0 B11R1.166 B(c1ccc(cc1C)C)(O)O LS10933 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.166 B(c1ccc(cc1C)Cl)(O)O LS11030 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.166 B(c1ccc(cc1C)F)(O)O LS11036 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.166 B(c1ccc(cc1C)O)(O)O LS11044 [0,0,0,0,0,0|2,0,1]=3 4 B11R1.166 B(c1ccc(cc1Cl)C)(O)O LS11410 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.166 B(c1ccc(cc1Cl)Cl)(O)O LS10929 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.166 B(c1ccc(cc1Cl)F)(O)O LS10970 [0,0,0,0,0,0|3,0,1]=4 7 B11R1.166 B(c1ccc(cc1F)Br)(O)O LS11028 [0,0,0,0,0,0|3,0,1]=4 8 B11R1.166 B(c1ccc(cc1F)C)(O)O LS10981 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.166 B(c1ccc(cc1F)Cl)(O)O LS10243 [0,0,0,0,0,0|3,0,1]=4 10 B11R1.166 B(c1ccc(cc1F)F)(O)O LS10930 [0,0,0,0,0,0|3,0,1]=4 11 B11R1.166 CC(=O)c1ccc(cc1Cl)Br LS10361 [0,0,0,0,0,0|3,0,0]=3 12 B11R1.166 CC(=O)c1ccc(cc1F)Cl LS10306 [0,0,0,0,0,0|3,0,0]=3 13 B11R1.166 CC(=O)c1ccc(cc1O)F LS10126 [0,0,0,0,0,0|2,0,0]=2 14 B11R1.166 Cc1c(ccc(n1)O)[N+](=O)[O-] LS20738 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.166 Cc1cc(ccc1C(=O)O)F LS10581 [0,0,0,0,0,0|2,0,0]=2 16 B11R1.166 Cc1cc(ccc1C(C)C)O LS10720 [0,0,0,0,0,0|3,0,1]=4 17 B11R1.166 Cc1cc(ccc1[N+](=O)[O-])F LS11421 [0,0,0,0,0,0|3,0,1]=4 18 B11R1.166 Cc1cc(ncc1[N+](=O)[O-])O LS20746 [0,0,0,0,0,0|3,0,1]=4 19 B11R1.166 Cc1ccc(c(c1)F)C(=O)O LS10521 [0,0,0,0,0,0|2,0,0]=2 20 B11R1.166 Cc1ccc(c(c1)F)[N+](=O)[O-] LS10436 [0,0,0,0,0,0|3,0,1]=4 21 B11R1.166 Cc1ccc(c(n1)Cl)C(=O)O LS20787 [0,0,0,0,0,0|3,0,0]=3 22 B11R1.166 c1c(c(=O)[nH]c(=O)[nH]1)C(=O)O LS20799 [0,0,0,0,0,0|2,0,2]=4 23 B11R1.166 c1c(cnc(c1Br)C(=O)O)Br LS20021 [0,0,0,0,0,0|3,0,0]=3 24 B11R1.166 c1cc(c(cc1Br)Br)C(=O)O LS10326 [0,0,0,0,0,0|2,0,0]=2 25 B11R1.166 c1cc(c(cc1Br)Cl)C(=O)O LS10346 [0,0,0,0,0,0|2,0,0]=2 26 B11R1.166 c1cc(c(cc1Br)F)C(=O)O LS10691 [0,0,0,0,0,0|2,0,0]=2 27 B11R1.166 c1cc(c(cc1Br)F)[N+](=O)[O-] LS10479 [0,0,0,0,0,0|3,0,1]=4 28 B11R1.166 c1cc(c(cc1Br)N)C(=O)O LS11470 [0,0,0,0,0,0|2,0,0]=2 29 B11R1.166 c1cc(c(cc1Cl)Cl)C(=O)O LS10673 [0,0,0,0,0,0|2,0,0]=2 30 B11R1.166 c1cc(c(cc1Cl)F)[N+](=O)[O-] LS00111 [0,0,0,0,0,0|3,0,1]=4 31 B11R1.166 c1cc(c(cc1Cl)N)C(=O)N LS10587 [0,0,0,0,0,0|3,0,0]=3 32 B11R1.166 c1cc(c(cc1Cl)N)C(=O)O LS11433 [0,0,0,0,0,0|2,0,0]=2 33 B11R1.166 c1cc(c(cc1Cl)O)C(=O)O LS10716 [0,0,0,0,0,0|1,0,0]=1 34 B11R1.166 c1cc(c(cc1F)Br)[N+](=O)[O-] LS10299 [0,0,0,0,0,0|3,0,1]=4 35 B11R1.166 c1cc(c(cc1F)Cl)[N+](=O)[O-] LS10294 [0,0,0,0,0,0|3,0,1]=4 36 B11R1.166 c1cc(c(cc1F)F)C(=O)[O-] LS11163 [0,0,0,0,0,0|2,0,1]=3 37 B11R1.166 c1cc(c(cc1F)N)C(=O)O LS10234 [0,0,0,0,0,0|2,0,0]=2 38 B11R1.166 c1cc(c(cc1F)N)[N+](=O)[O-] LS10279 [0,0,0,0,0,0|3,0,1]=4 39 B11R1.166 c1cc(c(cc1F)O)C(=O)O LS11396 [0,0,0,0,0,0|1,0,0]=1 40 B11R1.166 c1cc(c(cc1N)Br)[N+](=O)[O-] LS10292 [0,0,0,0,0,0|3,0,1]=4 41 B11R1.166 c1cc(c(cc1N)Cl)C(=O)O LS10725 [0,0,0,0,0,0|2,0,0]=2 42 B11R1.166 c1cc(c(cc1N)F)[N+](=O)[O-] LS10280 [0,0,0,0,0,0|3,0,1]=4 43 B11R1.166 c1cc(c(cc1O)Cl)C(=O)O LS11739 [0,0,0,0,0,0|1,0,0]=1 44 B11R1.166 c1cc(c(cc1O)F)[N+](=O)[O-] LS00120 [0,0,0,0,0,0|2,0,1]=3 45 B11R1.166 c1cc(c(cc1O)I)[N+](=O)[O-] LS10155 [0,0,0,0,0,0|2,0,1]=3 