,0|1,0,1]=4 711 B8R1.3 Cc1ccc(cn1)O PB30543 [2,0,0,0,0,0|2,0,0]=4 712 B8R1.3 Cc1ccc(nc1)N AB17938 [2,0,0,0,0,0|1,0,1]=4 713 B8R1.3 Cc1ccc(nc1)O AB13138 [2,0,0,0,0,0|2,0,0]=4 714 B8R1.3 c1c(cnc(n1)N)O PB32565 [2,0,0,0,0,0|2,0,0]=4 715 B8R1.3 c1cc(ncc1Br)N PB30536 [2,0,0,0,0,0|2,0,0]=4 716 B8R1.3 c1cc(ncc1Br)O AB05097 [2,0,0,0,0,0|2,0,0]=4 717 B8R1.3 c1cc(ncc1Cl)N AB00712 [2,0,0,0,0,0|2,0,0]=4 718 B8R1.3 c1cc(ncc1F)N AB10107 [2,0,0,0,0,0|2,0,0]=4 719 B8R1.3 c1cc(ncc1I)N PB25985 [2,0,0,0,0,0|2,0,0]=4 720 B8R1.3 c1cc(ncc1I)O AB05112 [2,0,0,0,0,0|2,0,0]=4 721 B8R1.3 c1cc(ncc1N)Br PB17224 [2,0,0,0,0,0|2,0,0]=4 722 B8R1.3 c1cc(ncc1N)Cl AB00661 [2,0,0,0,0,0|2,0,0]=4 723 B8R1.3 c1cc(ncc1N)F PB33962 [2,0,0,0,0,0|2,0,0]=4 724 B8R1.3 c1cc(ncc1N)O AB15078 [2,0,0,0,0,0|1,0,0]=3 725 B8R1.3 c1cc(ncc1O)Br PB15771 [2,0,0,0,0,0|2,0,0]=4 726 B8R1.3 c1cc(ncc1O)Cl PB32188 [2,0,0,0,0,0|2,0,0]=4 727 B8R1.3 c1cc(ncc1O)F AB08123 [2,0,0,0,0,0|2,0,0]=4 728 B8R1.3 c1cc(ncc1O)I AB50021 [2,0,0,0,0,0|2,0,0]=4 729 B8R1.3 c1cc(ncc1O)N AB15563 [2,0,0,0,0,0|1,0,0]=3 730 B10R1.1 Cc1ccc(cc1)CC=O AB02059 [1,1,0,0,0,0|1,0,0]=3 731 B10R1.1 Cc1ccc(cc1)\C=C\Br AB73509 [1,1,0,0,0,0|2,0,0]=4 732 B10R1.1 Cc1ccc(nc1)\C=N\O AB72002 [1,1,0,0,0,0|2,0,0]=4 733 B10R1.1 c1cc(ccc1CC=O)Br AB11790 [1,1,0,0,0,0|1,0,0]=3 734 B10R1.1 c1cc(ccc1CC=O)Cl AB11793 [1,1,0,0,0,0|1,0,0]=3 735 B10R1.1 c1cc(ccc1CC=O)F AB11805 [1,1,0,0,0,0|1,0,0]=3 736 B10R1.1 c1cc(ccc1CC=O)N AB27688 [1,1,0,0,0,0|0,0,0]=2 737 B10R1.1 c1cc(ccc1CCBr)N MB02970 [1,1,0,0,0,0|1,0,1]=4 738 B10R1.1 c1cc(ccc1CCN)N AB00936 [1,1,0,0,0,0|1,0,1]=4 739 B10R1.1 c1cc(ccc1CCO)Br AB00280 [1,1,0,0,0,0|1,0,1]=4 740 B10R1.1 c1cc(ccc1\C=C\Br)Br AB32162 [1,1,0,0,0,0|2,0,0]=4 741 B10R1.1 c1cc(ccc1\C=C\Br)Cl AB32165 [1,1,0,0,0,0|2,0,0]=4 742 B10R1.1 c1cc(ccc1\C=C\Br)F AB66443 [1,1,0,0,0,0|2,0,0]=4 743 B10R1.1 c1cc(ccc1\C=N\O)Br AB06151 [1,1,0,0,0,0|1,0,0]=3 744 B10R1.3 C#Cc1ccc(cc1)C=O AB22364 [1,1,0,0,0,0|1,0,0]=3 745 B10R1.3 CCc1ccc(cc1)NN AB10141 [1,1,0,0,0,0|1,0,1]=4 746 B10R1.3 CNc1ncc(cn1)C=O AB30585 [1,1,0,0,0,0|2,0,0]=4 747 B10R1.3 COc1ccc(cc1)NN AB11940 [1,1,0,0,0,0|2,0,0]=4 748 B10R1.3 COc1ccc(nc1)C=O PB17495 [1,1,0,0,0,0|2,0,0]=4 749 B10R1.3 CSc1ccc(cc1)CO AB00982 [1,1,0,0,0,0|1,0,1]=4 750 B10R1.3 c1c(cnc(n1)CN)C=O AB63214 [1,1,0,0,0,0|2,0,0]=4 751 B10R1.3 c1cc(ccc1C#N)NN AB06913 [1,1,0,0,0,0|1,0,1]=4 752 B10R1.3 c1cc(ccc1CN)CO AB23442 [1,1,0,0,0,0|0,0,1]=3 753 B10R1.3 c1cc(ncc1C#N)C=O AB67705 [1,1,0,0,0,0|1,0,1]=4 754 B10R1.3 c1cc(ncc1C=O)C#N AB66011 [1,1,0,0,0,0|1,0,1]=4 755 B10R1.3 c1cc(ncc1C=O)CCl AB69673 [1,1,0,0,0,0|2,0,0]=4 756 B10R1.3 c1cc(ncc1CCl)C=O AB59921 [1,1,0,0,0,0|2,0,0]=4 757 B10R1.3 c1cc(ncc1CO)CN AB63417 [1,1,0,0,0,0|1,0,1]=4 758 B10R1.25 CCc1ccc(cc1O)N MB23852 [1,1,0,0,0,0|1,0,1]=4 759 B10R1.25 CNc1ccc(cc1O)N MB33015 [1,1,0,0,0,0|2,0,0]=4 760 B10R1.25 CSc1ccc(cc1O)N MB36502 [1,1,0,0,0,0|2,0,0]=4 761 B10R1.25 Cc1c(ccc(n1)Br)C=O AB66856 [1,1,0,0,0,0|2,0,0]=4 762 B10R1.25 Cc1c(ccc(n1)Cl)C=O AB32133 [1,1,0,0,0,0|2,0,0]=4 763 B10R1.25 Cc1cc(c(cn1)C=O)Br AB66855 [1,1,0,0,0,0|2,0,0]=4 764 B10R1.25 Cc1cc(c(cn1)C=O)Cl AB66849 [1,1,0,0,0,0|2,0,0]=4 765 B10R1.25 Cc1cc(c(cn1)C=O)F AB75172 [1,1,0,0,0,0|2,0,0]=4 766 B10R1.25 Cc1cc(c(cn1)C=O)N AB83689 [1,1,0,0,0,0|2,0,0]=4 767 B10R1.25 Cc1cc(c(cn1)C=O)O AB75249 [1,1,0,0,0,0|2,0,0]=4 768 B10R1.25 Cc1cc(c(nc1)C=O)C AB53525 [1,1,0,0,0,0|2,0,0]=4 769 B10R1.25 Cc1cc(c(nc1)C=O)Cl AB75087 [1,1,0,0,0,0|2,0,0]=4 770 B10R1.25 Cc1cc(c(nc1)C=O)F AB75163 [1,1,0,0,0,0|2,0,0]=4 771 B10R1.25 Cc1cc(c(nc1)C=O)N AB83746 [1,1,0,0,0,0|2,0,0]=4 772 B10R1.25 Cc1cc(c(nc1)C=O)O AB75242 [1,1,0,0,0,0|2,0,0]=4 773 B10R1.25 Cc1cc(cnc1C=O)Br AB42359 [1,1,0,0,0,0|2,0,0]=4 774 B10R1.25 Cc1cc(cnc1C=O)Cl AB75118 [1,1,0,0,0,0|2,0,0]=4 775 B10R1.25 Cc1cc(cnc1C=O)F AB74798 [1,1,0,0,0,0|2,0,0]=4 776 B10R1.25 Cc1cc(ncc1C=O)Br AB67814 [1,1,0,0,0,0|2,0,0]=4 777 B10R1.25 Cc1cc(ncc1C=O)C AB74124 [1,1,0,0,0,0|2,0,0]=4 778 B10R1.25 Cc1cc(ncc1C=O)Cl AB32140 [1,1,0,0,0,0|2,0,0]=4 779 B10R1.25 Cc1cc(ncc1C=O)F AB75824 [1,1,0,0,0,0|2,0,0]=4 780 B10R1.25 Cc1ccc(c(c1)N)C=O AB58436 [1,1,0,0,0,0|1,0,0]=3 781 B10R1.25 Cc1ccc(c(n1)Br)C=O AB55809 [1,1,0,0,0,0|2,0,0]=4 782 B10R1.25 Cc1ccc(c(n1)C)C=O AB13970 [1,1,0,0,0,0|2,0,0]=4 783 B10R1.25 Cc1ccc(c(n1)Cl)C=O AB32135 [1,1,0,0,0,0|2,0,0]=4 784 B10R1.25 Cc1ccc(c(n1)N)C=O AB27631 [1,1,0,0,0,0|2,0,0]=4 785 B10R1.25 Cc1ccc(c(n1)O)C=O AB42321 [1,1,0,0,0,0|2,0,0]=4 786 B10R1.25 c1c(c(cnc1Br)C=O)Cl AB67260 [1,1,0,0,0,0|2,0,0]=4 787 B10R1.25 c1c(c(cnc1Br)C=O)F AB68032 [1,1,0,0,0,0|2,0,0]=4 788 B10R1.25 c1c(c(cnc1Br)C=O)N AB68108 [1,1,0,0,0,0|2,0,0]=4 789 B10R1.25 c1c(c(cnc1Br)C=O)O AB72645 [1,1,0,0,0,0|2,0,0]=4 790 B10R1.25 c1c(c(cnc1Cl)C=O)Br AB67955 [1,1,0,0,0,0|2,0,0]=4 791 B10R1.25 c1c(c(cnc1Cl)C=O)Cl PB13495 [1,1,0,0,0,0|2,0,0]=4 792 B10R1.25 c1c(c(cnc1Cl)C=O)F AB68027 [1,1,0,0,0,0|2,0,0]=4 793 B10R1.25 c1c(c(cnc1Cl)C=O)N AB52769 [1,1,0,0,0,0|2,0,0]=4 794 B10R1.25 c1c(c(cnc1Cl)C=O)O AB69327 [1,1,0,0,0,0|2,0,0]=4 795 B10R1.25 c1c(c(cnc1F)C=O)Cl AB75063 [1,1,0,0,0,0|2,0,0]=4 796 B10R1.25 c1c(c(cnc1N)C=O)Cl AB71947 [1,1,0,0,0,0|1,0,0]=3 797 B10R1.25 c1c(c(cnc1N)C=O)N AB43397 [1,1,0,0,0,0|1,0,0]=3 798 B10R1.25 c1c(c(cnc1N)C=O)O AB84438 [1,1,0,0,0,0|1,0,0]=3 799 B10R1.25 c1c(c(cnc1O)C=O)O AB69704 [1,1,0,0,0,0|2,0,0]=4 800 B10R1.25 c1c(c(nc(n1)N)Cl)C=O AB55843 [1,1,0,0,0,0|2,0,0]=4 801 B10R1.25 c1c(c(nc(n1)N)N)C=O AB21344 [1,1,0,0,0,0|2,0,0]=4 802 B10R1.25 c1c(cnc(c1Br)C=O)Br AB48580 [1,1,0,0,0,0|2,0,0]=4 803 B10R1.25 c1c(cnc(c1Cl)C=O)F AB70954 [1,1,0,0,0,0|2,0,0]=4 804 B10R1.25 c1c(cnc(c1F)C=O)Br PB11091 [1,1,0,0,0,0|2,0,0]=4 805 B10R1.25 c1c(cnc(c1F)C=O)Cl AB70957 [1,1,0,0,0,0|2,0,0]=4 806 B10R1.25 c1c(cnc(c1N)C=O)Br AB83734 [1,1,0,0,0,0|2,0,0]=4 807 B10R1.25 c1c(cnc(c1N)C=O)Cl AB83735 [1,1,0,0,0,0|2,0,0]=4 808 B10R1.25 c1c(cnc(c1N)C=O)N AB83749 [1,1,0,0,0,0|1,0,0]=3 809 B10R1.25 c1c(cnc(c1O)C=O)Br AB70969 [1,1,0,0,0,0|2,0,0]=4 810 B10R1.25 c1c(cnc(c1O)C=O)Cl AB75009 [1,1,0,0,0,0|2,0,0]=4 811 B10R1.25 c1c(cnc(c1O)C=O)N AB84581 [1,1,0,0,0,0|1,0,0]=3 812 B10R1.25 c1cc(c(cc1Br)Br)C=O AB66752 [1,1,0,0,0,0|1,0,0]=3 813 B10R1.25 c1cc(c(cc1Br)N)C=O AB45657 [1,1,0,0,0,0|1,0,0]=3 814 B10R1.25 c1cc(c(cc1Br)N)CO AB42495 [1,1,0,0,0,0|1,0,1]=4 815 B10R1.25 c1cc(c(cc1Br)O)C=O AB23661 [1,1,0,0,0,0|1,0,0]=3 816 B10R1.25 c1cc(c(cc1Cl)Br)C=O MB06997 [1,1,0,0,0,0|1,0,0]=3 817 B10R1.25 c1cc(c(cc1Cl)Br)CO MB06939 [1,1,0,0,0,0|1,0,1]=4 818 B10R1.25 c1cc(c(cc1Cl)N)C=O AB58432 [1,1,0,0,0,0|1,0,0]=3 819 B10R1.25 c1cc(c(cc1Cl)O)C=O AB23660 [1,1,0,0,0,0|1,0,0]=3 820 B10R1.25 c1cc(c(cc1F)Br)C=O AB06851 [1,1,0,0,0,0|1,0,0]=3 821 B10R1.25 c1cc(c(cc1F)Br)CO AB06857 [1,1,0,0,0,0|1,0,1]=4 822 B10R1.25 c1cc(c(cc1F)N)C=O AB55874 [1,1,0,0,0,0|1,0,0]=3 823 B10R1.25 c1cc(c(cc1I)O)C=O MB06220 [1,1,0,0,0,0|1,0,0]=3 824 B10R1.25 c1cc(c(cc1N)F)C#N AB32067 [1,1,0,0,0,0|1,0,1]=4 825 B10R1.25 c1cc(c(cc1N)F)CBr AB56061 [1,1,0,0,0,0|1,0,1]=4 826 B10R1.25 c1cc(c(cc1N)F)CN AB50282 [1,1,0,0,0,0|1,0,1]=4 827 B10R1.25 c1cc(c(cc1N)O)C#N AB53481 [1,1,0,0,0,0|1,0,1]=4 828 B10R1.25 c1cc(c(cc1N)O)C=O MB09039 [1,1,0,0,0,0|0,0,0]=2 829 B10R1.25 c1cc(c(cc1N)O)CN MB10253 [1,1,0,0,0,0|1,0,1]=4 830 B10R1.25 c1cc(c(cc1O)Br)C=O MB25584 [1,1,0,0,0,0|1,0,0]=3 831 B10R1.25 c1cc(c(cc1O)I)C=O MB25658 [1,1,0,0,0,0|1,0,0]=3 832 B10R1.25 c1cc(c(cc1O)N)C=O MB38477 [1,1,0,0,0,0|1,0,0]=3 833 B10R1.25 c1cc(nc(c1C=O)Br)Br PB20462 [1,1,0,0,0,0|2,0,0]=4 834 B10R1.25 c1cc(nc(c1C=O)Br)Cl AB64562 [1,1,0,0,0,0|2,0,0]=4 835 B10R1.25 c1cc(nc(c1C=O)Cl)Cl PB17413 [1,1,0,0,0,0|2,0,0]=4 836 B10R1.25 c1cc(nc(c1C=O)F)Br AB70853 [1,1,0,0,0,0|2,0,0]=4 837 B10R1.25 c1cc(nc(c1C=O)N)Br AB69709 [1,1,0,0,0,0|2,0,0]=4 838 B10R1.25 c1cc(nc(c1C=O)N)Cl AB69707 [1,1,0,0,0,0|2,0,0]=4 839 B10R1.25 c1cc(nc(c1C=O)N)N AB76145 [1,1,0,0,0,0|1,0,0]=3 840 B10R1.25 c1cc(nc(c1C=O)O)Br AB84532 [1,1,0,0,0,0|2,0,0]=4 841 B10R1.25 c1cc(nc(c1C=O)O)Cl AB84535 [1,1,0,0,0,0|2,0,0]=4 842 B10R1.25 c1cc(nc(c1C=O)O)N AB84539 [1,1,0,0,0,0|1,0,0]=3 843 B10R1.176 CCc1ccc(c(c1)O)N MB03784 [1,1,0,0,0,0|1,0,1]=4 844 B10R1.176 CNc1ccc(c(c1)O)N MB25952 [1,1,0,0,0,0|2,0,0]=4 845 B10R1.176 COc1ccc(c(c1)Br)N AB49251 [1,1,0,0,0,0|2,0,0]=4 846 B10R1.176 COc1ccc(c(c1)F)N AB09440 [1,1,0,0,0,0|2,0,0]=4 847 B10R1.176 COc1ccc(c(c1)I)N AB42374 [1,1,0,0,0,0|2,0,0]=4 848 B10R1.176 COc1ccc(c(c1)N)N AB02069 [1,1,0,0,0,0|2,0,0]=4 849 B10R1.176 Cc1c(cc(cn1)C=O)Cl AB74641 [1,1,0,0,0,0|2,0,0]=4 850 B10R1.176 Cc1c(cc(cn1)C=O)F AB62781 [1,1,0,0,0,0|2,0,0]=4 851 B10R1.176 Cc1c(ccc(n1)C=O)Br MB09863 [1,1,0,0,0,0|2,0,0]=4 852 B10R1.176 Cc1c(ccc(n1)C=O)Cl AB70731 [1,1,0,0,0,0|2,0,0]=4 853 B10R1.176 Cc1c(ccc(n1)C=O)F AB44884 [1,1,0,0,0,0|2,0,0]=4 854 B10R1.176 Cc1cc(ccc1Br)C=O AB42951 [1,1,0,0,0,0|1,0,0]=3 855 B10R1.176 Cc1cc(ccc1Br)CO AB50387 [1,1,0,0,0,0|1,0,1]=4 856 B10R1.176 Cc1cc(ccc1Cl)C=O AB11800 [1,1,0,0,0,0|1,0,0]=3 857 B10R1.176 Cc1cc(cnc1Br)C=O AB44906 [1,1,0,0,0,0|2,0,0]=4 858 B10R1.176 Cc1cc(cnc1C)C=O AB75407 [1,1,0,0,0,0|2,0,0]=4 859 B10R1.176 Cc1cc(cnc1Cl)C=O AB64236 [1,1,0,0,0,0|2,0,0]=4 860 B10R1.176 Cc1cc(cnc1F)C=O AB25943 [1,1,0,0,0,0|2,0,0]=4 861 B10R1.176 Cc1cc(ncc1Br)C=O AB41159 [1,1,0,0,0,0|2,0,0]=4 862 B10R1.176 Cc1cc(ncc1C)C=O AB74125 [1,1,0,0,0,0|2,0,0]=4 863 B10R1.176 Cc1cc(ncc1Cl)C=O AB41161 [1,1,0,0,0,0|2,0,0]=4 864 B10R1.176 Cc1cc(ncc1F)C=O AB75169 [1,1,0,0,0,0|2,0,0]=4 865 B10R1.176 Cc1ccc(cc1O)C=O MB01933 [1,1,0,0,0,0|1,0,0]=3 866 B10R1.176 Cc1ccc(nc1C)C=O AB74104 [1,1,0,0,0,0|2,0,0]=4 867 B10R1.176 Cc1ccc(nc1Cl)C=O AB75097 [1,1,0,0,0,0|2,0,0]=4 868 B10R1.176 Cc1ccc(nc1F)C=O AB72847 [1,1,0,0,0,0|2,0,0]=4 869 B10R1.176 Cc1cnc(cc1Br)C=O AB70162 [1,1,0,0,0,0|2,0,0]=4 870 B10R1.176 Cc1cnc(cc1Cl)C=O AB67497 [1,1,0,0,0,0|2,0,0]=4 871 B10R1.176 Cc1cnc(cc1F)C=O AB82952 [1,1,0,0,0,0|2,0,0]=4 872 B10R1.176 Cn1ccc(cc1=O)C=O PB35148 [1,1,0,0,0,0|2,0,0]=4 873 B10R1.176 c1c(cnc(c1Br)Cl)C=O AB64592 [1,1,0,0,0,0|2,0,0]=4 874 B10R1.176 c1c(cnc(c1Cl)Br)C=O AB70941 [1,1,0,0,0,0|2,0,0]=4 875 B10R1.176 c1c(cnc(c1Cl)F)C=O AB70931 [1,1,0,0,0,0|2,0,0]=4 876 B10R1.176 c1c(cnc(c1Cl)N)C=O AB76562 [1,1,0,0,0,0|1,0,0]=3 877 B10R1.176 c1c(cnc(c1Cl)O)C=O AB20957 [1,1,0,0,0,0|2,0,0]=4 878 B10R1.176 c1c(cnc(c1F)Br)C=O AB70942 [1,1,0,0,0,0|2,0,0]=4 879 B10R1.176 c1c(cnc(c1F)Cl)C=O AB67661 [1,1,0,0,0,0|2,0,0]=4 880 B10R1.176 c1c(cnc(c1F)F)C=O AB70938 [1,1,0,0,0,0|2,0,0]=4 881 B10R1.176 c1c(cnc(c1N)Cl)C=O AB67746 [1,1,0,0,0,0|2,0,0]=4 882 B10R1.176 c1c(cnc(c1O)Cl)C=O AB62785 [1,1,0,0,0,0|2,0,0]=4 883 B10R1.176 c1c(ncc(c1Cl)Br)C=O AB67641 [1,1,0,0,0,0|2,0,0]=4 884 B10R1.176 c1c(ncc(c1Cl)Cl)C=O AB67602 [1,1,0,0,0,0|2,0,0]=4 885 B10R1.176 c1c(ncc(c1Cl)F)C=O AB67655 [1,1,0,0,0,0|2,0,0]=4 886 B10R1.176 c1c(ncc(c1Cl)N)C=O AB67744 [1,1,0,0,0,0|1,0,0]=3 887 B10R1.176 c1c(ncc(c1Cl)O)C=O AB67780 [1,1,0,0,0,0|2,0,0]=4 888 B10R1.176 c1c(ncc(c1F)Cl)C=O AB82983 [1,1,0,0,0,0|2,0,0]=4 889 B10R1.176 c1c(ncc(c1F)F)C=O AB73186 [1,1,0,0,0,0|2,0,0]=4 890 B10R1.176 c1c(ncc(c1N)Cl)C=O AB83912 [1,1,0,0,0,0|2,0,0]=4 891 B10R1.176 c1c(ncc(c1O)Cl)C=O AB75002 [1,1,0,0,0,0|2,0,0]=4 892 B10R1.176 c1cc(c(cc1C#N)F)N AB02282 [1,1,0,0,0,0|1,0,1]=4 893 B10R1.176 c1cc(c(cc1C#N)I)N AB17464 [1,1,0,0,0,0|1,0,1]=4 894 B10R1.176 c1cc(c(cc1C#N)O)N MB03898 [1,1,0,0,0,0|1,0,1]=4 895 B10R1.176 c1cc(c(cc1C=O)Cl)Br AB43050 [1,1,0,0,0,0|1,0,0]=3 896 B10R1.176 c1cc(c(cc1C=O)I)F AB44172 [1,1,0,0,0,0|1,0,0]=3 897 B10R1.176 c1cc(c(cc1C=O)I)O MB00259 [1,1,0,0,0,0|1,0,0]=3 898 B10R1.176 c1cc(c(cc1C=O)N)O MB13575 [1,1,0,0,0,0|1,0,0]=3 899 B10R1.176 c1cc(c(cc1C=O)O)Br MB09255 [1,1,0,0,0,0|1,0,0]=3 900 B10R1.176 c1cc(c(cc1C=O)O)Cl MB25536 [1,1,0,0,0,0|1,0,0]=3 901 B10R1.176 c1cc(c(cc1C=O)O)F MB09319 [1,1,0,0,0,0|1,0,0]=3 902 B10R1.176 c1cc(c(cc1C=O)O)N MB34962 [1,1,0,0,0,0|0,0,0]=2 903 B10R1.176 c1cc(c(cc1CN)F)N AB50278 [1,1,0,0,0,0|1,0,1]=4 904 B10R1.176 c1cc(c(cc1CN)O)N MB29053 [1,1,0,0,0,0|1,0,1]=4 905 B10R1.176 c1cc(c(cc1CO)F)Br AB44195 [1,1,0,0,0,0|1,0,1]=4 906 B10R1.176 c1cc(c(nc1C=O)Cl)F AB70948 [1,1,0,0,0,0|2,0,0]=4 907 B10R1.176 c1cc(c(nc1C=O)Cl)N AB75366 [1,1,0,0,0,0|1,0,0]=3 908 B10R1.176 c1cc(c(nc1C=O)Cl)O AB74848 [1,1,0,0,0,0|2,0,0]=4 909 B10R1.176 c1cc(c(nc1C=O)F)Cl AB70952 [1,1,0,0,0,0|2,0,0]=4 910 B10R1.176 c1cc(c(nc1C=O)F)F AB70940 [1,1,0,0,0,0|2,0,0]=4 911 B10R1.176 c1cc(c(nc1C=O)N)Cl AB83955 [1,1,0,0,0,0|2,0,0]=4 912 B10R1.176 c1cc(c(nc1C=O)O)Cl AB70962 [1,1,0,0,0,0|2,0,0]=4 913 B10R1.15 CCC(=O)c1ccccn1 AB01373 [1,1,0,0,0,0|2,0,0]=4 914 B10R1.15 COC(=O)c1cccnn1 PB28168 [1,1,0,0,0,0|2,0,0]=4 915 B10R1.15 COC(=O)c1ccncn1 PB15680 [1,1,0,0,0,0|2,0,0]=4 916 B10R1.15 COC(=O)c1ccnnc1 PB31452 [1,1,0,0,0,0|2,0,0]=4 917 B10R1.15 COC(=O)c1cncnc1 PB15822 [1,1,0,0,0,0|2,0,0]=4 918 B10R1.15 COC(=O)c1ncccn1 PB20045 [1,1,0,0,0,0|2,0,0]=4 919 B10R1.15 c1cc(cnc1)C(=O)C=O AB62325 [1,1,0,0,0,0|1,0,1]=4 920 B10R1.15 c1cc(cnc1)C(=O)CBr AB02174 [1,1,0,0,0,0|2,0,0]=4 921 B10R1.15 c1cc(cnc1)C(=O)CBr AB44461 [1,1,0,0,0,0|2,0,0]=4 922 B10R1.15 c1cc(cnc1)C(=O)CCl MB06839 [1,1,0,0,0,0|2,0,0]=4 923 B10R1.15 c1ccc(cc1)C(=O)C=O AB00817 [1,1,0,0,0,0|0,0,1]=3 924 B10R1.15 c1ccc(cc1)C(=O)C=O AB03966 [1,1,0,0,0,0|0,0,1]=3 925 B10R1.15 c1ccc(cc1)C(=O)NN AB00887 [1,1,0,0,0,0|1,0,0]=3 926 B10R1.15 c1ccnc(c1)C(=O)C=O AB62330 [1,1,0,0,0,0|1,0,1]=4 927 B10R1.15 c1ccnc(c1)C(=O)CBr AB23665 [1,1,0,0,0,0|2,0,0]=4 928 B10R1.15 c1cnccc1C(=O)C=O AB62328 [1,1,0,0,0,0|1,0,1]=4 929 B10R1.15 c1cnccc1C(=O)CBr AB12154 [1,1,0,0,0,0|2,0,0]=4 930 B10R1.61 B(c1ccccc1Br)(O)O AB08325 [1,1,0,0,0,0|1,0,1]=4 931 B10R1.61 B(c1ccccc1C)(O)O AB03348 [1,1,0,0,0,0|1,0,1]=4 932 B10R1.61 B(c1ccccc1Cl)(O)O AB06914 [1,1,0,0,0,0|1,0,1]=4 933 B10R1.61 B(c1ccccc1F)(O)O AB06918 [1,1,0,0,0,0|1,0,1]=4 934 B10R1.61 B(c1ccccc1N)(O)O AB08088 [1,1,0,0,0,0|1,0,1]=4 935 B10R1.61 B(c1ccccc1O)(O)O AB08053 [1,1,0,0,0,0|1,0,1]=4 936 B10R1.61 CC(=O)c1c(cccn1)Cl PB28312 [1,1,0,0,0,0|2,0,0]=4 937 B10R1.61 CC(=O)c1c(cccn1)F PB26212 [1,1,0,0,0,0|2,0,0]=4 938 B10R1.61 CC(=O)c1c(cccn1)N AB08681 [1,1,0,0,0,0|2,0,0]=4 939 B10R1.61 CC(=O)c1cccnc1Br AB18171 [1,1,0,0,0,0|2,0,0]=4 940 B10R1.61 CC(=O)c1cccnc1Cl PB32351 [1,1,0,0,0,0|2,0,0]=4 941 B10R1.61 CC(=O)c1cccnc1F AB41104 [1,1,0,0,0,0|2,0,0]=4 942 B10R1.61 CC(=O)c1cccnc1N AB11689 [1,1,0,0,0,0|2,0,0]=4 943 B10R1.61 CC(=O)c1ccncc1Br PB12099 [1,1,0,0,0,0|2,0,0]=4 944 B10R1.61 CC(=O)c1ccncc1F PB22036 [1,1,0,0,0,0|2,0,0]=4 945 B10R1.61 CC(=O)c1ccncc1N AB41121 [1,1,0,0,0,0|2,0,0]=4 946 B10R1.61 CC(=O)c1cnccc1Br AB64732 [1,1,0,0,0,0|2,0,0]=4 947 B10R1.61 CC(=O)c1cnccc1Cl AB64447 [1,1,0,0,0,0|2,0,0]=4 948 B10R1.61 CC(=O)c1cnccc1F AB41107 [1,1,0,0,0,0|2,0,0]=4 949 B10R1.61 Cc1c(cccn1)C(=O)C AB03570 [1,1,0,0,0,0|2,0,0]=4 950 B10R1.61 Cc1c(cccn1)C(=O)O PB27380 [1,1,0,0,0,0|1,0,0]=3 951 B10R1.61 Cc1c(ccnn1)C(=O)O PB22593 [1,1,0,0,0,0|2,0,0]=4 952 B10R1.61 Cc1c(nccn1)C(=O)O PB12562 [1,1,0,0,0,0|2,0,0]=4 953 B10R1.61 Cc1ccccc1C(=N)N AB18273 [1,1,0,0,0,0|2,0,0]=4 954 B10R1.61 Cc1ccccc1C(=S)N AB16881 [1,1,0,0,0,0|1,1,0]=4 955 B10R1.61 Cc1cccnc1C(=O)O PB10121 [1,1,0,0,0,0|1,0,0]=3 956 B10R1.61 Cc1ccncc1C(=O)C AB45306 [1,1,0,0,0,0|2,0,0]=4 957 B10R1.61 Cc1ccncc1C(=O)O PB17119 [1,1,0,0,0,0|1,0,0]=3 958 B10R1.61 Cc1ccnnc1C(=O)O PB17664 [1,1,0,0,0,0|2,0,0]=4 959 B10R1.61 Cc1cnccc1C(=O)O PB12103 [1,1,0,0,0,0|1,0,0]=3 960 B10R1.61 Cc1cnncc1C(=O)O PB17923 [1,1,0,0,0,0|2,0,0]=4 961 B10R1.61 c1c(c(ncn1)C(=O)O)Br PB12688 [1,1,0,0,0,0|2,0,0]=4 962 B10R1.61 c1c(c(ncn1)Cl)C(=O)O AB51529 [1,1,0,0,0,0|2,0,0]=4 963 B10R1.61 c1c(c(ncn1)N)C(=O)O AB02045 [1,1,0,0,0,0|2,0,0]=4 964 B10R1.61 c1cc(c(nc1)Br)C(=O)O AB09561 [1,1,0,0,0,0|1,0,0]=3 965 B10R1.61 c1cc(c(nc1)C(=O)N)N PB24920 [1,1,0,0,0,0|2,0,0]=4 966 B10R1.61 c1cc(c(nc1)C(=O)O)Cl PB30690 [1,1,0,0,0,0|1,0,0]=3 967 B10R1.61 c1cc(c(nc1)C(=O)O)F PB12310 [1,1,0,0,0,0|1,0,0]=3 968 B10R1.61 c1cc(c(nc1)C(=O)O)I AB10544 [1,1,0,0,0,0|1,0,0]=3 969 B10R1.61 c1cc(c(nc1)C(=O)O)N PB32134 [1,1,0,0,0,0|1,0,0]=3 970 B10R1.61 c1cc(c(nc1)Cl)C(=O)O AB00651 [1,1,0,0,0,0|1,0,0]=3 971 B10R1.61 c1cc(c(nc1)F)C(=O)O AB01814 [1,1,0,0,0,0|1,0,0]=3 972 B10R1.61 c1cc(c(nc1)N)C(=O)O PB30535 [1,1,0,0,0,0|1,0,0]=3 973 B10R1.61 c1cc(c(nc1)O)C(=O)O AB01020 [1,1,0,0,0,0|1,0,0]=3 974 B10R1.61 c1ccc(c(c1)C(=N)N)Br AB18326 [1,1,0,0,0,0|2,0,0]=4 975 B10R1.61 c1ccc(c(c1)C(=N)N)Cl AB05888 [1,1,0,0,0,0|2,0,0]=4 976 B10R1.61 c1ccc(c(c1)C(=N)N)F AB18318 [1,1,0,0,0,0|2,0,0]=4 977 B10R1.61 c1ccc(c(c1)C(=N)N)O AB55085 [1,1,0,0,0,0|2,0,0]=4 978 B10R1.61 c1ccc(c(c1)C(=O)O)Br AB00223 [1,1,0,0,0,0|0,0,0]=2 979 B10R1.61 c1ccc(c(c1)C(=S)N)Br AB21272 [1,1,0,0,0,0|1,1,0]=4 980 B10R1.61 c1ccc(c(c1)C(=S)N)Cl AB01839 [1,1,0,0,0,0|1,1,0]=4 981 B10R1.61 c1ccc(c(c1)C(=S)N)N AB07816 [1,1,0,0,0,0|1,1,0]=4 982 B10R1.61 c1cnc(c(n1)C(=O)O)Cl PB23222 [1,1,0,0,0,0|2,0,0]=4 983 B10R1.61 c1cnc(c(n1)C(=O)O)N AB00606 [1,1,0,0,0,0|2,0,0]=4 984 B10R1.61 c1cnc(c(n1)C(=O)O)O PB18475 [1,1,0,0,0,0|2,0,0]=4 985 B10R1.61 c1cncc(c1Br)C(=O)O AB18009 [1,1,0,0,0,0|1,0,0]=3 986 B10R1.61 c1cncc(c1C(=O)N)O MB13532 [1,1,0,0,0,0|2,0,0]=4 987 B10R1.61 c1cncc(c1C(=O)O)Br PB10062 [1,1,0,0,0,0|1,0,0]=3 988 B10R1.61 c1cncc(c1C(=O)O)Cl AB13346 [1,1,0,0,0,0|1,0,0]=3 989 B10R1.61 c1cncc(c1C(=O)O)I AB09565 [1,1,0,0,0,0|1,0,0]=3 990 B10R1.61 c1cncc(c1C(=O)O)N PB17122 [1,1,0,0,0,0|1,0,0]=3 991 B10R1.61 c1cncc(c1C(=O)O)O PB29057 [1,1,0,0,0,0|1,0,0]=3 992 B10R1.61 c1cncc(c1Cl)C(=O)O AB03598 [1,1,0,0,0,0|1,0,0]=3 993 B10R1.61 c1cncc(c1F)C(=O)O AB18036 [1,1,0,0,0,0|1,0,0]=3 994 B10R1.61 c1cncc(c1I)C(=O)O AB15003 [1,1,0,0,0,0|1,0,0]=3 995 B10R1.61 c1cncc(c1N)C(=O)N PB21456 [1,1,0,0,0,0|2,0,0]=4 996 B10R1.61 c1cncc(c1N)C(=O)O PB26016 [1,1,0,0,0,0|1,0,0]=3 997 B10R1.61 c1cncc(c1O)C(=O)N MB06099 [1,1,0,0,0,0|2,0,0]=4 998 B10R1.61 c1cncc(c1O)C(=O)O AB01802 [1,1,0,0,0,0|1,0,0]=3 999 B10R1.61 c1cnnc(c1C(=O)O)O AB76276 [1,1,0,0,0,0|2,0,0]=4 1000 B10R1.113 B(c1cccc(c1)Br)(O)O AB05452 [1,1,0,0,0,0|1,0,1]=4 1001 B10R1.113 B(c1cccc(c1)C)(O)O AB01795 [1,1,0,0,0,0|1,0,1]=4 1002 B10R1.113 B(c1cccc(c1)Cl)(O)O AB04228 [1,1,0,0,0,0|1,0,1]=4 1003 B10R1.113 B(c1cccc(c1)F)(O)O AB05340 [1,1,0,0,0,0|1,0,1]=4 1004 B10R1.113 B(c1cccc(c1)I)(O)O AB08836 [1,1,0,0,0,0|1,0,1]=4 1005 B10R1.113 B(c1cccc(c1)N)(O)O AB00895 [1,1,0,0,0,0|1,0,1]=4 1006 B10R1.113 B(c1cccc(c1)N)(O)O AB01122 [1,1,0,0,0,0|1,0,1]=4 1007 B10R1.113 B(c1cccc(c1)O)(O)O AB08061 [1,1,0,0,0,0|1,0,1]=4 1008 B10R1.113 B(c1cccc(c1)S)(O)O AB13509 [1,1,0,0,0,0|1,0,1]=4 1009 B10R1.113 CC(=O)c1cc(ccn1)Br AB67963 [1,1,0,0,0,0|2,0,0]=4 1010 B10R1.113 CC(=O)c1cc(ccn1)Cl AB60198 [1,1,0,0,0,0|2,0,0]=4 1011 B10R1.113 CC(=O)c1cc(ccn1)F AB68049 [1,1,0,0,0,0|2,0,0]=4 1012 B10R1.113 CC(=O)c1cc(ccn1)O AB69730 [1,1,0,0,0,0|2,0,0]=4 1013 B10R1.113 CC(=O)c1cc(cnc1)Br PB20794 [1,1,0,0,0,0|2,0,0]=4 1014 B10R1.113 CC(=O)c1cc(cnc1)F AB41114 [1,1,0,0,0,0|2,0,0]=4 1015 B10R1.113 CC(=O)c1cc(cnc1)N AB30920 [1,1,0,0,0,0|2,0,0]=4 1016 B10R1.113 CC(=O)c1cccc(n1)Br AB05570 [1,1,0,0,0,0|2,0,0]=4 1017 B10R1.113 CC(=O)c1cccc(n1)Cl AB41100 [1,1,0,0,0,0|2,0,0]=4 1018 B10R1.113 CC(=O)c1cccc(n1)F AB50226 [1,1,0,0,0,0|2,0,0]=4 1019 B10R1.113 CC(=O)c1cccc(n1)N AB67452 [1,1,0,0,0,0|2,0,0]=4 1020 B10R1.113 CC(=O)c1ccnc(c1)Br AB31302 [1,1,0,0,0,0|2,0,0]=4 1021 B10R1.113 CC(=O)c1ccnc(c1)Cl PB18811 [1,1,0,0,0,0|2,0,0]=4 1022 B10R1.113 CC(=O)c1ccnc(c1)F AB50237 [1,1,0,0,0,0|2,0,0]=4 1023 B10R1.113 CC(=O)c1ccnc(c1)N