0 B9R1.6 B(c1ccccc1)(O)O LS00011 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.6 B(c1cccnc1)(O)O LS20190 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.6 B(c1ccncc1)(O)O LS20393 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.6 B(c1ccncn1)(O)O LS11623 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.6 B(c1cncnc1)(O)O LS11123 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.6 CC(=O)c1cccnc1 LS20960 [0,0,0,0,0,0|1,0,2]=3 6 B9R1.6 C[C@@H](c1ccccc1)N LS30171 [0,0,0,0,0,0|1,0,0]=1 7 B9R1.6 C[C@H](c1ccccc1)N LS30099 [0,0,0,0,0,0|1,0,0]=1 8 B9R1.6 c1cc(cnc1)C(=S)N LS40686 [0,0,0,0,0,0|2,1,1]=4 9 B9R1.6 c1ccc(cc1)C(=N)N LS10719 [0,0,0,0,0,0|2,0,1]=3 10 B9R1.6 c1ccc(cc1)C(=O)O LS41489 [0,0,0,0,0,0|1,0,1]=2 11 B9R1.6 c1ccc(cc1)C(=S)N LS10766 [0,0,0,0,0,0|1,1,1]=3 12 B9R1.6 c1ccnc(c1)C(=N)N LS21180 [0,0,0,0,0,0|3,0,1]=4 13 B9R1.6 c1cnc(cn1)C(=O)O LS20078 [0,0,0,0,0,0|3,0,1]=4 14 B9R1.6 c1cnc(nc1)C(=O)O LS20267 [0,0,0,0,0,0|3,0,1]=4 15 B9R1.6 c1cncnc1C(=O)O LS20389 [0,0,0,0,0,0|3,0,1]=4 16 B8R1.2 C#Cc1ccccc1 LS10701 [1,0,0,0,0,0|0,0,2]=3 17 B8R1.2 CNc1cccnc1 LS20470 [1,0,0,0,0,0|2,0,0]=3 18 B8R1.2 c1cc(cnc1)C=O LS20485 [1,0,0,0,0,0|1,0,2]=4 19 B8R1.2 c1ccc(cc1)C=O LS41490 [1,0,0,0,0,0|0,0,2]=3 20 B8R1.2 c1ccc(cc1)CO LS41488 [1,0,0,0,0,0|0,0,0]=1 21 B8R1.2 c1cnc(cn1)CN LS20127 [1,0,0,0,0,0|3,0,0]=4 22 B8R1.2 c1cnc(cn1)CN LS20128 [1,0,0,0,0,0|3,0,0]=4 23 B8R1.2 c1cnccc1C=O LS20943 [1,0,0,0,0,0|1,0,2]=4 24 B8R1.2 c1cnccc1CN LS20857 [1,0,0,0,0,0|2,0,0]=3 25 B8R1.2 c1cnccc1NN LS20045 [1,0,0,0,0,0|3,0,0]=4 26 B10R1.13 B(c1ccc(cc1)Br)(O)O LS10182 [0,1,0,0,0,0|2,0,0]=3 27 B10R1.13 B(c1ccc(cc1)C)(O)O LS00088 [0,1,0,0,0,0|2,0,0]=3 28 B10R1.13 B(c1ccc(cc1)Cl)(O)O LS00091 [0,1,0,0,0,0|2,0,0]=3 29 B10R1.13 B(c1ccc(cc1)F)(O)O LS00090 [0,1,0,0,0,0|2,0,0]=3 30 B10R1.13 B(c1ccc(cc1)I)(O)O LS10893 [0,1,0,0,0,0|2,0,0]=3 31 B10R1.13 B(c1ccc(cc1)N)(O)O LS10039 [0,1,0,0,0,0|2,0,0]=3 32 B10R1.13 B(c1ccc(cc1)O)(O)O