46 B11R1.166 c1cc(c(cc1O)O)C(=O)N LS10714 [0,0,0,0,0,0|1,0,0]=1 47 B11R1.166 c1cc(nc(c1C(=O)O)Cl)Cl LS20515 [0,0,0,0,0,0|3,0,0]=3 48 B11R1.166 c1cc(nc(c1[N+](=O)[O-])Cl)O LS20715 [0,0,0,0,0,0|3,0,1]=4 49 B11R1.166 c1cc(nc(c1[N+](=O)[O-])O)Cl LS20717 [0,0,0,0,0,0|3,0,1]=4 50 B10R1.13 B(c1ccc(cc1)Br)(O)O LS10182 [1,0,0,0,0,0|2,0,1]=4 51 B10R1.13 B(c1ccc(cc1)C)(O)O LS00088 [1,0,0,0,0,0|2,0,1]=4 52 B10R1.13 B(c1ccc(cc1)Cl)(O)O LS00091 [1,0,0,0,0,0|2,0,1]=4 53 B10R1.13 B(c1ccc(cc1)F)(O)O LS00090 [1,0,0,0,0,0|2,0,1]=4 54 B10R1.13 B(c1ccc(cc1)I)(O)O LS10893 [1,0,0,0,0,0|2,0,1]=4 55 B10R1.13 B(c1ccc(cc1)N)(O)O LS10039 [1,0,0,0,0,0|2,0,1]=4 56 B10R1.13 B(c1ccc(cc1)O)(O)O LS10892 [1,0,0,0,0,0|1,0,1]=3 57 B10R1.13 B(c1ccc(cc1)S)(O)O LS00089 [1,0,0,0,0,0|1,1,1]=4 58 B10R1.13 CC(=O)c1ccc(cc1)Br LS11874 [1,0,0,0,0,0|2,0,0]=3 59 B10R1.13 CC(=O)c1ccc(cc1)F LS11575 [1,0,0,0,0,0|2,0,0]=3 60 B10R1.13 CC(=O)c1ccc(cc1)N LS10360 [1,0,0,0,0,0|2,0,0]=3 61 B10R1.13 CC(=O)c1ccc(cc1)O LS10359 [1,0,0,0,0,0|1,0,0]=2 62 B10R1.13 CC(=O)c1ccc(cn1)Br LS20859 [1,0,0,0,0,0|3,0,0]=4 63 B10R1.13 CC(=O)c1ccc(nc1)Br LS21178 [1,0,0,0,0,0|3,0,0]=4 64 B10R1.13 Cc1ccc(cn1)C(=O)O LS20541 [1,0,0,0,0,0|2,0,0]=3 65 B10R1.13 Cc1ncc(cn1)C(=O)O LS20220 [1,0,0,0,0,0|3,0,0]=4 66 B10R1.13 c1c(cnc(n1)Cl)C(=O)O LS21033 [1,0,0,0,0,0|3,0,0]=4 67 B10R1.13 c1c(cnc(n1)N)C(=O)O LS20168 [1,0,0,0,0,0|3,0,0]=4 68 B10R1.13 c1c(ncc(n1)Cl)C(=O)O LS20205 [1,0,0,0,0,0|3,0,0]=4 69 B10R1.13 c1c(ncc(n1)O)C(=O)O LS20206 [1,0,0,0,0,0|2,0,0]=3 70 B10R1.13 c1cc(ccc1C(=N)N)Br LS00131 [1,0,0,0,0,0|3,0,0]=4 71 B10R1.13 c1cc(ccc1C(=O)Cl)N LS11728 [1,0,0,0,0,0|2,0,0]=3 72 B10R1.13 c1cc(ccc1C(=O)O)Cl LS10674 [1,0,0,0,0,0|1,0,0]=2 73 B10R1.13 c1cc(ccc1N)[N+](=O)[O-] LS10622 [1,0,0,0,0,0|2,0,1]=4 74 B10R1.13 c1cc(ccc1[N+](=O)[O-])Cl LS10621 [1,0,0,0,0,0|2,0,1]=4 75 B10R1.13 c1cc(ncc1Br)C(=O)O LS20244 [1,0,0,0,0,0|2,0,0]=3 76 B10R1.13 c1cc(ncc1C(=O)O)Cl LS20664 [1,0,0,0,0,0|2,0,0]=3 77 B10R1.13 c1cc(ncc1C(=O)O)N LS20730 [1,0,0,0,0,0|2,0,0]=3 78 B10R1.13 c1cc(ncc1F)C(=O)O LS20092 [1,0,0,0,0,0|2,0,0]=3 79 B10R1.13 c1cc(ncc1[N+](=O)[O-])O LS20531 [1,0,0,0,0,0|2,0,1]=4 80 B10R1.25 COc1ccc(cc1F)O LS10467 [1,0,0,0,0,0|3,0,0]=4 81 B10R1.25 Cc1cc(ccc1C=O)F LS10500 [1,0,0,0,0,0|2,0,0]=3 82 B10R1.25 Cc1cc(ccc1C=O)O LS11394 [1,0,0,0,0,0|1,0,0]=2 83 B10R1.25 c1cc(c(cc1Br)Br)CO LS11326 [1,0,0,0,0,0|2,0,1]=4 84 B10R1.25 c1cc(c(cc1Br)F)C=O LS10657 [1,0,0,0,0,0|2,0,0]=3 85 B10R1.25 c1cc(c(cc1Br)O)C=O LS10088 [1,0,0,0,0,0|1,0,0]=2 86 B10R1.25 c1cc(c(cc1Cl)Br)C=O LS10197 [1,0,0,0,0,0|2,0,0]=3 87 B10R1.25 c1cc(c(cc1Cl)F)C=O LS10509 [1,0,0,0,0,0|2,0,0]=3 88 B10R1.25 c1cc(c(cc1Cl)O)C=O LS11382 [1,0,0,0,0,0|1,0,0]=2 89 B10R1.25 c1cc(c(cc1F)Br)C=O LS10393 [1,0,0,0,0,0|2,0,0]=3 90 B10R1.25 c1cc(c(cc1F)Cl)C=O LS11829 [1,0,0,0,0,0|2,0,0]=3 91 B10R1.25 c1cc(c(cc1F)O)C=O LS10219 [1,0,0,0,0,0|1,0,0]=2 92 B10R1.25 c1cc(c(cc1O)Cl)C#N LS10262 [1,0,0,0,0,0|2,0,1]=4 93 B10R1.25 c1cc(c(cc1O)Cl)C=O LS11740 [1,0,0,0,0,0|1,0,0]=2 94 B10R1.61 B(c1ccccc1Br)(O)O LS10792 [1,0,0,0,0,0|2,0,1]=4 95 B10R1.61 B(c1ccccc1C)(O)O LS10802 [1,0,0,0,0,0|2,0,1]=4 96 B10R1.61 B(c1ccccc1Cl)(O)O LS00151 [1,0,0,0,0,0|2,0,1]=4 97 B10R1.61 B(c1ccccc1F)(O)O LS10797 [1,0,0,0,0,0|2,0,1]=4 98 B10R1.61 B(c1ccccc1N)(O)O LS10787 [1,0,0,0,0,0|2,0,1]=4 99 B10R1.61 B(c1ccccc1O)(O)O LS10799 [1,0,0,0,0,0|1,0,1]=3 100 B10R1.61 CC(=O)c1ccccc1N LS10731 [1,0,0,0,0,0|2,0,0]=3 101 B10R1.61 CC(=O)c1ccccc1O LS10607 [1,0,0,0,0,0|1,0,0]=2 102 B10R1.61 CC(=O)c1cccnc1Cl LS20570 [1,0,0,0,0,0|3,0,0]=4 103 B10R1.61 C[C@H](c1ccccc1Cl)O LS30121 [1,0,0,0,0,0|2,0,1]=4 104 B10R1.61 Cc1c(cccn1)C(=O)N LS20770 [1,0,0,0,0,0|3,0,0]=4 105 B10R1.61 Cc1c(cccn1)C(=O)O LS20435 [1,0,0,0,0,0|2,0,0]=3 106 B10R1.61 Cc1c(cncn1)C(=O)O LS20826 [1,0,0,0,0,0|3,0,0]=4 107 B10R1.61 Cc1ccccc1C(=O)O LS10119 [1,0,0,0,0,0|1,0,0]=2 108 B10R1.61 Cc1cccnc1C(=O)O LS20983 [1,0,0,0,0,0|2,0,0]=3 109 B10R1.61 c1cc(c(nc1)Br)C(=O)O LS20396 [1,0,0,0,0,0|2,0,0]=3 110 B10R1.61 c1cc(c(nc1)C(=O)O)F LS20394 [1,0,0,0,0,0|2,0,0]=3 111 B10R1.61 c1cc(c(nc1)C(=O)O)N LS00020 [1,0,0,0,0,0|2,0,0]=3 112 B10R1.61 c1cc(c(nc1)Cl)C(=O)O LS20665 [1,0,0,0,0,0|2,0,0]=3 113 B10R1.61 c1cc(c(nc1)N)C(=O)O LS20530 [1,0,0,0,0,0|2,0,0]=3 114 B10R1.61 c1cc(c(nc1)O)C(=O)O LS20423 [1,0,0,0,0,0|1,0,0]=2 115 B10R1.61 c1cc(c(nc1)S)C(=O)O LS20725 [1,0,0,0,0,0|1,1,0]=3 116 B10R1.61 c1cc(c(nc1)[N+](=O)[O-])O LS20836 [1,0,0,0,0,0|2,0,1]=4 117 B10R1.61 c1ccc(c(c1)C(=O)N)N LS11473 [1,0,0,0,0,0|2,0,0]=3 118 B10R1.61 c1ccc(c(c1)C(=O)O)Br LS10336 [1,0,0,0,0,0|1,0,0]=2 119 B10R1.61 c1ccc(c(c1)C(=O)O)Cl LS10675 [1,0,0,0,0,0|1,0,0]=2 120 B10R1.61 c1ccc(c(c1)C(=O)O)I LS00003 [1,0,0,0,0,0|1,0,0]=2 121 B10R1.61 c1ccc(c(c1)N)[N+](=O)[O-] LS11572 [1,0,0,0,0,0|2,0,1]=4 122 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])Br LS11477 [1,0,0,0,0,0|2,0,1]=4 123 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])I LS11476 [1,0,0,0,0,0|2,0,1]=4 124 B10R1.61 c1cnc(c(n1)C(=O)O)O LS20287 [1,0,0,0,0,0|2,0,0]=3 125 B10R1.61 c1cncc(c1C(=O)O)Br LS20726 [1,0,0,0,0,0|2,0,0]=3 126 B10R1.61 c1cncc(c1C(=O)O)F LS20409 [1,0,0,0,0,0|2,0,0]=3 127 B10R1.61 c1cncc(c1C(=O)O)N LS20439 [1,0,0,0,0,0|2,0,0]=3 128 B10R1.61 c1cncc(c1C(=O)O)O LS20035 [1,0,0,0,0,0|1,0,0]=2 129 B10R1.61 c1cncc(c1Cl)C(=O)O LS20834 [1,0,0,0,0,0|2,0,0]=3 130 B12R1.57 COc1cc(ccc1C(=O)O)F LS10248 [0,1,0,0,0,0|1,0,0]=2 131 B12R1.57 COc1cc(ccc1[N+](=O)[O-])F LS10561 [0,1,0,0,0,0|2,0,1]=4 132 B12R1.57 c1cc(c(cc1Cl)CO)[N+](=O)[O-] LS10111 [0,1,0,0,0,0|2,0,1]=4 133 B12R1.232 Cc1cc(c(cc1Br)F)C(=O)O LS10525 [0,1,0,0,0,0|2,0,0]=3 134 B12R1.232 Cc1cc(c(cc1F)Br)C(=O)O LS10528 [0,1,0,0,0,0|2,0,0]=3 135 B12R1.232 Cc1cc(c(cc1F)C(=O)O)Br LS10526 [0,1,0,0,0,0|2,0,0]=3 136 B12R1.232 Cc1cc(c(cc1F)F)C(=O)O LS10201 [0,1,0,0,0,0|2,0,0]=3 137 B12R1.232 c1c(c(cc(c1Br)Cl)F)C(=O)O LS11501 [0,1,0,0,0,0|2,0,0]=3 138 B12R1.232 c1c(c(cc(c1Br)O)O)C(=O)O LS10163 [0,1,0,0,0,0|0,0,0]=1 139 B12R1.232 c1c(c(cc(c1Cl)Cl)N)C(=O)O LS10030 [0,1,0,0,0,0|2,0,0]=3 140 B12R1.232 c1c(c(cc(c1F)Br)Cl)C(=O)O LS10529 [0,1,0,0,0,0|2,0,0]=3 141 B12R1.232 c1c(c(cc(c1F)Cl)Cl)C(=O)O LS10531 [0,1,0,0,0,0|2,0,0]=3 142 B12R1.232 c1c(c(cc(c1F)F)F)C(=O)O LS11174 [0,1,0,0,0,0|2,0,0]=3 143 B12R1.452 B(c1ccc(cc1Cl)OC)(O)O LS10757 [0,1,0,0,0,0|2,0,1]=4 144 B12R1.452 B(c1ccc(cc1F)OC)(O)O LS10980 [0,1,0,0,0,0|2,0,1]=4 145 B12R1.452 CC(=O)c1ccc(cc1F)OC LS11613 [0,1,0,0,0,0|2,0,0]=3 146 B12R1.452 COc1ccc(c(c1)Cl)C(=O)O