AB67454 [1,1,0,0,0,0|2,0,0]=4 1024 B10R1.113 Cc1cc(ccn1)C(=O)C AB41122 [1,1,0,0,0,0|2,0,0]=4 1025 B10R1.113 Cc1cc(ccn1)C(=O)Cl AB60195 [1,1,0,0,0,0|2,0,0]=4 1026 B10R1.113 Cc1cc(ccn1)C(=O)O AB06393 [1,1,0,0,0,0|1,0,0]=3 1027 B10R1.113 Cc1cc(cnc1)C(=O)O PB12710 [1,1,0,0,0,0|1,0,0]=3 1028 B10R1.113 Cc1cc(ncn1)C(=O)O PB20450 [1,1,0,0,0,0|2,0,0]=4 1029 B10R1.113 Cc1cccc(c1)C(=N)N AB11452 [1,1,0,0,0,0|2,0,0]=4 1030 B10R1.113 Cc1cccc(c1)C(=S)N AB08506 [1,1,0,0,0,0|1,1,0]=4 1031 B10R1.113 Cc1cccc(n1)C(=O)C AB25782 [1,1,0,0,0,0|2,0,0]=4 1032 B10R1.113 Cc1cccc(n1)C(=O)O AB01368 [1,1,0,0,0,0|1,0,0]=3 1033 B10R1.113 Cc1ccnc(c1)C(=O)C AB10395 [1,1,0,0,0,0|2,0,0]=4 1034 B10R1.113 Cc1ccnc(c1)C(=O)O AB15851 [1,1,0,0,0,0|1,0,0]=3 1035 B10R1.113 Cc1ccnc(n1)C(=O)O PB31505 [1,1,0,0,0,0|2,0,0]=4 1036 B10R1.113 Cc1cncc(n1)C(=O)O AB48615 [1,1,0,0,0,0|2,0,0]=4 1037 B10R1.113 c1c(cncc1Cl)C(=O)O PB25983 [1,1,0,0,0,0|1,0,0]=3 1038 B10R1.113 c1c(cncc1F)C(=O)O PB23226 [1,1,0,0,0,0|1,0,0]=3 1039 B10R1.113 c1c(cncc1N)C(=O)O PB13029 [1,1,0,0,0,0|1,0,0]=3 1040 B10R1.113 c1c(cncc1O)C(=O)N MB01725 [1,1,0,0,0,0|2,0,0]=4 1041 B10R1.113 c1c(cncc1O)C(=O)O PB33816 [1,1,0,0,0,0|1,0,0]=3 1042 B10R1.113 c1c(cnnc1Cl)C(=O)O PB30096 [1,1,0,0,0,0|2,0,0]=4 1043 B10R1.113 c1c(nc(cn1)Br)C(=O)O AB69955 [1,1,0,0,0,0|2,0,0]=4 1044 B10R1.113 c1c(nc(cn1)Cl)C(=O)O PB21720 [1,1,0,0,0,0|2,0,0]=4 1045 B10R1.113 c1c(nc(cn1)N)C(=O)O AB60537 [1,1,0,0,0,0|2,0,0]=4 1046 B10R1.113 c1c(ncnc1Cl)C(=O)O AB48398 [1,1,0,0,0,0|2,0,0]=4 1047 B10R1.113 c1cc(cc(c1)Br)C(=N)N AB18330 [1,1,0,0,0,0|2,0,0]=4 1048 B10R1.113 c1cc(cc(c1)Br)C(=O)N MB00265 [1,1,0,0,0,0|1,0,0]=3 1049 B10R1.113 c1cc(cc(c1)Br)C(=S)N AB21268 [1,1,0,0,0,0|1,1,0]=4 1050 B10R1.113 c1cc(cc(c1)Cl)C(=S)N AB05898 [1,1,0,0,0,0|1,1,0]=4 1051 B10R1.113 c1cc(cc(c1)F)C(=N)N AB18313 [1,1,0,0,0,0|2,0,0]=4 1052 B10R1.113 c1cc(cc(c1)F)C(=S)N AB21276 [1,1,0,0,0,0|1,1,0]=4 1053 B10R1.113 c1cc(cc(c1)N)C(=N)N AB01115 [1,1,0,0,0,0|2,0,0]=4 1054 B10R1.113 c1cc(cc(c1)N)C(=S)N AB21283 [1,1,0,0,0,0|1,1,0]=4 1055 B10R1.113 c1cc(cc(c1)O)C(=N)N AB55570 [1,1,0,0,0,0|2,0,0]=4 1056 B10R1.113 c1cc(cc(c1)O)C(=O)N MB00281 [1,1,0,0,0,0|1,0,0]=3 1057 B10R1.113 c1cc(nc(c1)Br)C(=O)N MB00999 [1,1,0,0,0,0|2,0,0]=4 1058 B10R1.113 c1cc(nc(c1)Br)C(=O)O AB03328 [1,1,0,0,0,0|1,0,0]=3 1059 B10R1.113 c1cc(nc(c1)Cl)C(=O)O AB04138 [1,1,0,0,0,0|1,0,0]=3 1060 B10R1.113 c1cc(nc(c1)F)C(=O)O AB11487 [1,1,0,0,0,0|1,0,0]=3 1061 B10R1.113 c1cc(nc(c1)I)C(=O)N AB42518 [1,1,0,0,0,0|2,0,0]=4 1062 B10R1.113 c1cc(nc(c1)I)C(=O)O AB42497 [1,1,0,0,0,0|1,0,0]=3 1063 B10R1.113 c1cc(nc(c1)N)C(=O)O PB23179 [1,1,0,0,0,0|1,0,0]=3 1064 B10R1.113 c1cnc(cc1Br)C(=O)O PB21234 [1,1,0,0,0,0|1,0,0]=3 1065 B10R1.113 c1cnc(cc1C(=O)N)Br AB05162 [1,1,0,0,0,0|2,0,0]=4 1066 B10R1.113 c1cnc(cc1C(=O)N)Cl AB04952 [1,1,0,0,0,0|2,0,0]=4 1067 B10R1.113 c1cnc(cc1C(=O)N)N AB16207 [1,1,0,0,0,0|2,0,0]=4 1068 B10R1.113 c1cnc(cc1C(=O)O)Br AB09563 [1,1,0,0,0,0|1,0,0]=3 1069 B10R1.113 c1cnc(cc1C(=O)O)Cl PB12125 [1,1,0,0,0,0|1,0,0]=3 1070 B10R1.113 c1cnc(cc1C(=O)O)F AB11490 [1,1,0,0,0,0|1,0,0]=3 1071 B10R1.113 c1cnc(cc1C(=O)O)I AB29977 [1,1,0,0,0,0|1,0,0]=3 1072 B10R1.113 c1cnc(cc1C(=O)O)N PB19872 [1,1,0,0,0,0|1,0,0]=3 1073 B10R1.113 c1cnc(cc1C(=O)O)O PB29144 [1,1,0,0,0,0|1,0,0]=3 1074 B10R1.113 c1cnc(cc1Cl)C(=O)N AB08235 [1,1,0,0,0,0|2,0,0]=4 1075 B10R1.113 c1cnc(cc1Cl)C(=O)O AB04585 [1,1,0,0,0,0|1,0,0]=3 1076 B10R1.113 c1cnc(cc1F)C(=O)O AB40659 [1,1,0,0,0,0|1,0,0]=3 1077 B10R1.113 c1cnc(cc1I)C(=O)O AB28008 [1,1,0,0,0,0|1,0,0]=3 1078 B10R1.113 c1cnc(cc1I)C(=O)O PB20818 [1,1,0,0,0,0|1,0,0]=3 1079 B10R1.113 c1cnc(cc1N)C(=O)N AB43415 [1,1,0,0,0,0|2,0,0]=4 1080 B10R1.113 c1cnc(cc1N)C(=O)O PB23313 [1,1,0,0,0,0|1,0,0]=3 1081 B10R1.113 c1cnc(cc1O)C(=O)N MB05243 [1,1,0,0,0,0|2,0,0]=4 1082 B10R1.113 c1cnc(cc1O)C(=O)O AB06407 [1,1,0,0,0,0|1,0,0]=3 1083 B10R1.113 c1cnc(nc1C(=O)O)Cl AB28457 [1,1,0,0,0,0|2,0,0]=4 1084 B10R1.113 c1cnc(nc1C(=O)O)N AB42844 [1,1,0,0,0,0|2,0,0]=4 1085 B10R1.113 c1cnc(nc1Cl)C(=O)O AB55866 [1,1,0,0,0,0|2,0,0]=4 1086 B10R1.14 COC(=O)c1cc(cs1)Br PB18709 [0,1,0,0,1,0|2,0,0]=4 1087 B10R1.14 COC(=O)c1cc(cs1)Cl PB24460 [0,1,0,0,1,0|2,0,0]=4 1088 B10R1.14 COC(=O)c1cc(sc1)Br PB21329 [0,1,0,0,1,0|2,0,0]=4 1089 B10R1.14 COC(=O)c1cc(sc1)Cl PB30437 [0,1,0,0,1,0|2,0,0]=4 1090 B10R1.14 COC(=O)c1ccc(s1)Br PB24794 [0,1,0,0,1,0|2,0,0]=4 1091 B10R1.14 COC(=O)c1ccc(s1)Cl MB03690 [0,1,0,0,1,0|2,0,0]=4 1092 B10R1.14 COC(=O)c1cnc(s1)N AB16042 [0,1,0,0,1,0|2,0,0]=4 1093 B10R1.14 COC(=O)c1csc(n1)N AB06554 [0,1,0,0,1,0|2,0,0]=4 1094 B10R1.14 COC(=O)c1ncc(s1)N PB39132 [0,1,0,0,1,0|2,0,0]=4 1095 B10R1.14 Cc1ccc(s1)C(=O)OC AB23205 [0,1,0,0,1,0|2,0,0]=4 1096 B10R1.58 Cn1c(cc(n1)C(=O)O)N PB19094 [0,1,0,0,1,0|2,0,0]=4 1097 B10R1.59 Cc1cc(c(o1)C)C(=O)O AB03078 [0,1,0,0,1,0|2,0,0]=4 1098 B10R1.59 Cc1cc(c(s1)N)C(=O)O AB22303 [0,1,0,0,1,0|2,0,0]=4 1099 B10R1.59 Cc1cc(sc1C(=O)O)Br CB11471 [0,1,0,0,1,0|2,0,0]=4 1100 B10R1.59 Cn1cc(cc1C(=O)O)N AB42940 [0,1,0,0,1,0|1,0,0]=3 1101 B10R1.59 c1c(c(sc1Br)Cl)C(=O)O MB19768 [0,1,0,0,1,0|2,0,0]=4 1102 B10R1.59 c1c(c(sc1Cl)Cl)C(=O)O PB12074 [0,1,0,0,1,0|2,0,0]=4 1103 B10R1.59 c1c(cn(c1C(=O)O)N)Br MB14547 [0,1,0,0,1,0|2,0,0]=4 1104 B10R1.194 c1c(c(c(s1)C(=O)O)N)Br AB65684 [0,1,0,0,1,0|2,0,0]=4 1105 B12R1.4 CC(=O)Cc1ccc(cc1)OC AB00957 [0,1,0,0,0,1|2,0,0]=4 1106 B12R1.4 COc1ccc(cn1)CC(=O)O AB55204 [0,1,0,0,0,1|2,0,0]=4 1107 B12R1.4 c1cc(ccc1CC(=O)O)CN AB17066 [0,1,0,0,0,1|0,0,0]=2 1108 B12R1.19 CC(=O)Oc1ccc(c(c1)Cl)F MB07187 [0,1,0,0,0,1|2,0,0]=4 1109 B12R1.19 Cc1cc(ncc1Br)CC(=O)O AB41182 [0,1,0,0,0,1|2,0,0]=4 1110 B12R1.19 Cc1cc(ncc1Cl)CC(=O)O AB41190 [0,1,0,0,0,1|2,0,0]=4 1111 B12R1.19 Cc1ccc(cc1Br)NC(=O)C AB07992 [0,1,0,0,0,1|2,0,0]=4 1112 B12R1.19 Cc1ccc(nc1C)CC(=O)O AB74109 [0,1,0,0,0,1|2,0,0]=4 1113 B12R1.19 c1c(ncc(c1Cl)Cl)CC(=O)O AB70221 [0,1,0,0,0,1|2,0,0]=4 1114 B12R1.19 c1c(ncc(c1Cl)F)CC(=O)O AB74103 [0,1,0,0,0,1|2,0,0]=4 1115 B12R1.19 c1cc(c(nc1CC(=O)O)F)Cl AB71038 [0,1,0,0,0,1|2,0,0]=4 1116 B12R1.20 Cc1ccc(cc1)C(C(=O)O)N AB06684 [0,1,0,0,0,1|1,0,0]=3 1117 B12R1.20 Cc1ccc(cc1)[C@H](C(=O)O)N AB32672 [0,1,0,0,0,1|1,0,0]=3 1118 B12R1.20 Cc1ccc(nc1)C(C(=O)O)O AB31481 [0,1,0,0,0,1|2,0,0]=4 1119 B12R1.20 c1cc(ccc1C(C(=O)O)N)Br AB02090 [0,1,0,0,0,1|1,0,0]=3 1120 B12R1.20 c1cc(ccc1C(C(=O)O)N)Br AB20158 [0,1,0,0,0,1|1,0,0]=3 1121 B12R1.20 c1cc(ccc1C(C(=O)O)N)Cl AB02094 [0,1,0,0,0,1|1,0,0]=3 1122 B12R1.20 c1cc(ccc1C(C(=O)O)N)F