LS10892 [0,1,0,0,0,0|2,0,0]=3 33 B10R1.13 B(c1ccc(cc1)S)(O)O LS00089 [0,1,0,0,0,0|2,0,0]=3 34 B10R1.13 B(c1ccc(nc1)Br)(O)O LS11091 [0,1,0,0,0,0|3,0,0]=4 35 B10R1.13 B(c1ccc(nc1)C)(O)O LS11103 [0,1,0,0,0,0|3,0,0]=4 36 B10R1.13 B(c1ccc(nc1)Cl)(O)O LS11095 [0,1,0,0,0,0|3,0,0]=4 37 B10R1.13 B(c1ccc(nc1)F)(O)O LS20294 [0,1,0,0,0,0|3,0,0]=4 38 B10R1.13 B(c1ccc(nc1)N)(O)O LS21229 [0,1,0,0,0,0|3,0,0]=4 39 B10R1.13 CC(=O)c1ccc(cc1)Br LS11874 [0,1,0,0,0,0|0,0,2]=3 40 B10R1.13 CC(=O)c1ccc(cc1)F LS11575 [0,1,0,0,0,0|0,0,2]=3 41 B10R1.13 CC(=O)c1ccc(cc1)N LS10360 [0,1,0,0,0,0|0,0,2]=3 42 B10R1.13 CC(=O)c1ccc(cc1)O LS10359 [0,1,0,0,0,0|0,0,2]=3 43 B10R1.13 CC(=O)c1ccc(cn1)Br LS20859 [0,1,0,0,0,0|1,0,2]=4 44 B10R1.13 CC(=O)c1ccc(nc1)Br LS21178 [0,1,0,0,0,0|1,0,2]=4 45 B10R1.13 CN(C)c1ccc(cc1)Br LS10693 [0,1,0,0,0,0|2,0,0]=3 46 B10R1.13 CN(C)c1ccc(cc1)Cl LS10239 [0,1,0,0,0,0|2,0,0]=3 47 B10R1.13 Cc1ccc(cn1)C(=O)O LS20541 [0,1,0,0,0,0|2,0,1]=4 48 B10R1.13 c1cc(ccc1C(=N)N)Br LS00131 [0,1,0,0,0,0|2,0,1]=4 49 B10R1.13 c1cc(ccc1C(=O)Cl)N LS11728 [0,1,0,0,0,0|1,0,2]=4 50 B10R1.13 c1cc(ccc1C(=O)O)Cl LS10674 [0,1,0,0,0,0|1,0,1]=3 51 B10R1.13 c1cc(ccc1N)[N+](=O)[O-] LS10622 [0,1,0,0,0,0|2,0,1]=4 52 B10R1.13 c1cc(ccc1[N+](=O)[O-])Cl LS10621 [0,1,0,0,0,0|2,0,1]=4 53 B10R1.13 c1cc(ncc1Br)C(=O)O LS20244 [0,1,0,0,0,0|2,0,1]=4 54 B10R1.13 c1cc(ncc1C(=O)O)Cl LS20664 [0,1,0,0,0,0|2,0,1]=4 55 B10R1.13 c1cc(ncc1C(=O)O)N LS20730 [0,1,0,0,0,0|2,0,1]=4 56 B10R1.13 c1cc(ncc1F)C(=O)O LS20092 [0,1,0,0,0,0|2,0,1]=4 57 B10R1.15 CC(CN)c1ccccc1 LS10637 [0,1,0,0,0,0|1,0,0]=2 58 B10R1.15 CC(CN)c1ccccc1 LS10638 [0,1,0,0,0,0|1,0,0]=2 59 B10R1.15 CC[C@@H](c1ccccc1)N LS30125 [0,1,0,0,0,0|1,0,0]=2 60 B10R1.15 CC[C@H](c1ccccc1)N LS30175 [0,1,0,0,0,0|1,0,0]=2 61 B10R1.15 COC(=O)c1cccnc1 LS20584 [0,1,0,0,0,0|1,0,2]=4 62 B10R1.15 C[C@@H](CN)c1ccccc1 LS30174 [0,1,0,0,0,0|1,0,0]=2 63 B10R1.15 C[C@H](CN)c1ccccc1 LS30173 [0,1,0,0,0,0|1,0,0]=2 64 B10R1.15 