LS11741 [0,1,0,0,0,0|1,0,0]=2 147 B12R1.452 COc1ccc(c(c1)F)[N+](=O)[O-] LS10312 [0,1,0,0,0,0|2,0,1]=4 148 B12R1.452 COc1ccc(c(c1)N)C(=O)O LS10553 [0,1,0,0,0,0|1,0,0]=2 149 B12R1.452 c1cc(c(cc1C#N)F)C(=O)O LS11606 [0,1,0,0,0,0|2,0,0]=3 150 B12R1.893 c1cc(c(c(c1C(=O)O)Br)F)F LS10246 [0,1,0,0,0,0|2,0,0]=3 151 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)Br LS10244 [0,1,0,0,0,0|2,0,0]=3 152 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)F LS11172 [0,1,0,0,0,0|2,0,0]=3 153 B12R1.893 c1cc(c(c(c1C(=O)O)F)O)F LS10250 [0,1,0,0,0,0|2,0,0]=3 154 B12R1.893 c1cc(c(c(c1C(=O)[O-])F)F)F LS11173 [0,1,0,0,0,0|2,0,1]=4 155 B12R1.1000 CC(=O)c1c(cc(cc1F)Br)F LS11309 [0,1,0,0,0,0|3,0,0]=4 156 B12R1.1000 Cc1cc(cc(c1C(=O)O)Br)F LS10527 [0,1,0,0,0,0|2,0,0]=3 157 B12R1.1000 c1c(cc(c(c1Cl)C(=O)Cl)Cl)Cl LS10131 [0,1,0,0,0,0|3,0,0]=4 158 B12R1.1000 c1c(cc(c(c1F)C(=O)O)Cl)Cl LS10075 [0,1,0,0,0,0|2,0,0]=3 159 B12R1.1000 c1c(cc(c(c1F)C(=O)O)F)Br LS10464 [0,1,0,0,0,0|2,0,0]=3 160 B12R1.1000 c1c(cc(c(c1O)C(=O)O)O)O LS11467 [0,1,0,0,0,0|0,0,0]=1 161 B12R1.1000 c1c(cc(c(c1O)C(=O)O)O)O LS11468 [0,1,0,0,0,0|0,0,0]=1 162 B12R1.1000 c1c(cc(c(c1O)[N+](=O)[O-])F)F LS10677 [0,1,0,0,0,0|2,0,1]=4 163 B12R1.1703 COC(=O)c1ccc(cc1F)Br LS11210 [0,1,0,0,0,0|2,0,0]=3 164 B12R1.1703 COC(=O)c1ccc(cc1F)F LS11835 [0,1,0,0,0,0|2,0,0]=3 165 B12R1.1703 COC(=O)c1ccc(cc1O)O LS10726 [0,1,0,0,0,0|0,0,0]=1 166 B12R1.1703 Cc1cc(cnc1C(=O)OC)Br LS20025 [0,1,0,0,0,0|3,0,0]=4 167 B12R2.612 c1cc2c(cc1Br)COC2=O LS40024 [0,0,0,1,0,0|2,0,0]=3 168 B12R2.612 c1cc2c(cc1Cl)CCC2=O LS00023 [0,0,0,1,0,0|3,0,0]=4 169 B12R2.612 c1cc2c(cc1Cl)onc2O LS40223 [0,0,0,1,0,0|2,0,0]=3 170 B12R2.612 c1cc2c(cc1F)CCC2=O LS20516 [0,0,0,1,0,0|3,0,0]=4 171 B12R2.612 c1cc2c(cc1O)CCC2=O LS40251 [0,0,0,1,0,0|2,0,0]=3 172 B12R2.612 c1cc2c(cc1O)OCC2=O LS21028 [0,0,0,1,0,0|1,0,0]=2 173 B12R1.233 c1cc(c(cc1Br)F)CC(=O)O LS11529 [0,0,0,0,0,1|2,0,0]=3 174 B9R1.1 C=Cc1ccc(cc1)Br LS11650 [2,0,0,0,0,0|2,0,0]=4 175 B9R1.1 C=Cc1ccc(cc1)Cl LS11649 [2,0,0,0,0,0|2,0,0]=4 176 B9R1.1 COc1ccc(cc1)O LS10474 [2,0,0,0,0,0|2,0,0]=4 177 B9R1.1 Cc1ccc(cc1)CO LS11273 [2,0,0,0,0,0|1,0,1]=4 178 B9R1.1 c1cc(ccc1C=O)Cl LS10198 [2,0,0,0,0,0|1,0,0]=3 179 B9R1.1 c1cc(ccc1CO)I LS11275 [2,0,0,0,0,0|1,0,1]=4 180 B9R1.1 c1cc(ccc1CO)N LS10779 [2,0,0,0,0,0|1,0,1]=4 181 B9R1.1 c1cc(ncc1Br)C=O LS20518 [2,0,0,0,0,0|2,0,0]=4 182 B9R1.1 c1cc(ncc1C=O)Br LS20544 [2,0,0,0,0,0|2,0,0]=4 183 B9R1.1 c1cc(ncc1C=O)Cl LS20242 [2,0,0,0,0,0|2,0,0]=4 184 B9R1.1 c1cc(ncc1Cl)C=O LS20775 [2,0,0,0,0,0|2,0,0]=4 185 B9R1.6 B(c1ccccc1)(O)O LS00011 [2,0,0,0,0,0|1,0,1]=4 186 B9R1.6 CC(=O)c1cccnc1 LS20960 [2,0,0,0,0,0|2,0,0]=4 187 B9R1.6 c1ccc(cc1)C(=N)N LS10719 [2,0,0,0,0,0|2,0,0]=4 188 B9R1.6 c1ccc(cc1)C(=O)O LS41489 [2,0,0,0,0,0|0,0,0]=2 189 B9R1.6 c1ccc(cc1)C(=S)N LS10766 [2,0,0,0,0,0|1,1,0]=4 190 B9R1.6 c1cnc(cn1)C(=O)O LS20078 [2,0,0,0,0,0|2,0,0]=4 191 B9R1.6 c1cnc(nc1)C(=O)O LS20267 [2,0,0,0,0,0|2,0,0]=4 192 B9R1.6 c1cncnc1C(=O)O LS20389 [2,0,0,0,0,0|2,0,0]=4 193 B9R1.15 C=Cc1ccccc1Br LS11653 [2,0,0,0,0,0|2,0,0]=4 194 B9R1.15 C=Cc1ccccc1Cl LS11654 [2,0,0,0,0,0|2,0,0]=4 195 B9R1.15 C=Cc1ccccc1F LS11647 [2,0,0,0,0,0|2,0,0]=4 196 B9R1.15 Cc1ccccc1C=O LS11852 [2,0,0,0,0,0|1,0,0]=3 