AB02694 [0,1,0,0,0,1|1,0,0]=3 1123 B12R1.20 c1cc(ccc1C(C(=O)O)N)F AB24574 [0,1,0,0,0,1|1,0,0]=3 1124 B12R1.20 c1cc(ccc1C(C(=O)O)N)O AB02671 [0,1,0,0,0,1|1,0,0]=3 1125 B12R1.20 c1cc(ccc1[C@@H](C(=O)O)N)Cl AB15770 [0,1,0,0,0,1|1,0,0]=3 1126 B12R1.20 c1cc(ccc1[C@@H](C(=O)O)N)F AB04848 [0,1,0,0,0,1|1,0,0]=3 1127 B12R1.20 c1cc(ccc1[C@H](C(=O)O)N)Br AB32807 [0,1,0,0,0,1|1,0,0]=3 1128 B12R1.20 c1cc(ccc1[C@H](C(=O)O)N)Cl AB16238 [0,1,0,0,0,1|1,0,0]=3 1129 B12R1.20 c1cc(ccc1[C@H](C(=O)O)N)F AB01939 [0,1,0,0,0,1|1,0,0]=3 1130 B12R1.20 c1cc(ccc1[C@H](C(=O)O)N)O AB00341 [0,1,0,0,0,1|1,0,0]=3 1131 B12R1.20 c1cc(ncc1C(C(=O)O)N)Br AB32552 [0,1,0,0,0,1|2,0,0]=4 1132 B12R1.20 c1cc(ncc1C(C(=O)O)N)Cl AB32556 [0,1,0,0,0,1|2,0,0]=4 1133 B12R1.49 COC(=N)Cc1ccc(cc1)Br AB60928 [0,1,0,0,0,1|2,0,0]=4 1134 B12R1.49 COC(=N)Cc1ccc(cc1)Cl AB60925 [0,1,0,0,0,1|2,0,0]=4 1135 B12R1.49 COC(=N)Cc1ccc(cc1)F AB60924 [0,1,0,0,0,1|2,0,0]=4 1136 B12R1.49 COC(=O)Cc1ccc(cc1)Br PB24610 [0,1,0,0,0,1|1,0,0]=3 1137 B12R1.49 COC(=O)Nc1ccc(cn1)Br MB01437 [0,1,0,0,0,1|2,0,0]=4 1138 B12R1.49 COC(=O)Nc1ccc(nc1)Br MB14348 [0,1,0,0,0,1|2,0,0]=4 1139 B12R1.49 Cc1ccc(cc1)CC(=N)OC AB60933 [0,1,0,0,0,1|2,0,0]=4 1140 B12R1.233 Cc1cc(cnc1NC(=O)C)N AB64450 [0,1,0,0,0,1|2,0,0]=4 1141 B12R1.233 c1c(cnc(c1N)CC(=O)O)Br AB40972 [0,1,0,0,0,1|2,0,0]=4 1142 B12R1.233 c1c(cnc(c1N)CC(=O)O)Cl AB41048 [0,1,0,0,0,1|2,0,0]=4 1143 B12R1.5 CCc1ccc(cc1)C(=O)C=O AB48659 [0,2,0,0,0,0|1,0,1]=4 1144 B12R1.5 COC(=N)c1ccc(cc1)C=O AB60994 [0,2,0,0,0,0|2,0,0]=4 1145 B12R1.5 COC(=O)c1ccc(cc1)C#C AB04259 [0,2,0,0,0,0|1,0,0]=3 1146 B12R1.5 COC(=O)c1ccc(cn1)C#C AB69053 [0,2,0,0,0,0|2,0,0]=4 1147 B12R1.5 COC(=O)c1ccc(cn1)C=O AB63118 [0,2,0,0,0,0|2,0,0]=4 1148 B12R1.5 COC(=O)c1ccc(cn1)CBr AB31485 [0,2,0,0,0,0|2,0,0]=4 1149 B12R1.5 COC(=O)c1ccc(nc1)C=O AB44523 [0,2,0,0,0,0|2,0,0]=4 1150 B12R1.5 COC(=O)c1ccc(nc1)CBr AB56164 [0,2,0,0,0,0|2,0,0]=4 1151 B12R1.5 COC(=O)c1ccc(nc1)CCl AB06109 [0,2,0,0,0,0|2,0,0]=4 1152 B12R1.5 COC(=O)c1ccc(nc1)CO AB06608 [0,2,0,0,0,0|2,0,0]=4 1153 B12R1.5 COC(=O)c1ccc(nn1)NN PB15260 [0,2,0,0,0,0|2,0,0]=4 1154 B12R1.5 COc1ccc(cc1)C(=N)OC AB04684 [0,2,0,0,0,0|2,0,0]=4 1155 B12R1.5 COc1ccc(cc1)C(=O)C#N MB03942 [0,2,0,0,0,0|2,0,0]=4 1156 B12R1.5 COc1ccc(cc1)C(=O)C=O AB05250 [0,2,0,0,0,0|1,0,1]=4 1157 B12R1.5 COc1ccc(cc1)C(=O)C=O AB05286 [0,2,0,0,0,0|1,0,1]=4 1158 B12R1.5 COc1ccc(cn1)C(=O)OC PB33918 [0,2,0,0,0,0|2,0,0]=4 1159 B12R1.5 COc1ccc(nc1)C(=O)OC PB10973 [0,2,0,0,0,0|2,0,0]=4 1160 B12R1.5 CSc1ccc(cc1)C(=O)C=O AB48690 [0,2,0,0,0,0|1,0,1]=4 1161 B12R1.5 c1cc(ccc1C#N)C(=O)C=O AB14104 [0,2,0,0,0,0|0,0,2]=4 1162 B12R1.5 c1cc(ccc1C#N)C(=O)C=O AB44430 [0,2,0,0,0,0|0,0,2]=4 1163 B12R1.5 c1cc(ccc1CN)C(=O)C=O AB23361 [0,2,0,0,0,0|0,0,1]=3 1164 B12R1.6 CS(=O)(=O)c1ccc(cc1)CN AB23397 [0,2,0,0,0,0|1,0,1]=4 1165 B12R1.48 CCc1ccc(cc1O)C(=O)N MB23796 [0,2,0,0,0,0|2,0,0]=4 1166 B12R1.48 CCc1ccc(cc1O)C(=O)O MB06270 [0,2,0,0,0,0|1,0,0]=3 1167 B12R1.48 CNc1ccc(cc1O)C(=O)N MB33559 [0,2,0,0,0,0|1,0,0]=3 1168 B12R1.48 CNc1ccc(cc1O)C(=O)O MB29392 [0,2,0,0,0,0|0,0,0]=2 1169 B12R1.48 COc1c(cc(cn1)C(=O)O)Br AB64029 [0,2,0,0,0,0|2,0,0]=4 1170 B12R1.48 COc1c(cc(cn1)C(=O)O)Cl AB20982 [0,2,0,0,0,0|2,0,0]=4 1171 B12R1.48 COc1c(cc(cn1)C(=O)O)F AB62787 [0,2,0,0,0,0|2,0,0]=4 1172 B12R1.48 COc1c(cc(cn1)C(=O)O)N AB84951 [0,2,0,0,0,0|2,0,0]=4 1173 B12R1.48 COc1c(cc(cn1)C(=O)O)O AB74794 [0,2,0,0,0,0|2,0,0]=4 1174 B12R1.48 COc1ccc(cc1Br)C(=O)N AB64470 [0,2,0,0,0,0|2,0,0]=4 1175 B12R1.48 COc1ccc(cc1Br)C(=O)O AB01268 [0,2,0,0,0,0|1,0,0]=3 1176 B12R1.48 COc1ccc(cc1O)C(=O)N MB32793 [0,2,0,0,0,0|2,0,0]=4 1177 B12R1.48 COc1ccc(nc1Br)C(=O)O AB25432 [0,2,0,0,0,0|2,0,0]=4 1178 B12R1.48 COc1cnc(cc1Cl)C(=O)O AB67547 [0,2,0,0,0,0|2,0,0]=4 1179 B12R1.48 CSc1ccc(cc1O)C(=O)N MB34551 [0,2,0,0,0,0|2,0,0]=4 1180 B12R1.48 CSc1ccc(cc1O)C(=O)O MB30298 [0,2,0,0,0,0|1,0,0]=3 1181 B12R1.48 Cc1cc(cnc1OC)C(=O)O AB70810 [0,2,0,0,0,0|2,0,0]=4 1182 B12R1.48 c1c(c(cnc1C(=O)O)C=O)N AB83685 [0,2,0,0,0,0|2,0,0]=4 1183 B12R1.48 c1c(c(cnc1C(=O)O)C=O)O AB75433 [0,2,0,0,0,0|2,0,0]=4 1184 B12R1.48 c1c(cnc(c1N)C=O)C(=O)O AB83742 [0,2,0,0,0,0|2,0,0]=4 1185 B12R1.48 c1c(cnc(c1O)C=O)C(=O)O AB84590 [0,2,0,0,0,0|2,0,0]=4 1186 B12R1.48 c1cc(c(cc1C(=O)N)O)C#N MB26792 [0,2,0,0,0,0|1,0,1]=4 1187 B12R1.48 c1cc(c(cc1C(=O)N)O)CN MB34020 [0,2,0,0,0,0|1,0,0]=3 1188 B12R1.48 c1cc(c(cc1C(=O)O)O)C#N MB27102 [0,2,0,0,0,0|0,0,1]=3 1189 B12R1.48 c1cc(c(cc1C(=O)O)O)CN MB25917 [0,2,0,0,0,0|0,0,0]=2 1190 B12R1.48 c1cc(c(cc1[N+](=O)[O-])F)CN AB70444 [0,2,0,0,0,0|1,0,1]=4 1191 B12R1.48 c1cc(nc(c1C=O)N)C(=O)O AB83714 [0,2,0,0,0,0|2,0,0]=4 1192 B12R1.48 c1cc(nc(c1C=O)O)C(=O)O AB84546 [0,2,0,0,0,0|2,0,0]=4 1193 B12R1.113 CC(=O)c1ccc(cc1)CC#C AB73223 [0,2,0,0,0,0|2,0,0]=4 1194 B12R1.256 B(c1ccc(cc1)C(=O)C)(O)O AB08109 [0,2,0,0,0,0|2,0,0]=4 1195 B12R1.256 B(c1ccc(cc1)C(=O)O)(O)O AB03988 [0,2,0,0,0,0|1,0,0]=3 1196 B12R1.256 B(c1ccc(cc1)N(C)C)(O)O AB08086 [0,2,0,0,0,0|1,0,1]=4 1197 B12R1.256 CC(=O)c1ccc(nc1)C(=O)O AB60293 [0,2,0,0,0,0|2,0,0]=4 1198 B12R1.256 CC(=O)c1ccc(nc1)N(C)C AB67490 [0,2,0,0,0,0|2,0,0]=4 1199 B12R1.256 CN(C)c1ccc(cc1)C(=N)N AB18271 [0,2,0,0,0,0|2,0,0]=4 1200 B12R1.256 CN(C)c1ccc(cn1)C(=O)O AB30638 [0,2,0,0,0,0|1,0,0]=3 1201 B12R1.256 CN(C)c1ncc(cn1)C(=O)O AB25342 [0,2,0,0,0,0|2,0,0]=4 1202 B12R1.256 c1cc(ccc1C(=N)N)[N+](=O)[O-] AB05920 [0,2,0,0,0,0|1,0,1]=4 1203 B12R1.256 c1cc(ccc1C(=N)N)[N+](=O)[O-] MB01641 [0,2,0,0,0,0|1,0,1]=4 1204 B12R1.256 c1cc(ccc1C(=S)N)[N+](=O)[O-] AB23006 [0,2,0,0,0,0|1,0,1]=4 1205 B12R1.256 c1cc(ncc1C(=O)O)C(F)F AB71409 [0,2,0,0,0,0|2,0,0]=4 1206 B12R1.256 c1cc(ncc1C(F)F)C(=O)O AB74743 [0,2,0,0,0,0|2,0,0]=4 1207 B12R1.256 c1cc(ncc1[N+](=O)[O-])C(=O)O AB17947 [0,2,0,0,0,0|1,0,1]=4 1208 B12R1.452 B(=O)c1ccc(c(c1)Cl)C(=O)Cl AB30721 [0,2,0,0,0,0|2,0,0]=4 1209 B12R1.452 CC(=O)c1ccc(cc1F)OC PB30564 [0,2,0,0,0,0|2,0,0]=4 1210 B12R1.452 CCc1ccc(c(c1)O)C(=O)N MB23792 [0,2,0,0,0,0|2,0,0]=4 1211 B12R1.452 CCc1ccc(c(c1)O)C(=O)O MB23797 [0,2,0,0,0,0|1,0,0]=3 1212 B12R1.452 CCc1ccc(c(n1)O)C(=O)O AB53119 [0,2,0,0,0,0|2,0,0]=4 1213 B12R1.452 CNc1ccc(c(c1)O)C(=O)N MB37392 [0,2,0,0,0,0|1,0,0]=3 1214 B12R1.452 CNc1ccc(c(c1)O)C(=O)O MB10618 [0,2,0,0,0,0|0,0,0]=2 1215 B12R1.452 COc1cc(c(cn1)C(=O)O)Br AB67019 [0,2,0,0,0,0|2,0,0]=4 1216 B12R1.452 COc1cc(c(cn1)C(=O)O)Cl AB67014 [0,2,0,0,0,0|2,0,0]=4 1217 B12R1.452 COc1cc(c(cn1)C(=O)O)F AB67025 [0,2,0,0,0,0|2,0,0]=4 1218 B12R1.452 