c1ccc(cc1)C(=O)CBr LS11352 [0,1,0,0,0,0|0,0,2]=3 65 B10R1.15 c1ccc(cc1)C(=O)CCl LS11677 [0,1,0,0,0,0|0,0,2]=3 66 B10R1.15 c1ccc(cc1)C(=O)CO LS10613 [0,1,0,0,0,0|0,0,2]=3 67 B10R1.15 c1ccc(cc1)[C@@H](CO)N LS30212 [0,1,0,0,0,0|1,0,0]=2 68 B10R1.15 c1ccc(cc1)[C@@H](CO)O LS30263 [0,1,0,0,0,0|0,0,0]=1 69 B10R1.15 c1ccc(cc1)[C@H](CO)N LS30213 [0,1,0,0,0,0|1,0,0]=2 70 B10R1.15 c1ccc(cc1)[C@H](CO)O LS30264 [0,1,0,0,0,0|0,0,0]=1 71 B10R1.28 CC(C)(c1ccccc1)O LS11531 [0,1,0,0,0,0|0,0,0]=1 72 B10R1.28 c1cc(cnc1)C(F)(F)F LS20274 [0,1,0,0,0,0|3,0,0]=4 73 B10R1.28 c1ccc(cc1)P(=O)(Cl)Cl LS40262 [0,1,0,0,0,0|2,0,1]=4 74 B10R1.28 c1ccc(cc1)S(=O)(=O)O LS10672 [0,1,0,0,0,0|2,0,0]=3 75 B10R1.28 c1ccc(cc1)S(=O)(=O)[O-] LS40553 [0,1,0,0,0,0|2,0,1]=4 76 B10R1.61 B(c1ccccc1Br)(O)O LS10792 [0,1,0,0,0,0|2,0,0]=3 77 B10R1.61 B(c1ccccc1C)(O)O LS10802 [0,1,0,0,0,0|2,0,0]=3 78 B10R1.61 B(c1ccccc1Cl)(O)O LS00151 [0,1,0,0,0,0|2,0,0]=3 79 B10R1.61 B(c1ccccc1F)(O)O LS10797 [0,1,0,0,0,0|2,0,0]=3 80 B10R1.61 B(c1ccccc1N)(O)O LS10787 [0,1,0,0,0,0|2,0,0]=3 81 B10R1.61 B(c1ccccc1O)(O)O LS10799 [0,1,0,0,0,0|2,0,0]=3 82 B10R1.61 B(c1cccnc1Br)(O)O LS20193 [0,1,0,0,0,0|3,0,0]=4 83 B10R1.61 B(c1cccnc1Cl)(O)O LS11093 [0,1,0,0,0,0|3,0,0]=4 84 B10R1.61 B(c1cccnc1F)(O)O LS11099 [0,1,0,0,0,0|3,0,0]=4 85 B10R1.61 B(c1cnccc1C)(O)O LS11105 [0,1,0,0,0,0|3,0,0]=4 86 B10R1.61 CC(=O)c1ccccc1N LS10731 [0,1,0,0,0,0|0,0,2]=3 87 B10R1.61 CC(=O)c1ccccc1O LS10607 [0,1,0,0,0,0|0,0,2]=3 88 B10R1.61 CC(=O)c1cccnc1Cl LS20570 [0,1,0,0,0,0|1,0,2]=4 89 B10R1.61 CN(C)c1ccccc1Br LS10558 [0,1,0,0,0,0|2,0,0]=3 90 B10R1.61 CN(C)c1ccccc1Cl LS10168 [0,1,0,0,0,0|2,0,0]=3 91 B10R1.61 CN(C)c1ccccc1F LS10242 [0,1,0,0,0,0|2,0,0]=3 92 B10R1.61 C[C@H](c1ccccc1Cl)O LS30121 [0,1,0,0,0,0|0,0,0]=1 93 B10R1.61 Cc1c(cccn1)C(=O)O LS20435 [0,1,0,0,0,0|2,0,1]=4 94 B10R1.61 Cc1ccccc1C(=O)O LS10119 [0,1,0,0,0,0|1,0,1]=3 95 B10R1.61 Cc1cccnc1C(=O)O LS20983 [0,1,0,0,0,0|2,0,1]=4 96 B10R1.61 c1cc(c(nc1)Br)C(=O)O