197 B9R1.15 Cc1ccccc1CO LS11274 [2,0,0,0,0,0|1,0,1]=4 198 B9R1.15 c1cc(c(nc1)C=O)O LS20166 [2,0,0,0,0,0|1,0,0]=3 199 B9R1.15 c1cc(c(nc1)CO)O LS20165 [2,0,0,0,0,0|1,0,1]=4 200 B9R1.15 c1cc(c(nc1)Cl)C=O LS20395 [2,0,0,0,0,0|2,0,0]=4 201 B9R1.15 c1cc(c(nc1)N)C=O LS41434 [2,0,0,0,0,0|2,0,0]=4 202 B9R1.15 c1cc(c(nc1)O)C=O LS21175 [2,0,0,0,0,0|1,0,0]=3 203 B9R1.15 c1ccc(c(c1)C#N)O LS10639 [2,0,0,0,0,0|1,0,1]=4 204 B9R1.15 c1ccc(c(c1)C=O)N LS10114 [2,0,0,0,0,0|1,0,0]=3 205 B9R1.15 c1ccc(c(c1)CO)F LS11270 [2,0,0,0,0,0|1,0,1]=4 206 B9R1.15 c1ccc(c(c1)CO)I LS11276 [2,0,0,0,0,0|1,0,1]=4 207 B9R1.15 c1ccc(c(c1)CO)N LS10594 [2,0,0,0,0,0|1,0,1]=4 208 B9R1.15 c1cncc(c1C=O)Br LS20109 [2,0,0,0,0,0|2,0,0]=4 209 B9R1.69 Cc1cc(ccc1Br)O LS10569 [2,0,0,0,0,0|2,0,0]=4 210 B9R1.69 Cc1cc(ccc1O)Br LS10229 [2,0,0,0,0,0|2,0,0]=4 211 B9R1.69 Cc1cc(ccc1O)Cl LS10662 [2,0,0,0,0,0|2,0,0]=4 212 B9R1.69 Cc1ccc(c(c1)Br)O LS11738 [2,0,0,0,0,0|2,0,0]=4 213 B9R1.69 Cc1ccc(c(c1)O)Br LS11750 [2,0,0,0,0,0|2,0,0]=4 214 B9R1.69 c1cc(c(cc1Br)Br)O LS11451 [2,0,0,0,0,0|2,0,0]=4 215 B9R1.69 c1cc(c(cc1Br)N)O LS10615 [2,0,0,0,0,0|2,0,0]=4 216 B9R1.69 c1cc(c(cc1Br)O)Cl LS10495 [2,0,0,0,0,0|2,0,0]=4 217 B9R1.69 c1cc(c(cc1Br)O)F LS10459 [2,0,0,0,0,0|2,0,0]=4 218 B9R1.69 c1cc(c(cc1Br)O)N LS10644 [2,0,0,0,0,0|2,0,0]=4 219 B9R1.69 c1cc(c(cc1Cl)Br)O LS11737 [2,0,0,0,0,0|2,0,0]=4 220 B9R1.69 c1cc(c(cc1Cl)N)O LS10668 [2,0,0,0,0,0|2,0,0]=4 221 B9R1.69 c1cc(c(cc1Cl)O)I LS10194 [2,0,0,0,0,0|2,0,0]=4 222 B9R1.69 c1cc(c(cc1F)Br)O LS10461 [2,0,0,0,0,0|2,0,0]=4 223 B9R1.69 c1cc(c(cc1F)N)O LS10399 [2,0,0,0,0,0|2,0,0]=4 224 B9R1.69 c1cc(c(cc1F)O)Br LS10489 [2,0,0,0,0,0|2,0,0]=4 225 B9R1.69 c1cc(c(cc1F)O)Cl LS10485 [2,0,0,0,0,0|2,0,0]=4 226 B9R1.69 c1cc(c(cc1N)O)Cl LS10724 [2,0,0,0,0,0|2,0,0]=4 227 B9R1.69 c1cc(c(cc1O)Br)Cl LS10344 [2,0,0,0,0,0|2,0,0]=4 228 B9R1.69 c1cc(c(cc1O)Br)F LS10460 [2,0,0,0,0,0|2,0,0]=4 229 B9R1.69 c1cc(c(cc1O)Br)O LS11757 [2,0,0,0,0,0|1,0,0]=3 230 B9R1.69 c1cc(c(cc1O)Cl)Br LS10343 [2,0,0,0,0,0|2,0,0]=4 231 B9R1.69 c1cc(c(cc1O)Cl)N LS11520 [2,0,0,0,0,0|2,0,0]=4 232 B9R1.69 c1cc(c(cc1O)F)N LS00146 [2,0,0,0,0,0|2,0,0]=4 233 B9R1.69 c1cc(c(cc1O)F)O LS00052 [2,0,0,0,0,0|1,0,0]=3 234 B9R1.69 c1cc(c(cc1O)N)F LS10007 [2,0,0,0,0,0|2,0,0]=4 235 B9R1.69 c1cc(c(cc1O)O)Br LS10165 [2,0,0,0,0,0|1,0,0]=3 236 B11R1.3 B(c1ccc(cc1)CO)(O)O LS10891 [1,1,0,0,0,0|1,0,1]=4 237 B11R1.3 B(c1ccc(cc1)OC)(O)O LS10897 [1,1,0,0,0,0|1,0,1]=4 238 B11R1.3 CC(=C)c1ccc(cc1)OC LS10061 [1,1,0,0,0,0|2,0,0]=4 239 B11R1.3 CC(=O)c1ccc(nc1)OC LS20033 [1,1,0,0,0,0|2,0,0]=4 240 B11R1.3 COc1ccc(cc1)C(=O)O LS11457 [1,1,0,0,0,0|0,0,0]=2 241 B11R1.3 c1cc(ccc1C=O)C(=O)O LS10649 [1,1,0,0,0,0|0,0,1]=3 242 B11R1.3 c1cc(ccc1CCl)C(=O)O LS11536 [1,1,0,0,0,0|1,0,0]=3 243 B11R1.3 c1cc(ccc1CO)[N+](=O)[O-] LS10721 [1,1,0,0,0,0|1,0,1]=4 244 B11R1.19 Cc1ccc(cc1)S(=O)(=O)O LS30073 [1,1,0,0,0,0|2,0,0]=4 245 B11R1.19 Cc1ccc(cc1)S(=O)(=O)O LS30074 [1,1,0,0,0,0|2,0,0]=4 246 B11R1.19 c1cc(ccc1O)S(=O)(=O)O LS10671 [1,1,0,0,0,0|1,0,0]=3 247 B11R1.19 c1cc(ccc1O)S(=O)(=O)[O-] LS40551 [1,1,0,0,0,0|1,0,1]=4 248 B11R1.19 c1cc(ccc1O)S(=O)(=O)[O-] LS40552 [1,1,0,0,0,0|1,0,1]=4 249 B11R1.19 c1cc(ccc1S(=O)(=O)O)Cl LS10688 [1,1,0,0,0,0|2,0,0]=4 250 