COc1cc(c(cn1)C(=O)O)N PB26882 [0,2,0,0,0,0|2,0,0]=4 1219 B12R1.452 COc1cc(c(cn1)C(=O)O)O AB67046 [0,2,0,0,0,0|2,0,0]=4 1220 B12R1.452 COc1cc(c(nc1)C(=O)O)N AB77164 [0,2,0,0,0,0|2,0,0]=4 1221 B12R1.452 COc1ccc(c(c1)N)C(=O)O AB06724 [0,2,0,0,0,0|1,0,0]=3 1222 B12R1.452 COc1ccc(c(n1)Cl)C(=O)O AB44161 [0,2,0,0,0,0|2,0,0]=4 1223 B12R1.452 COc1ccc(c(n1)N)C(=O)O AB69714 [0,2,0,0,0,0|2,0,0]=4 1224 B12R1.452 CSc1ccc(c(c1)O)C(=O)N MB38873 [0,2,0,0,0,0|2,0,0]=4 1225 B12R1.452 CSc1ccc(c(c1)O)C(=O)O MB07648 [0,2,0,0,0,0|1,0,0]=3 1226 B12R1.452 c1c(cnc(c1Cl)C(=O)O)C=O AB73621 [0,2,0,0,0,0|2,0,0]=4 1227 B12R1.452 c1c(cnc(c1N)C(=O)O)C=O AB83553 [0,2,0,0,0,0|2,0,0]=4 1228 B12R1.452 c1c(ncc(c1N)C(=O)O)C=O AB83443 [0,2,0,0,0,0|2,0,0]=4 1229 B12R1.452 c1cc(c(cc1C#N)O)C(=O)N MB30427 [0,2,0,0,0,0|1,0,1]=4 1230 B12R1.452 c1cc(c(cc1C#N)O)C(=O)O MB26600 [0,2,0,0,0,0|0,0,1]=3 1231 B12R1.452 c1cc(c(cc1C=O)O)C(=O)N MB37703 [0,2,0,0,0,0|2,0,0]=4 1232 B12R1.452 c1cc(c(cc1C=O)O)C(=O)O MB30837 [0,2,0,0,0,0|1,0,0]=3 1233 B12R1.452 c1cc(c(cc1CN)F)[N+](=O)[O-] AB70447 [0,2,0,0,0,0|1,0,1]=4 1234 B12R1.452 c1cc(c(cc1CN)O)C(=O)N MB36467 [0,2,0,0,0,0|1,0,0]=3 1235 B12R1.452 c1cc(c(cc1NN)Br)C(=O)N MB19783 [0,2,0,0,0,0|1,0,0]=3 1236 B12R1.452 c1cc(c(nc1C=O)N)C(=O)O AB83510 [0,2,0,0,0,0|2,0,0]=4 1237 B12R1.23 c1cc(c(cc1S(=O)(=O)N)O)N MB01259 [0,2,0,0,0,0|1,0,1]=4 1238 B12R1.126 c1cc(c(cc1N)O)S(=O)(=O)N MB36626 [0,2,0,0,0,0|1,0,1]=4 1239 B12R1.56 CC(=O)c1cc(c(cn1)N)C=O AB83635 [0,2,0,0,0,0|2,0,0]=4 1240 B12R1.56 CC(=O)c1cc(c(nc1)N)C=O AB83706 [0,2,0,0,0,0|2,0,0]=4 1241 B12R1.56 CC(=O)c1ccc(c(n1)C=O)N AB83726 [0,2,0,0,0,0|2,0,0]=4 1242 B12R1.56 CCc1cc(ccc1O)C(=O)N MB23638 [0,2,0,0,0,0|2,0,0]=4 1243 B12R1.56 CCc1cc(ccc1O)C(=O)O MB09659 [0,2,0,0,0,0|1,0,0]=3 1244 B12R1.56 CNc1cc(ccc1O)C(=O)N MB36307 [0,2,0,0,0,0|2,0,0]=4 1245 B12R1.56 CNc1cc(ccc1O)C(=O)O MB14732 [0,2,0,0,0,0|1,0,0]=3 1246 B12R1.56 COc1c(ccc(n1)C(=O)O)F AB66806 [0,2,0,0,0,0|2,0,0]=4 1247 B12R1.56 COc1cc(ccc1Br)C(=O)O AB44930 [0,2,0,0,0,0|1,0,0]=3 1248 B12R1.56 COc1cc(ccc1O)C(=O)N MB25472 [0,2,0,0,0,0|2,0,0]=4 1249 B12R1.56 COc1cc(cnc1Cl)C(=O)O AB66372 [0,2,0,0,0,0|2,0,0]=4 1250 B12R1.56 CSc1cc(ccc1O)C(=O)N MB36366 [0,2,0,0,0,0|2,0,0]=4 1251 B12R1.56 c1c(c(cnc1C(=O)O)N)C=O AB83637 [0,2,0,0,0,0|1,0,0]=3 1252 B12R1.56 c1c(c(cnc1C(=O)O)O)C=O AB84408 [0,2,0,0,0,0|2,0,0]=4 1253 B12R1.56 c1c(cnc(c1C=O)N)C(=O)O AB83709 [0,2,0,0,0,0|1,0,0]=3 1254 B12R1.56 c1c(cnc(c1C=O)O)C(=O)O AB84521 [0,2,0,0,0,0|2,0,0]=4 1255 B12R1.56 c1cc(c(cc1C(=O)N)C#N)O MB26383 [0,2,0,0,0,0|2,0,0]=4 1256 B12R1.56 c1cc(c(cc1C(=O)N)CN)O MB32597 [0,2,0,0,0,0|2,0,0]=4 1257 B12R1.56 c1cc(c(cc1C(=O)O)C#N)O MB08388 [0,2,0,0,0,0|1,0,0]=3 1258 B12R1.56 c1cc(c(cc1C(=O)O)CN)O MB02933 [0,2,0,0,0,0|1,0,0]=3 1259 B12R1.56 c1cc(c(cc1[N+](=O)[O-])C=O)N AB52848 [0,2,0,0,0,0|1,0,1]=4 1260 B12R1.56 c1cc(c(cc1[N+](=O)[O-])CO)N AB52850 [0,2,0,0,0,0|1,0,1]=4 1261 B12R1.56 c1cc(nc(c1N)C=O)C(=O)O AB83727 [0,2,0,0,0,0|1,0,0]=3 1262 B12R1.56 c1cc(nc(c1O)C=O)C(=O)O AB84568 [0,2,0,0,0,0|2,0,0]=4 1263 B12R1.232 CC(=O)c1cc(c(cc1O)Cl)F MB07188 [0,2,0,0,0,0|2,0,0]=4 1264 B12R1.232 CC(=O)c1cc(c(cc1O)O)Cl MB02763 [0,2,0,0,0,0|2,0,0]=4 1265 B12R1.232 c1c(c(cc(c1Br)O)O)C(=O)O AB00226 [0,2,0,0,0,0|1,0,0]=3 1266 B12R1.232 c1c(c(cc(c1F)F)F)C(=O)O AB01123 [0,2,0,0,0,0|1,0,0]=3 1267 B12R1.232 c1c(c(cc(c1N)O)O)C(=O)O MB08936 [0,2,0,0,0,0|1,0,0]=3 1268 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)O MB09386 [0,2,0,0,0,0|2,0,0]=4 1269 B12R1.367 CNC(=O)c1ccc(c(c1)F)O MB25391 [0,2,0,0,0,0|2,0,0]=4 1270 B12R1.367 CNC(=O)c1ccc(c(c1)I)O MB25392 [0,2,0,0,0,0|2,0,0]=4 1271 B12R1.367 CNC(=O)c1ccc(c(c1)N)O MB35206 [0,2,0,0,0,0|2,0,0]=4 1272 B12R1.367 CNC(=O)c1ccc(c(c1)O)Br MB35713 [0,2,0,0,0,0|2,0,0]=4 1273 B12R1.367 CNC(=O)c1ccc(c(c1)O)Cl MB32480 [0,2,0,0,0,0|2,0,0]=4 1274 B12R1.367 CNC(=O)c1ccc(c(c1)O)F MB25339 [0,2,0,0,0,0|2,0,0]=4 1275 B12R1.367 CNC(=O)c1ccc(c(c1)O)I MB25347 [0,2,0,0,0,0|2,0,0]=4 1276 B12R1.367 CNC(=O)c1ccc(c(c1)O)N MB25356 [0,2,0,0,0,0|1,0,0]=3 1277 B12R1.367 COC(=O)c1cc(c(cn1)F)N AB73600 [0,2,0,0,0,0|2,0,0]=4 1278 B12R1.367 COC(=O)c1cc(c(cn1)O)O PB34753 [0,2,0,0,0,0|2,0,0]=4 1279 B12R1.367 COC(=O)c1cc(c(nc1)Cl)N AB11451 [0,2,0,0,0,0|2,0,0]=4 1280 B12R1.367 COC(=O)c1cc(c(nc1)I)N AB73548 [0,2,0,0,0,0|2,0,0]=4 1281 B12R1.367 COC(=O)c1cc(c(nc1)N)Br AB25976 [0,2,0,0,0,0|1,0,0]=3 1282 B12R1.367 COC(=O)c1cc(c(nc1)N)Cl AB66518 [0,2,0,0,0,0|1,0,0]=3 1283 B12R1.367 COC(=O)c1cc(c(nc1)N)F AB73570 [0,2,0,0,0,0|1,0,0]=3 1284 B12R1.367 COC(=O)c1cc(c(nc1)N)N AB64509 [0,2,0,0,0,0|1,0,0]=3 1285 B12R1.367 COC(=O)c1cc(c(nc1)N)O AB73573 [0,2,0,0,0,0|1,0,0]=3 1286 B12R1.367 COC(=O)c1cc(c(nc1)O)N AB63058 [0,2,0,0,0,0|2,0,0]=4 1287 B12R1.367 COC(=O)c1cc(c(nc1)O)O PB37505 [0,2,0,0,0,0|2,0,0]=4 1288 B12R1.367 COC(=O)c1ccc(c(c1)Br)F AB21248 [0,2,0,0,0,0|1,0,0]=3 1289 B12R1.367 COC(=O)c1ccc(c(c1)N)Br CB10400 [0,2,0,0,0,0|1,0,0]=3 1290 B12R1.367 COC(=O)c1ccc(c(c1)N)Cl AB15542 [0,2,0,0,0,0|1,0,0]=3 1291 B12R1.367 COC(=O)c1ccc(c(c1)O)Br AB43030 [0,2,0,0,0,0|1,0,0]=3 1292 B12R1.367 COC(=O)c1ccc(c(c1)O)Cl AB64117 [0,2,0,0,0,0|1,0,0]=3 1293 B12R1.367 COC(=O)c1ccc(c(n1)N)Cl AB73568 [0,2,0,0,0,0|2,0,0]=4 1294 B12R1.367 COC(=O)c1ccc(c(n1)N)N AB60256 [0,2,0,0,0,0|1,0,0]=3 1295 B12R1.367 COC(=O)c1ccc(c(n1)O)O PB20416 [0,2,0,0,0,0|2,0,0]=4 1296 B12R1.367 COC(=O)c1cnc(c(n1)Br)N PB34445 [0,2,0,0,0,0|2,0,0]=4 1297 B12R1.367 COC(=O)c1cnc(c(n1)I)N PB33717 [0,2,0,0,0,0|2,0,0]=4 1298 B12R1.367 Cc1cc(ccc1Cl)C(=O)C=O AB45361 [0,2,0,0,0,0|1,0,1]=4 1299 B12R1.367 Cc1cc(ccc1F)C(=O)C=O AB45373 [0,2,0,0,0,0|1,0,1]=4 1300 B12R1.367 Cc1cc(ccc1O)C(=O)NC MB25368 [0,2,0,0,0,0|2,0,0]=4 1301 B12R1.367 Cc1cc(cnc1N)C(=O)OC AB66393 [0,2,0,0,0,0|1,0,0]=3 1302 B12R1.367 Cc1cc(ncc1Br)C(=O)OC AB41177 [0,2,0,0,0,0|2,0,0]=4 1303 B12R1.367 Cc1cc(ncc1Cl)C(=O)OC AB72092 [0,2,0,0,0,0|2,0,0]=4 1304 B12R1.367 Cc1cc(ncc1N)C(=O)OC PB11380 [0,2,0,0,0,0|1,0,0]=3 1305 B12R1.367 Cc1ccc(cc1F)C(=O)OC AB23209 [0,2,0,0,0,0|1,0,0]=3 1306 B12R1.367 Cc1ccc(cc1O)C(=O)NC AB63536 [0,2,0,0,0,0|2,0,0]=4 1307 B12R1.367 Cc1ccc(cc1O)C(=O)OC AB04849 [0,2,0,0,0,0|1,0,0]=3 1308 B12R1.367 Cc1ccc(nc1N)C(=O)OC AB73564 [0,2,0,0,0,0|2,0,0]=4 1309 B12R1.367 Cc1cnc(cc1N)C(=O)OC AB73592 [0,2,0,0,0,0|2,0,0]=4 1310 B12R1.367 Cn1cc(ccc1=O)C(=O)OC PB10057 [0,2,0,0,0,0|2,0,0]=4 1311 B12R1.367 Cn1ccc(cc1=O)C(=O)OC PB27549 [0,2,0,0,0,0|2,0,0]=4 1312 B12R1.367 c1cc(c(cc1C(=O)C=O)Cl)Cl