LS20396 [0,1,0,0,0,0|2,0,1]=4 97 B10R1.61 c1cc(c(nc1)C(=O)O)F LS20394 [0,1,0,0,0,0|2,0,1]=4 98 B10R1.61 c1cc(c(nc1)C(=O)O)N LS00020 [0,1,0,0,0,0|2,0,1]=4 99 B10R1.61 c1cc(c(nc1)Cl)C(=O)O LS20665 [0,1,0,0,0,0|2,0,1]=4 100 B10R1.61 c1cc(c(nc1)N)C(=O)O LS20530 [0,1,0,0,0,0|2,0,1]=4 101 B10R1.61 c1cc(c(nc1)O)C(=O)O LS20423 [0,1,0,0,0,0|2,0,1]=4 102 B10R1.61 c1cc(c(nc1)S)C(=O)O LS20725 [0,1,0,0,0,0|2,0,1]=4 103 B10R1.61 c1ccc(c(c1)C(=O)N)N LS11473 [0,1,0,0,0,0|1,0,2]=4 104 B10R1.61 c1ccc(c(c1)C(=O)O)Br LS10336 [0,1,0,0,0,0|1,0,1]=3 105 B10R1.61 c1ccc(c(c1)C(=O)O)Cl LS10675 [0,1,0,0,0,0|1,0,1]=3 106 B10R1.61 c1ccc(c(c1)C(=O)O)I LS00003 [0,1,0,0,0,0|1,0,1]=3 107 B10R1.61 c1ccc(c(c1)N)[N+](=O)[O-] LS11572 [0,1,0,0,0,0|2,0,1]=4 108 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])Br LS11477 [0,1,0,0,0,0|2,0,1]=4 109 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])I LS11476 [0,1,0,0,0,0|2,0,1]=4 110 B10R1.61 c1cncc(c1C(=O)O)Br LS20726 [0,1,0,0,0,0|2,0,1]=4 111 B10R1.61 c1cncc(c1C(=O)O)F LS20409 [0,1,0,0,0,0|2,0,1]=4 112 B10R1.61 c1cncc(c1C(=O)O)N LS20439 [0,1,0,0,0,0|2,0,1]=4 113 B10R1.61 c1cncc(c1C(=O)O)O LS20035 [0,1,0,0,0,0|2,0,1]=4 114 B10R1.61 c1cncc(c1Cl)C(=O)O LS20834 [0,1,0,0,0,0|2,0,1]=4 115 B10R1.113 B(c1cc(cnc1)Br)(O)O LS11106 [0,1,0,0,0,0|3,0,0]=4 116 B10R1.113 B(c1cc(cnc1)Cl)(O)O LS11107 [0,1,0,0,0,0|3,0,0]=4 117 B10R1.113 B(c1cc(cnc1)F)(O)O LS20225 [0,1,0,0,0,0|3,0,0]=4 118 B10R1.113 B(c1cccc(c1)Br)(O)O LS10826 [0,1,0,0,0,0|2,0,0]=3 119 B10R1.113 B(c1cccc(c1)C)(O)O LS10847 [0,1,0,0,0,0|2,0,0]=3 120 B10R1.113 B(c1cccc(c1)Cl)(O)O LS00152 [0,1,0,0,0,0|2,0,0]=3 121 B10R1.113 B(c1cccc(c1)F)(O)O LS10837 [0,1,0,0,0,0|2,0,0]=3 122 B10R1.113 B(c1cccc(c1)N)(O)O LS10820 [0,1,0,0,0,0|2,0,0]=3 123 B10R1.113 B(c1cccc(c1)N)(O)O LS10821 [0,1,0,0,0,0|2,0,0]=3 124 B10R1.113 B(c1cccc(c1)N)(O)O LS11541 [0,1,0,0,0,0|2,0,0]=3 125 B10R1.113 B(c1cccc(c1)O)(O)O LS10839 [0,1,0,0,0,0|2,0,0]=3 126 B10R1.113 