B11R1.21 B(c1ccc(c(c1)Cl)O)(O)O LS11002 [1,1,0,0,0,0|1,0,1]=4 251 B11R1.21 Cc1ccc(cc1Br)C(=O)O LS10330 [1,1,0,0,0,0|1,0,0]=3 252 B11R1.21 Cc1ccc(cc1Cl)C(=O)O LS10663 [1,1,0,0,0,0|1,0,0]=3 253 B11R1.21 Cc1ccc(cc1F)C(=O)O LS10532 [1,1,0,0,0,0|1,0,0]=3 254 B11R1.21 c1cc(c(cc1C(=O)O)F)F LS11167 [1,1,0,0,0,0|1,0,0]=3 255 B11R1.21 c1cc(c(cc1C(=O)[O-])F)F LS11168 [1,1,0,0,0,0|1,0,1]=4 256 B11R1.22 COC(=O)c1ccc(nc1)Cl LS20217 [1,1,0,0,0,0|2,0,0]=4 257 B11R1.22 COC(=O)c1ccc(nc1)N LS20441 [1,1,0,0,0,0|2,0,0]=4 258 B11R1.22 Cc1ccc(cn1)C(=O)OC LS20731 [1,1,0,0,0,0|2,0,0]=4 259 B11R1.22 c1cc(ccc1C(=O)CN)Br LS11597 [1,1,0,0,0,0|2,0,0]=4 260 B11R1.22 c1cc(ccc1C(=O)NN)Cl LS11767 [1,1,0,0,0,0|2,0,0]=4 261 B11R1.22 c1cc(ccc1C(CN)O)O LS41256 [1,1,0,0,0,0|1,0,1]=4 262 B11R1.37 COc1cc(ccc1C=O)F LS10599 [1,1,0,0,0,0|1,0,0]=3 263 B11R1.277 Cc1cc(c(cc1Br)F)C=O LS10510 [1,1,0,0,0,0|2,0,0]=4 264 B11R1.277 Cc1cc(c(cc1F)Br)C=O LS10656 [1,1,0,0,0,0|2,0,0]=4 265 B11R1.277 Cc1cc(c(cc1O)C)C=O LS10195 [1,1,0,0,0,0|1,0,0]=3 266 B11R1.277 c1c(c(cc(c1F)Cl)Cl)C=O LS10389 [1,1,0,0,0,0|2,0,0]=4 267 B11R1.277 c1c(c(cc(c1F)F)F)C=O LS10496 [1,1,0,0,0,0|2,0,0]=4 268 B11R1.277 c1c(c(cc(c1F)F)O)C=O LS10186 [1,1,0,0,0,0|1,0,0]=3 269 B11R1.278 c1cc(c(c(c1C=O)F)F)Br LS10035 [1,1,0,0,0,0|2,0,0]=4 270 B11R1.279 COc1ccc(c(c1)F)C=O LS10504 [1,1,0,0,0,0|1,0,0]=3 271 B11R1.279 COc1ccc(c(c1)F)C=O LS11583 [1,1,0,0,0,0|1,0,0]=3 272 B11R1.279 c1cc(c(cc1C#N)O)C=O LS10079 [1,1,0,0,0,0|1,0,0]=3 273 B11R1.464 Cc1cc(c(c(c1)C)C=O)C LS10375 [1,1,0,0,0,0|2,0,0]=4 274 B11R1.464 Cc1cc(cc(c1C=O)Br)F LS10511 [1,1,0,0,0,0|2,0,0]=4 275 B11R1.464 Cc1cc(cc(c1C=O)C)O LS10368 [1,1,0,0,0,0|1,0,0]=3 276 B11R1.464 c1c(cc(c(c1F)C=O)F)Br LS10022 [1,1,0,0,0,0|2,0,0]=4 277 B11R1.464 c1c(cc(c(c1O)C=O)F)F LS10076 [1,1,0,0,0,0|1,0,0]=3 278 B11R1.53 B(c1ccccc1CO)(O)O LS10798 [1,1,0,0,0,0|1,0,1]=4 279 B11R1.53 B(c1ccccc1OC)(O)O LS10801 [1,1,0,0,0,0|1,0,1]=4 280 B11R1.53 COc1ccccc1C(=O)Cl LS11458 [1,1,0,0,0,0|1,0,0]=3 281 B11R1.53 COc1ccccc1C(=O)O LS11456 [1,1,0,0,0,0|0,0,0]=2 282 B11R1.156 CC(=O)c1c(cccc1Br)F LS11304 [1,1,0,0,0,0|2,0,0]=4 283 B11R1.156 CC(=O)c1c(cccc1F)F LS11166 [1,1,0,0,0,0|2,0,0]=4 284 B11R1.156 Cc1cccc(c1C(=O)O)O LS10070 [1,1,0,0,0,0|0,0,0]=2 285 B11R1.156 c1cc(c(c(c1)Br)C(=O)O)Cl LS10321 [1,1,0,0,0,0|1,0,0]=3 286 B11R1.156 c1cc(c(c(c1)Br)C(=O)O)F LS11335 [1,1,0,0,0,0|1,0,0]=3 287 B11R1.156 c1cc(c(c(c1)Br)C(=O)O)N LS10138 [1,1,0,0,0,0|1,0,0]=3 288 B11R1.156 c1cc(c(c(c1)Cl)C(=O)Cl)Cl LS11443 [1,1,0,0,0,0|2,0,0]=4 289 B11R1.156 c1cc(c(c(c1)Cl)C(=O)O)Cl LS11437 [1,1,0,0,0,0|1,0,0]=3 290 B11R1.156 c1cc(c(c(c1)Cl)C(=O)O)N LS11434 [1,1,0,0,0,0|1,0,0]=3 291 B11R1.156 c1cc(c(c(c1)F)C(=O)O)N LS10583 [1,1,0,0,0,0|1,0,0]=3 292 B11R1.156 c1cc(c(c(c1)F)C(=O)O)O LS10249 [1,1,0,0,0,0|0,0,0]=2 293 B11R1.159 B(c1cccc(c1O)Br)(O)O LS10991 [1,1,0,0,0,0|1,0,1]=4 294 B11R1.159 CC(=O)c1cccc(c1F)Br LS10318 [1,1,0,0,0,0|2,0,0]=4 295 B11R1.159 Cc1c(cccc1F)C(=O)O LS10580 [1,1,0,0,0,0|1,0,0]=3 296 B11R1.159 Cc1c(cccc1I)C(=O)O LS10045 [1,1,0,0,0,0|1,0,0]=3 297 B11R1.159 Cc1cccc(c1C)C(=O)O LS11825 [1,1,0,0,0,0|1,0,0]=3 298 B11R1.159 Cc1cccc(c1I)C(=O)O LS10145 [1,1,0,0,0,0|1,0,0]=3 299 B11R1.159 Cc1cccc(c1N)C(=O)O LS11462 [1,1,0,0,0,0|1,0,0]=3 300 B11R1.159 c1cc(c(c(c1)Br)F)C(=O)O LS10579 [1,1,0,0,0,0|1,0,0]=3 301 B11R1.159 c1cc(c(c(c1)Br)N)C(=O)N LS11488 [1,1,0,0,0,0|2,0,0]=4 302 B11R1.159 c1cc(c(c(c1)Br)N)C(=O)O LS11484 [1,1,0,0,0,0|1,0,0]=3 303 B11R1.159 c1cc(c(c(c1)Br)O)[N+](=O)[O-] LS10741 [1,1,0,0,0,0|1,0,1]=4 304 B11R1.159 c1cc(c(c(c1)Cl)Cl)C(=O)O LS11460 [1,1,0,0,0,0|1,0,0]=3 305 B11R1.159 c1cc(c(c(c1)Cl)F)C(=O)O LS11404 [1,1,0,0,0,0|1,0,0]=3 306 B11R1.159 c1cc(c(c(c1)Cl)N)C(=O)O LS11486 [1,1,0,0,0,0|1,0,0]=3 307 B11R1.159 c1cc(c(c(c1)F)Br)C(=O)O LS10584 [1,1,0,0,0,0|1,0,0]=3 308 B11R1.159 c1cc(c(c(c1)F)F)C(=O)O LS11162 [1,1,0,0,0,0|1,0,0]=3 309 B11R1.159 c1cc(c(c(c1)F)N)C(=O)O LS11485 [1,1,0,0,0,0|1,0,0]=3 310 B11R1.159 c1cc(c(c(c1)I)F)C(=O)O LS10522 [1,1,0,0,0,0|1,0,0]=3 311 B11R1.159 c1cc(c(c(c1)N)F)C(=O)O LS10012 [1,1,0,0,0,0|1,0,0]=3 312 B11R1.159 c1cc(c(c(c1)N)N)C(=O)N LS11444 [1,1,0,0,0,0|2,0,0]=4 313 B11R1.159 c1cc(c(c(c1)N)N)C(=O)O LS11459 [1,1,0,0,0,0|1,0,0]=3 314 B11R1.159 c1cc(c(c(c1)O)O)C(=O)O LS10681 [1,1,0,0,0,0|0,0,0]=2 315 B11R1.167 B(c1cc(ccc1O)Cl)(O)O LS11049 [1,1,0,0,0,0|1,0,1]=4 316 B11R1.167 B(c1cc(ccc1O)F)(O)O LS11052 [1,1,0,0,0,0|1,0,1]=4 317 B11R1.167 CC(=O)c1cc(ccc1Br)Cl LS11579 [1,1,0,0,0,0|2,0,0]=4 318 B11R1.167 CC(=O)c1cc(ccc1Br)F LS10365 [1,1,0,0,0,0|2,0,0]=4 319 B11R1.167 CC(=O)c1cc(ccc1F)Br LS10106 [1,1,0,0,0,0|2,0,0]=4 320 B11R1.167 CC(=O)c1cc(ccc1I)F LS10113 [1,1,0,0,0,0|2,0,0]=4 321 B11R1.167 CC(=O)c1cc(ccc1O)O LS11715 [1,1,0,0,0,0|1,0,0]=3 322 B11R1.167 Cc1ccc(c(c1)C(=O)O)I LS10696 [1,1,0,0,0,0|1,0,0]=3 323 B11R1.167 Cc1ccc(cc1C(=O)O)Br LS10562 [1,1,0,0,0,0|1,0,0]=3 324 B11R1.167 Cc1ccc(cc1C(=O)O)F LS10582 [1,1,0,0,0,0|1,0,0]=3 325 B11R1.167 Cc1ccc(cc1C(=O)O)I LS11399 [1,1,0,0,0,0|1,0,0]=3 326 B11R1.167 c1c(c(cnc1F)F)C(=O)O LS20887 [1,1,0,0,0,0|2,0,0]=4 327 B11R1.167 c1c(cnc(c1C(=O)O)Cl)Br LS20228 [1,1,0,0,0,0|2,0,0]=4 328 B11R1.167 c1c(cnc(c1C(=O)O)Cl)Cl LS20422 [1,1,0,0,0,0|2,0,0]=4 329 B11R1.167 c1c(cnc(c1C(=O)O)O)Br LS20421 [1,1,0,0,0,0|1,0,0]=3 330 B11R1.167 c1cc(c(cc1Br)C(=O)N)N LS11489 [1,1,0,0,0,0|2,0,0]=4 331 B11R1.167 c1cc(c(cc1Br)C(=O)O)Cl LS11201 [1,1,0,0,0,0|1,0,0]=3 332 B11R1.167 c1cc(c(cc1Br)C(=O)O)F LS10585 [1,1,0,0,0,0|1,0,0]=3 333 B11R1.167 c1cc(c(cc1Br)C(=O)O)N LS10708 [1,1,0,0,0,0|1,0,0]=3 334 B11R1.167 c1cc(c(cc1Cl)C(=O)N)N LS10559 [1,1,0,0,0,0|2,0,0]=4 335 B11R1.167 c1cc(c(cc1Cl)C(=O)N)O LS10567 [1,1,0,0,0,0|1,0,0]=3 336 B11R1.167 c1cc(c(cc1Cl)C(=O)O)Cl LS11832 [1,1,0,0,0,0|1,0,0]=3 337 B11R1.167 c1cc(c(cc1Cl)C(=O)O)N LS10348 [1,1,0,0,0,0|1,0,0]=3 338 B11R1.167 c1cc(c(cc1Cl)C(=O)O)O LS11420 [1,1,0,0,0,0|0,0,0]=2 339 B11R1.167 c1cc(c(cc1F)C(=O)N)N LS11474 [1,1,0,0,0,0|2,0,0]=4 340 B11R1.167 c1cc(c(cc1F)C(=O)O)F LS11164 [1,1,0,0,0,0|1,0,0]=3 341 B11R1.167 c1cc(c(cc1F)C(=O)O)N LS11464 [1,1,0,0,0,0|1,0,0]=3 342 B11R1.167 c1cc(c(cc1F)C(=O)O)O LS10523 [1,1,0,0,0,0|0,0,0]=2 343 B11R1.167 c1cc(c(cc1F)C(=O)[O-])F LS11165 [1,1,0,0,0,0|1,0,1]=4 344 B11R1.167 c1cc(c(cc1N)C(=O)O)O LS11426 [1,1,0,0,0,0|0,0,0]=2 345 B11R1.167 c1cc(c(cc1O)C(=O)O)F LS10475 [1,1,0,0,0,0|1,0,0]=3 346 B11R1.167 c1cc(nc(c1F)C(=O)O)Cl LS20461 [1,1,0,0,0,0|2,0,0]=4 347 B11R1.222 CCC(=O)c1ccccc1Cl LS11338 [1,1,0,0,0,0|2,0,0]=4 348 