AB48679 [0,2,0,0,0,0|1,0,1]=4 1313 B12R1.367 c1cc(c(cc1C(=O)C=O)F)F AB15499 [0,2,0,0,0,0|1,0,1]=4 1314 B12R1.367 c1cc(c(cc1C(=O)NN)N)O AB01234 [0,2,0,0,0,0|2,0,0]=4 1315 B12R1.893 Cc1c(c(ccc1C(=O)O)N)C CB10793 [0,2,0,0,0,0|0,0,0]=2 1316 B12R1.893 Cc1c(ccc(c1Cl)[N+](=O)[O-])N CB11200 [0,2,0,0,0,0|1,0,1]=4 1317 B12R1.893 c1c(c(c(c(n1)F)F)Cl)C(=O)O PB12582 [0,2,0,0,0,0|2,0,0]=4 1318 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)Br AB31740 [0,2,0,0,0,0|1,0,0]=3 1319 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)Cl AB31744 [0,2,0,0,0,0|1,0,0]=3 1320 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)I AB31747 [0,2,0,0,0,0|1,0,0]=3 1321 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)N AB17887 [0,2,0,0,0,0|0,0,0]=2 1322 B12R1.893 c1cc(c(c(c1C(=O)O)N)F)F AB51174 [0,2,0,0,0,0|1,0,0]=3 1323 B12R1.893 c1cc(c(c(c1C(=O)O)O)N)O MB08940 [0,2,0,0,0,0|1,0,0]=3 1324 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)N)Br AB42982 [0,2,0,0,0,0|1,0,0]=3 1325 B12R1.1005 Cc1cc(cc(c1N)I)[N+](=O)[O-] MB00587 [0,2,0,0,0,0|1,0,1]=4 1326 B12R1.1005 Cc1cc(nc(c1C)C)C(=O)O AB71658 [0,2,0,0,0,0|2,0,0]=4 1327 B12R1.1005 c1c(cc(c(c1O)F)F)C(=O)O AB21040 [0,2,0,0,0,0|1,0,0]=3 1328 B12R1.16 CCNC(=O)c1ccc(cc1)O AB63728 [0,2,0,0,0,0|2,0,0]=4 1329 B12R1.16 CCOC(=O)c1ccc(cn1)Br MB01029 [0,2,0,0,0,0|2,0,0]=4 1330 B12R1.16 CCOC(=O)c1ccc(nc1)C PB19876 [0,2,0,0,0,0|2,0,0]=4 1331 B12R1.16 CCOC(=O)c1ccc(nc1)N AB21186 [0,2,0,0,0,0|1,0,0]=3 1332 B12R1.16 CCOC(=O)c1cnc(nc1)N AB17890 [0,2,0,0,0,0|2,0,0]=4 1333 B12R1.16 CCOS(=O)c1ccc(cc1)Cl AB45706 [0,2,0,0,0,0|2,0,0]=4 1334 B12R1.16 c1cc(ccc1C(=O)CC#N)Br AB07931 [0,2,0,0,0,0|2,0,0]=4 1335 B12R1.16 c1cc(ccc1C(=O)CC#N)I AB18118 [0,2,0,0,0,0|2,0,0]=4 1336 B12R1.1703 CCC(=O)c1ccc(cc1F)Br MB09679 [0,2,0,0,0,0|2,0,0]=4 1337 B12R1.1703 CNC(=O)c1ccc(cc1Br)O MB30771 [0,2,0,0,0,0|2,0,0]=4 1338 B12R1.1703 CNC(=O)c1ccc(cc1Cl)O MB37760 [0,2,0,0,0,0|2,0,0]=4 1339 B12R1.1703 CNC(=O)c1ccc(cc1F)O MB34809 [0,2,0,0,0,0|2,0,0]=4 1340 B12R1.1703 CNC(=O)c1ccc(cc1I)O MB34084 [0,2,0,0,0,0|2,0,0]=4 1341 B12R1.1703 CNC(=O)c1ccc(cc1N)Br AB65732 [0,2,0,0,0,0|2,0,0]=4 1342 B12R1.1703 CNC(=O)c1ccc(cc1N)Cl AB49593 [0,2,0,0,0,0|2,0,0]=4 1343 B12R1.1703 CNC(=O)c1ccc(cc1N)O MB30252 [0,2,0,0,0,0|2,0,0]=4 1344 B12R1.1703 CNC(=O)c1ccc(cc1O)Br MB14847 [0,2,0,0,0,0|2,0,0]=4 1345 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl MB09389 [0,2,0,0,0,0|2,0,0]=4 1346 B12R1.1703 CNC(=O)c1ccc(cc1O)F MB25343 [0,2,0,0,0,0|2,0,0]=4 1347 B12R1.1703 CNC(=O)c1ccc(cc1O)I MB25350 [0,2,0,0,0,0|2,0,0]=4 1348 B12R1.1703 CNC(=O)c1ccc(cc1O)N MB25357 [0,2,0,0,0,0|1,0,0]=3 1349 B12R1.1703 COC(=O)c1c(cc(cn1)Br)N PB33334 [0,2,0,0,0,0|2,0,0]=4 1350 B12R1.1703 COC(=O)c1c(nc(cn1)N)N AB64401 [0,2,0,0,0,0|2,0,0]=4 1351 B12R1.1703 COC(=O)c1ccc(cc1Br)F AB23216 [0,2,0,0,0,0|1,0,0]=3 1352 B12R1.1703 COC(=O)c1ccc(cc1Cl)F PB10114 [0,2,0,0,0,0|1,0,0]=3 1353 B12R1.1703 COC(=O)c1ccc(nc1Br)N AB73582 [0,2,0,0,0,0|1,0,0]=3 1354 B12R1.1703 COC(=O)c1ccc(nc1Cl)N AB70592 [0,2,0,0,0,0|1,0,0]=3 1355 B12R1.1703 COC(=O)c1ccc(nc1F)F AB48567 [0,2,0,0,0,0|2,0,0]=4 1356 B12R1.1703 COC(=O)c1ccc(nc1N)Cl PB30193 [0,2,0,0,0,0|2,0,0]=4 1357 B12R1.1703 COC(=O)c1cnc(cc1Br)N AB73580 [0,2,0,0,0,0|1,0,0]=3 1358 B12R1.1703 COC(=O)c1cnc(cc1Cl)Cl PB23404 [0,2,0,0,0,0|2,0,0]=4 1359 B12R1.1703 COC(=O)c1cnc(cc1Cl)N AB73574 [0,2,0,0,0,0|1,0,0]=3 1360 B12R1.1703 Cc1c(ccc(n1)N)C(=O)OC AB43431 [0,2,0,0,0,0|1,0,0]=3 1361 B12R1.1703 Cc1c(ccc(n1)O)C(=O)OC AB64410 [0,2,0,0,0,0|2,0,0]=4 1362 B12R1.1703 Cc1cc(c(cn1)C(=O)OC)Br AB40710 [0,2,0,0,0,0|2,0,0]=4 1363 B12R1.1703 Cc1cc(c(cn1)C(=O)OC)Cl AB40714 [0,2,0,0,0,0|2,0,0]=4 1364 B12R1.1703 Cc1cc(ccc1C(=O)OC)Br AB55602 [0,2,0,0,0,0|1,0,0]=3 1365 B12R1.1703 Cc1cc(cnc1C(=O)OC)Br AB41229 [0,2,0,0,0,0|2,0,0]=4 1366 B12R1.1703 Cc1cc(cnc1C(=O)OC)Cl AB41234 [0,2,0,0,0,0|2,0,0]=4 1367 B12R1.1703 Cc1ccc(c(c1)Br)C(=O)OC AB16571 [0,2,0,0,0,0|1,0,0]=3 1368 B12R1.1703 Cc1ccc(c(c1)O)C(=O)NC MB09401 [0,2,0,0,0,0|2,0,0]=4 1369 B12R1.1703 Cc1ccc(c(n1)O)C(=O)OC AB55505 [0,2,0,0,0,0|2,0,0]=4 1370 B12R1.1703 c1cc(c(cc1Cl)Cl)C(=O)CN CB10300 [0,2,0,0,0,0|2,0,0]=4 1371 B12R1.1703 c1cc(c(cc1F)F)C(=O)C=O AB14112 [0,2,0,0,0,0|1,0,1]=4 1372 B12R1.1703 c1cc(c(cc1O)O)C(=O)CBr AB16102 [0,2,0,0,0,0|2,0,0]=4 1373 B12R1.57 CCc1cc(ccc1C(=O)N)O MB23744 [0,2,0,0,0,0|2,0,0]=4 1374 B12R1.57 CCc1cc(ccc1C(=O)O)O MB23747 [0,2,0,0,0,0|1,0,0]=3 1375 B12R1.57 CNc1cc(ccc1C(=O)N)O MB36251 [0,2,0,0,0,0|2,0,0]=4 1376 B12R1.57 CNc1cc(ccc1C(=O)O)O MB33236 [0,2,0,0,0,0|1,0,0]=3 1377 B12R1.57 COc1c(ccc(n1)Br)C(=O)O AB67021 [0,2,0,0,0,0|2,0,0]=4 1378 B12R1.57 COc1c(ccc(n1)Cl)C(=O)O AB64672 [0,2,0,0,0,0|2,0,0]=4 1379 B12R1.57 COc1c(ccc(n1)F)C(=O)O AB67028 [0,2,0,0,0,0|2,0,0]=4 1380 B12R1.57 COc1c(ccc(n1)N)C(=O)O AB43430 [0,2,0,0,0,0|1,0,0]=3 1381 B12R1.57 COc1cc(ccc1C(=O)N)O MB26783 [0,2,0,0,0,0|2,0,0]=4 1382 B12R1.57 COc1cc(ccc1C(=O)O)O MB03687 [0,2,0,0,0,0|1,0,0]=3 1383 B12R1.57 COc1cc(ncc1C(=O)O)Br AB67868 [0,2,0,0,0,0|2,0,0]=4 1384 B12R1.57 COc1cc(ncc1C(=O)O)Cl AB55875 [0,2,0,0,0,0|2,0,0]=4 1385 B12R1.57 COc1cc(ncc1C(=O)O)F AB67874 [0,2,0,0,0,0|2,0,0]=4 1386 B12R1.57 COc1cc(ncc1C(=O)O)N AB67877 [0,2,0,0,0,0|1,0,0]=3 1387 B12R1.57 CSc1cc(ccc1C(=O)N)O MB27987 [0,2,0,0,0,0|2,0,0]=4 1388 B12R1.57 CSc1cc(ccc1C(=O)O)O MB31488 [0,2,0,0,0,0|1,0,0]=3 1389 B12R1.57 c1cc(c(cc1O)C#N)C(=O)N MB34280 [0,2,0,0,0,0|2,0,0]=4 1390 B12R1.57 c1cc(c(cc1O)C#N)C(=O)O MB38049 [0,2,0,0,0,0|1,0,0]=3 1391 B12R1.57 c1cc(c(cc1O)C=O)C(=O)N MB35479 [0,2,0,0,0,0|2,0,0]=4 1392 B12R1.57 c1cc(c(cc1O)C=O)C(=O)O MB26938 [0,2,0,0,0,0|1,0,0]=3 1393 B12R1.57 c1cc(c(cc1O)CN)C(=O)N MB29099 [0,2,0,0,0,0|2,0,0]=4 1394 B12R1.57 c1cc(c(cc1O)CN)C(=O)O MB27880 [0,2,0,0,0,0|1,0,0]=3 1395 B12R1.1000 Cc1cc(c(c(n1)Cl)C(=O)O)Cl AB13101 [0,2,0,0,0,0|2,0,0]=4 1396 B12R1.1000 Cc1cc(cc(c1C(=O)O)C)Br MB08312 [0,2,0,0,0,0|1,0,0]=3 1397 B12R1.1000 Cc1cc(cc(c1C(=O)O)C)O CB10467 [0,2,0,0,0,0|1,0,0]=3 1398 B12R1.1000 Cc1cc(nc(c1C(=O)O)C)Cl AB23712 [0,2,0,0,0,0|2,0,0]=4 1399 B12R1.1000 Cc1cc(nc(c1C(=O)O)Cl)Cl PB15719 [0,2,0,0,0,0|2,0,0]=4 1400 B12R1.1000 c1c(c(c(nc1Cl)Cl)C(=O)O)N AB76234 [0,2,0,0,0,0|2,0,0]=4 1401 B12R1.1000 c1c(cc(c(c1Cl)C(=O)N)Cl)Br MB14420 [0,2,0,0,0,0|2,0,0]=4 1402 B12R1.1000 c1c(cc(c(c1Cl)C(=O)O)Cl)Br MB09861 [0,2,0,0,0,0|1,0,0]=3 1403 B12R1.1000 c1c(cc(c(c1F)C(=O)O)F)Br CB10650 [0,2,0,0,0,0|1,0,0]=3 1404 B12R1.1000 c1c(cc(c(c1N)C(=O)O)F)F AB15580 [0,2,0,0,0,0|1,0,0]=3 