B(c1cccc(c1)S)(O)O LS10841 [0,1,0,0,0,0|2,0,0]=3 127 B10R1.113 B(c1ccnc(c1)Cl)(O)O LS20195 [0,1,0,0,0,0|3,0,0]=4 128 B10R1.113 B(c1ccnc(c1)F)(O)O LS20224 [0,1,0,0,0,0|3,0,0]=4 129 B10R1.113 CC(=O)c1cccc(c1)N LS11527 [0,1,0,0,0,0|0,0,2]=3 130 B10R1.113 CC(=O)c1cccc(n1)Br LS20488 [0,1,0,0,0,0|1,0,2]=4 131 B10R1.113 CN(C)c1cccc(c1)O LS11214 [0,1,0,0,0,0|2,0,0]=3 132 B10R1.113 Cc1ccnc(c1)C(=O)C LS21177 [0,1,0,0,0,0|1,0,2]=4 133 B10R1.113 c1c(cncc1Br)C(=O)O LS20729 [0,1,0,0,0,0|2,0,1]=4 134 B10R1.113 c1c(cncc1Cl)C(=O)O LS20728 [0,1,0,0,0,0|2,0,1]=4 135 B10R1.113 c1c(cncc1N)C(=O)O LS20110 [0,1,0,0,0,0|2,0,1]=4 136 B10R1.113 c1c(cncc1O)C(=O)O LS20727 [0,1,0,0,0,0|2,0,1]=4 137 B10R1.113 c1cc(cc(c1)Br)C(=N)N LS10543 [0,1,0,0,0,0|2,0,1]=4 138 B10R1.113 c1cc(cc(c1)O)[N+](=O)[O-] LS11800 [0,1,0,0,0,0|2,0,1]=4 139 B10R1.113 c1cc(nc(c1)Br)C(=O)O LS20438 [0,1,0,0,0,0|2,0,1]=4 140 B10R1.113 c1cc(nc(c1)Cl)C(=O)O LS20264 [0,1,0,0,0,0|2,0,1]=4 141 B10R1.113 c1cnc(cc1C(=O)O)Br LS20245 [0,1,0,0,0,0|2,0,1]=4 142 B10R1.113 c1cnc(cc1C(=O)O)Cl LS20583 [0,1,0,0,0,0|2,0,1]=4 143 B10R1.113 c1cnc(cc1C(=O)O)F LS20410 [0,1,0,0,0,0|2,0,1]=4 144 B10R1.113 c1cnc(cc1C(=O)O)N LS20627 [0,1,0,0,0,0|2,0,1]=4 145 B10R1.113 c1cnc(cc1C(=O)O)O LS20483 [0,1,0,0,0,0|2,0,1]=4 146 B8R1.7 B(c1ccco1)(O)O LS11074 [0,0,0,0,1,0|3,0,0]=4 147 B8R1.7 B(c1cccs1)(O)O LS00104 [0,0,0,0,1,0|3,0,0]=4 148 B8R1.7 B(c1ccoc1)(O)O LS11075 [0,0,0,0,1,0|3,0,0]=4 149 B8R1.7 B(c1ccsc1)(O)O LS11078 [0,0,0,0,1,0|3,0,0]=4 150 B8R1.7 CC(=O)c1cccs1 LS20643 [0,0,0,0,1,0|1,0,2]=4 151 B8R1.7 CC(=O)c1ccsc1 LS20391 [0,0,0,0,1,0|1,0,2]=4 152 B8R1.7 CC(C)c1c[nH]cn1 LS21206 [0,0,0,0,1,0|3,0,0]=4 153 B8R1.7 c1cc([nH]c1)C(=O)O LS20064 [0,0,0,0,1,0|2,0,1]=4 154 B8R1.7 c1cc(sc1)C(=O)O LS20648 [0,0,0,0,1,0|2,0,1]=4 155 B8R1.7 c1cscc1C(=O)O LS20647 [0,0,0,0,1,0|2,0,1]=4 156 B10R1.18 B(Cc1ccccc1)(O)O LS10783 [0,0,0,0,0,1|2,0,0]=3 157 B10R1.18 CC(=O)Cc1ccncc1 LS00130 [0,0,0,0,0,1|1,0,2]=4 158 B10R1.18 