B11R1.222 CNC(=O)c1ccccc1N LS11490 [1,1,0,0,0,0|2,0,0]=4 349 B11R1.222 COC(=O)c1ccccc1Cl LS10628 [1,1,0,0,0,0|1,0,0]=3 350 B11R1.222 COC(=O)c1cccnc1N LS20032 [1,1,0,0,0,0|2,0,0]=4 351 B11R1.222 Cc1ccccc1C(=O)CBr LS11319 [1,1,0,0,0,0|2,0,0]=4 352 B13R1.653 COc1ccc(c(c1)Cl)CC(=O)O LS10685 [0,1,0,0,0,1|1,0,0]=3 353 B13R1.876 c1c(c(cc(c1F)F)F)CC(=O)O LS10351 [0,1,0,0,0,1|2,0,0]=4 354 B13R1.99 B(c1ccc(cc1OC)OC)(O)O LS10932 [0,2,0,0,0,0|1,0,1]=4 355 B13R1.165 c1cc(c(cc1Br)[N+](=O)[O-])C(=O)O LS10487 [0,2,0,0,0,0|1,0,1]=4 356 B13R1.165 c1cc(c(cc1Cl)[N+](=O)[O-])C(=O)O LS10666 [0,2,0,0,0,0|1,0,1]=4 357 B13R1.165 c1cc(c(cc1F)C(=O)O)C(=O)O LS11471 [0,2,0,0,0,0|1,0,0]=3 358 B13R1.2811 Cc1c(c(cc(c1F)F)C(=O)O)F LS11492 [0,2,0,0,0,0|2,0,0]=4 359 B13R1.2811 c1c(c(c(c(c1F)F)Cl)F)C(=O)O LS10524 [0,2,0,0,0,0|2,0,0]=4 360 B13R1.2812 c1c(c(c(c(c1I)O)I)C(=O)O)I LS10006 [0,2,0,0,0,0|2,0,0]=4 361 B13R1.120 B(c1ccc(c(c1)Cl)C(=O)O)(O)O LS11000 [0,2,0,0,0,0|1,0,0]=3 362 B13R1.120 B(c1ccc(c(c1)F)C(=O)O)(O)O LS11010 [0,2,0,0,0,0|1,0,0]=3 363 B13R1.120 Cc1cc(ccc1C(=O)O)[N+](=O)[O-] LS10210 [0,2,0,0,0,0|1,0,1]=4 364 B13R1.120 c1cc(c(cc1[N+](=O)[O-])Cl)C(=O)O LS10722 [0,2,0,0,0,0|1,0,1]=4 365 B13R1.120 c1cc(c(cc1[N+](=O)[O-])F)C(=O)O LS10586 [0,2,0,0,0,0|1,0,1]=4 366 B13R1.120 c1cc(c(cc1[N+](=O)[O-])O)C(=O)O LS10178 [0,2,0,0,0,0|0,0,1]=3 367 B11R2.36 c1cc(cc2c1cc[nH]2)O LS20137 [1,0,0,1,0,0|2,0,0]=4 368 B11R2.36 c1cc(cc2c1ccs2)O LS21200 [1,0,0,1,0,0|1,1,0]=4 369 B11R2.1 c1cc2c(nc1)COC2=O LS41441 [1,0,0,1,0,0|2,0,0]=4 370 B13R2.5187 c1cc2c(cc1Cl)C(=O)OC2=O LS11768 [0,1,0,1,0,0|1,0,1]=4 371 B13R2.5187 c1cc2c(cc1F)C(=O)OC2=O LS10169 [0,1,0,1,0,0|1,0,1]=4 372 B13R2.2130 c1cc2c(cc1C#N)COC2=O LS11431 [0,1,0,1,0,0|2,0,0]=4 373 B9R1.35 Cc1ccc(s1)C(=O)O LS20662 [1,0,0,0,1,0|2,0,0]=4 374 B9R1.35 c1c(csc1C(=O)O)Br LS20661 [1,0,0,0,1,0|2,0,0]=4 375 B9R1.35 c1cc(sc1C(=O)O)Br LS20297 [1,0,0,0,1,0|2,0,0]=4 376 B9R1.35 c1cc(sc1C(=O)O)Cl LS20472 [1,0,0,0,1,0|2,0,0]=4 377 B9R1.41 Cc1ccsc1C(=O)O LS20659 [1,0,0,0,1,0|2,0,0]=4 378 B9R1.41 c1csc(c1Br)C(=O)O LS20750 [1,0,0,0,1,0|2,0,0]=4 379 B9R1.41 c1csc(c1C(=O)O)Br LS20833 [1,0,0,0,1,0|2,0,0]=4 380 B9R1.41 c1csc(c1Cl)C(=O)O LS20749 [1,0,0,0,1,0|2,0,0]=4 381 B11R1.20 CC(=O)Cc1ccc(cc1)Br LS11255 [1,0,0,0,0,1|2,0,0]=4 382 B11R1.20 CC(=O)Cc1ccc(cc1)Cl LS11258 [1,0,0,0,0,1|2,0,0]=4 383 B11R1.20 CC(=O)Cc1ccc(cc1)F LS11260 [1,0,0,0,0,1|2,0,0]=4 384 B11R1.20 CC(=O)Oc1ccc(cc1)F LS10377 [1,0,0,0,0,1|2,0,0]=4 385 B11R1.20 Cc1ccc(cc1)CC(=O)C LS11261 [1,0,0,0,0,1|2,0,0]=4 386 B11R1.20 Cc1ccc(cc1)NC(=O)C LS11875 [1,0,0,0,0,1|2,0,0]=4 387 B11R1.20 c1cc(ccc1CC(=O)N)O LS11370 [1,0,0,0,0,1|1,0,0]=3 388 B11R1.20 c1cc(ccc1CC(=O)O)Br LS10304 [1,0,0,0,0,1|1,0,0]=3 389 B11R1.20 c1cc(ccc1CC(=O)O)O LS10592 [1,0,0,0,0,1|0,0,0]=2 390 B11R1.86 CC(=O)Cc1ccccc1Br LS11253 [1,0,0,0,0,1|2,0,0]=4 391 B11R1.86 CC(=O)Cc1ccccc1Cl LS11256 [1,0,0,0,0,1|2,0,0]=4 392 B11R1.86 CC(=O)Cc1ccccc1F LS11259 [1,0,0,0,0,1|2,0,0]=4 393 B11R1.86 c1ccc(c(c1)CC(=O)O)O LS10642 [1,0,0,0,0,1|0,0,0]=2 394 B11R1.74 Cc1cc(cc(c1)N)C(=O)O LS10247 [0,0,0,0,1,1|2,0,0]=4 395 B11R1.74 c1c(cc(cc1Br)I)C(=O)O LS10332 [0,0,0,0,1,1|2,0,0]=4 396 B11R1.74 c1c(cc(cc1F)F)C(=O)O LS11169 [0,0,0,0,1,1|2,0,0]=4