1405 B12R2.606 Cc1ccc2=NC(=O)N=c2c1 AB07026 [0,0,0,1,0,1|2,0,0]=4 1406 B12R2.606 Cc1ccc2c(c1)oc(n2)Cl AB65043 [0,0,0,1,0,1|2,0,0]=4 1407 B12R2.606 Cc1ccc2c(c1)oc(n2)S AB03206 [0,0,0,1,0,1|1,1,0]=4 1408 B12R2.606 Cc1nc2ccc(cc2o1)Br AB25987 [0,0,0,1,0,1|2,0,0]=4 1409 B12R2.606 Cc1nc2ccc(cc2o1)Cl AB49156 [0,0,0,1,0,1|2,0,0]=4 1410 B12R2.606 c1c(cnc2c1oc(=O)[nH]2)N AB65779 [0,0,0,1,0,1|1,0,0]=3 1411 B12R2.606 c1cc2=NC(=O)N=c2cc1Br AB10496 [0,0,0,1,0,1|2,0,0]=4 1412 B12R2.606 c1cc2=NC(=O)N=c2cc1F AB21861 [0,0,0,1,0,1|2,0,0]=4 1413 B12R2.606 c1cc2=NC(=O)N=c2cc1I AB21858 [0,0,0,1,0,1|2,0,0]=4 1414 B12R2.606 c1cc2c(cc1Br)CC(=O)C2 AB42440 [0,0,0,1,0,1|2,0,0]=4 1415 B12R2.606 c1cc2c(cc1Br)CC(=O)N2 PB32208 [0,0,0,1,0,1|2,0,0]=4 1416 B12R2.606 c1cc2c(cc1Br)NC(=O)C2 PB24760 [0,0,0,1,0,1|2,0,0]=4 1417 B12R2.606 c1cc2c(cc1Br)oc(n2)Cl AB63667 [0,0,0,1,0,1|2,0,0]=4 1418 B12R2.606 c1cc2c(cc1Br)oc(n2)N MB01972 [0,0,0,1,0,1|2,0,0]=4 1419 B12R2.606 c1cc2c(cc1Cl)CC(=O)N2 AB04636 [0,0,0,1,0,1|2,0,0]=4 1420 B12R2.606 c1cc2c(cc1Cl)NC(=O)C2 AB04797 [0,0,0,1,0,1|2,0,0]=4 1421 B12R2.606 c1cc2c(cc1Cl)oc(n2)Cl AB32054 [0,0,0,1,0,1|2,0,0]=4 1422 B12R2.606 c1cc2c(cc1Cl)oc(n2)N AB09701 [0,0,0,1,0,1|2,0,0]=4 1423 B12R2.606 c1cc2c(cc1Cl)oc(n2)S AB07270 [0,0,0,1,0,1|1,1,0]=4 1424 B12R2.606 c1cc2c(cc1F)CC(=O)N2 AB11374 [0,0,0,1,0,1|2,0,0]=4 1425 B12R2.606 c1cc2c(cc1F)NC(=O)C2 AB02036 [0,0,0,1,0,1|2,0,0]=4 1426 B12R2.606 c1cc2c(cc1I)CC(=O)N2 MB06441 [0,0,0,1,0,1|2,0,0]=4 1427 B12R2.606 c1cc2c(cc1N)CC(=O)N2 PB27577 [0,0,0,1,0,1|1,0,0]=3 1428 B12R2.606 c1cc2c(cc1N)NC(=O)C2 PB17556 [0,0,0,1,0,1|1,0,0]=3 1429 B12R2.606 c1cc2c(cc1N)nc(s2)S AB66150 [0,0,0,1,0,1|1,1,0]=4 1430 B12R2.606 c1cc2c(cc1N)oc(n2)S AB48296 [0,0,0,1,0,1|0,1,0]=3 1431 B12R2.606 c1cc2c(cc1N)sc(n2)S AB02354 [0,0,0,1,0,1|0,2,0]=4 1432 B12R2.606 c1cc2c(cc1O)NC(=O)C2 AB21813 [0,0,0,1,0,1|2,0,0]=4 1433 B12R2.612 Cc1ccc2c(c1)CNC2=O MB07070 [0,1,0,1,0,0|2,0,0]=4 1434 B12R2.612 Cc1ccc2c(c1)onc2Cl AB25984 [0,1,0,1,0,0|2,0,0]=4 1435 B12R2.612 Cc1ccc2c(n1)OCC2=O AB70120 [0,1,0,1,0,0|2,0,0]=4 1436 B12R2.612 c1c2c(cnc1Cl)C(=O)OC2 PB27327 [0,1,0,1,0,0|2,0,0]=4 1437 B12R2.612 c1cc(nc2c1C(=O)CO2)Cl AB70109 [0,1,0,1,0,0|2,0,0]=4 1438 B12R2.612 c1cc2c(cc1Br)CNC2=O PB29649 [0,1,0,1,0,0|2,0,0]=4 1439 B12R2.612 c1cc2c(cc1Br)OCC2=O AB45183 [0,1,0,1,0,0|1,0,0]=3 1440 B12R2.612 c1cc2c(cc1Br)onc2Cl MB11909 [0,1,0,1,0,0|2,0,0]=4 1441 B12R2.612 c1cc2c(cc1Br)onc2N MB07663 [0,1,0,1,0,0|2,0,0]=4 1442 B12R2.612 c1cc2c(cc1Cl)CCC2=O AB01874 [0,1,0,1,0,0|2,0,0]=4 1443 B12R2.612 c1cc2c(cc1Cl)CNC2=O MB05670 [0,1,0,1,0,0|2,0,0]=4 1444 B12R2.612 c1cc2c(cc1Cl)N=NC2=O AB60847 [0,1,0,1,0,0|2,0,0]=4 1445 B12R2.612 c1cc2c(cc1Cl)OCC2=O AB27747 [0,1,0,1,0,0|1,0,0]=3 1446 B12R2.612 c1cc2c(cc1Cl)onc2Cl AB25981 [0,1,0,1,0,0|2,0,0]=4 1447 B12R2.612 c1cc2c(cc1F)CCC2=O AB01853 [0,1,0,1,0,0|2,0,0]=4 1448 B12R2.612 c1cc2c(cc1F)CNC2=O AB71859 [0,1,0,1,0,0|2,0,0]=4 1449 B12R2.612 c1cc2c(cc1F)OCC2=O AB51227 [0,1,0,1,0,0|1,0,0]=3 1450 B12R2.612 c1cc2c(cc1F)onc2Cl AB71606 [0,1,0,1,0,0|2,0,0]=4 1451 B12R2.612 c1cc2c(cc1I)CCC2=O MB07544 [0,1,0,1,0,0|2,0,0]=4 1452 B12R2.612 c1cc2c(cc1N)CNC2=O PB14793 [0,1,0,1,0,0|1,0,0]=3 1453 B12R2.612 c1cc2c(cc1O)CNC2=O AB56006 [0,1,0,1,0,0|2,0,0]=4 1454 B8R1.1 Cc1ccc(s1)C=O AB00417 [1,0,0,0,1,0|2,0,0]=4 1455 B8R1.1 c1c(csc1Br)C=O PB31345 [1,0,0,0,1,0|2,0,0]=4 1456 B8R1.1 c1c(csc1C=O)Br PB24526 [1,0,0,0,1,0|2,0,0]=4 1457 B8R1.1 c1c(csc1C=O)Cl PB20572 [1,0,0,0,1,0|2,0,0]=4 1458 B8R1.1 c1c(csc1Cl)C=O PB18241 [1,0,0,0,1,0|2,0,0]=4 1459 B8R1.1 c1c(sc(n1)N)C=O AB11362 [1,0,0,0,1,0|2,0,0]=4 1460 B8R1.1 c1cc(sc1C=O)Br PB32069 [1,0,0,0,1,0|2,0,0]=4 1461 B8R1.1 c1cc(sc1C=O)Cl PB17085 [1,0,0,0,1,0|2,0,0]=4 1462 B8R1.7 C1C=C(C=N1)C(=O)O MB01464 [1,0,0,0,1,0|1,0,1]=4 1463 B8R1.7 CC(=O)c1ccsc1 PB17033 [1,0,0,0,1,0|2,0,0]=4 1464 B8R1.7 c1c(con1)C(=O)O AB27926 [1,0,0,0,1,0|2,0,0]=4 1465 B8R1.7 c1c(csn1)C(=O)O AB48586 [1,0,0,0,1,0|2,0,0]=4 1466 B8R1.7 c1c(nco1)C(=O)O PB14470 [1,0,0,0,1,0|2,0,0]=4 1467 B8R1.7 c1c(ncs1)C(=O)O AB06561 [1,0,0,0,1,0|2,0,0]=4 1468 B8R1.7 c1c(ocn1)C(=O)O AB19293 [1,0,0,0,1,0|2,0,0]=4 1469 B8R1.7 c1c(scn1)C(=O)O AB15430 [1,0,0,0,1,0|2,0,0]=4 1470 B8R1.7 c1cnsc1C(=O)O AB32452 [1,0,0,0,1,0|2,0,0]=4 1471 B8R1.7 c1coc(n1)C(=O)O AB19305 [1,0,0,0,1,0|2,0,0]=4 1472 B8R1.7 c1cocc1C(=O)O PB30525 [1,0,0,0,1,0|1,0,0]=3 1473 B8R1.7 c1conc1C(=O)O PB26232 [1,0,0,0,1,0|2,0,0]=4 1474 B8R1.7 c1csc(n1)C(=O)O AB10888 [1,0,0,0,1,0|2,0,0]=4 1475 B8R1.7 c1cscc1C(=O)O PB18386 [1,0,0,0,1,0|1,0,0]=3 1476 B8R1.7 c1csnc1C(=O)O PB34433 [1,0,0,0,1,0|2,0,0]=4 1477 B10R1.18 B(Cc1ccccc1)(O)O AB08328 [1,0,0,0,0,1|1,0,1]=4 1478 B10R1.18 CC(=O)Cc1ccccn1 AB03323 [1,0,0,0,0,1|2,0,0]=4 1479 B10R1.18 CC(=O)Cc1cccnc1 AB29343 [1,0,0,0,0,1|2,0,0]=4 1480 B10R1.18 CC(=O)Cc1cccnc1 AB45525 [1,0,0,0,0,1|2,0,0]=4 1481 B10R1.18 CC(=O)Nc1ccncc1 AB06982 [1,0,0,0,0,1|2,0,0]=4 1482 B10R1.18 c1c(cncn1)CC(=O)O PB12648 [1,0,0,0,0,1|2,0,0]=4 1483 B10R1.18 c1cc(cnc1)CC(=O)O AB01106 [1,0,0,0,0,1|1,0,0]=3 1484 B10R1.18 c1cc(nnc1)CC(=O)O PB14847 [1,0,0,0,0,1|2,0,0]=4 1485 B10R1.18 c1ccc(cc1)CC(=N)N AB29087 [1,0,0,0,0,1|2,0,0]=4 1486 B10R1.18 c1cnc(cn1)CC(=O)O PB10382 [1,0,0,0,0,1|2,0,0]=4 1487 B10R1.18 c1cnc(nc1)CC(=O)O PB34087 [1,0,0,0,0,1|2,0,0]=4 1488 B10R1.18 c1cncnc1CC(=O)O PB21983 [1,0,0,0,0,1|2,0,0]=4 1489 B10R1.18 c1cnncc1CC(=O)O PB31426 [1,0,0,0,0,1|2,0,0]=4 1490 B12R1.21 CC(=O)COc1ccc(cc1)Br AB26100 [0,0,0,0,0,2|2,0,0]=4 1491 B12R1.21 CC(=O)COc1ccc(cc1)Cl AB26096 [0,0,0,0,0,2|2,0,0]=4 1492 B12R1.21 CC(=O)COc1ccc(cc1)F AB26104 [0,0,0,0,0,2|2,0,0]=4 1493 B12R1.21 CC(=O)COc1ccc(cc1)I AB26107 [0,0,0,0,0,2|2,0,0]=4 1494 B12R1.21 Cc1ccc(cc1)CCC(=O)O AB01198 [0,0,0,0,0,2|1,0,0]=3 1495 B12R1.21 Cc1ccc(cc1)OCC(=O)C AB26110 [0,0,0,0,0,2|2,0,0]=4 1496 B12R1.21 c1cc(ccc1CCC(=O)O)Br AB08447 [0,0,0,0,0,2|1,0,0]=3 1497 B12R1.21 c1cc(ccc1CCC(=O)O)Cl AB01196 [0,0,0,0,0,2|1,0,0]=3 1498 B12R1.21 c1cc(ccc1CCC(=O)O)F AB02388 [0,0,0,0,0,2|1,0,0]=3 1499 B12R1.21 c1cc(ccc1CCC(=O)O)N AB01235 [0,0,0,0,0,2|0,0,0]=2 1500 B12R1.21 c1cc(ccc1CCC(=O)O)O AB00269 [0,0,0,0,0,2|1,0,0]=3 1501 B12R1.21 c1cc(ccc1CNC(=N)N)N AB48587 [0,0,0,0,0,2|2,0,0]=4 1502 B12R1.21 c1cc(ccc1OCC(=O)O)Cl AB00355 [0,0,0,0,0,2|1,0,0]=3 1503 B12R1.21 c1cc(ccc1\C=C\C(=O)O)Br AB00374 [0,0,0,0,0,2|1,0,0]=3 1504 B12R1.21 c1cc(ccc1\C=C\C(=O)O)Cl AB00377 [0,0,0,0,0,2|1,0,0]=3 1505 B12R1.21 c1cc(ccc1\C=C\C(=O)O)F AB00375 [0,0,0,0,0,2|1,0,0]=3