c1ccc(cc1)CC(=O)N LS11701 [0,0,0,0,0,1|1,0,2]=4 159 B7R1.3 c1cc(cnc1)Br LS20426 [2,0,0,0,0,0|2,0,0]=4 160 B7R1.3 c1cc(cnc1)F LS20779 [2,0,0,0,0,0|2,0,0]=4 161 B7R1.3 c1cc[nH]c(=O)c1 LS41474 [2,0,0,0,0,0|1,0,1]=4 162 B7R1.3 c1ccnc(c1)Br LS20874 [2,0,0,0,0,0|2,0,0]=4 163 B7R1.3 c1ccnc(c1)F LS20778 [2,0,0,0,0,0|2,0,0]=4 164 B7R1.3 c1ccnc(c1)N LS20582 [2,0,0,0,0,0|2,0,0]=4 165 B7R1.3 c1cnccc1F LS40545 [2,0,0,0,0,0|2,0,0]=4 166 B7R1.3 c1cnccc1N LS20499 [2,0,0,0,0,0|2,0,0]=4 167 B7R1.3 c1cnccc1O LS21099 [2,0,0,0,0,0|1,0,0]=3 168 B9R1.1 C=Cc1ccc(cc1)Br LS11650 [1,1,0,0,0,0|0,0,2]=4 169 B9R1.1 C=Cc1ccc(cc1)Cl LS11649 [1,1,0,0,0,0|0,0,2]=4 170 B9R1.1 CCc1ccc(cc1)F LS11765 [1,1,0,0,0,0|0,0,0]=2 171 B9R1.1 CCc1ccc(cn1)Br LS21179 [1,1,0,0,0,0|1,0,0]=3 172 B9R1.1 COc1ccc(cc1)O LS10474 [1,1,0,0,0,0|1,0,0]=3 173 B9R1.1 COc1ccc(cc1)S LS11831 [1,1,0,0,0,0|1,0,0]=3 174 B9R1.1 COc1ccc(cn1)Br LS21039 [1,1,0,0,0,0|2,0,0]=4 175 B9R1.1 COc1ccc(cn1)F LS20238 [1,1,0,0,0,0|2,0,0]=4 176 B9R1.1 COc1ccc(cn1)N LS20615 [1,1,0,0,0,0|2,0,0]=4 177 B9R1.1 COc1ccc(nc1)Cl LS20524 [1,1,0,0,0,0|2,0,0]=4 178 B9R1.1 Cc1ccc(cc1)C#C LS10578 [1,1,0,0,0,0|0,0,2]=4 179 B9R1.1 Cc1ccc(cc1)CBr LS11264 [1,1,0,0,0,0|1,0,0]=3 180 B9R1.1 Cc1ccc(cc1)CN LS11220 [1,1,0,0,0,0|1,0,0]=3 181 B9R1.1 Cc1ccc(cc1)CO LS11273 [1,1,0,0,0,0|0,0,0]=2 182 B9R1.1 Cc1ccc(nc1)OC LS20323 [1,1,0,0,0,0|2,0,0]=4 183 B9R1.1 c1cc(ccc1C#N)Br LS11574 [1,1,0,0,0,0|1,0,1]=4 184 B9R1.1 c1cc(ccc1C#N)F LS10440 [1,1,0,0,0,0|1,0,1]=4 185 B9R1.1 c1cc(ccc1C#N)N LS10115 [1,1,0,0,0,0|1,0,1]=4 186 B9R1.1 c1cc(ccc1C=O)Cl LS10198 [1,1,0,0,0,0|0,0,2]=4 187 B9R1.1 c1cc(ccc1CBr)Br LS11427 [1,1,0,0,0,0|1,0,0]=3 188 B9R1.1 c1cc(ccc1CBr)F LS10228 [1,1,0,0,0,0|1,0,0]=3 189 B9R1.1 c1cc(ccc1CBr)I LS11269 [1,1,0,0,0,0|1,0,0]=3 190 B9R1.1 c1cc(ccc1CCl)Cl LS11418 [1,1,0,0,0,0|1,0,0]=3 191 B9R1.1 c1cc(ccc1CO)I LS11275 [1,1,0,0,0,0|0,0,0]=2 192 B9R1.1 c1cc(ccc1CO)N LS10779 [1,1,0,0,0,0|0,0,0]=2 193 B9R1.1 c1cc(ccc1NN)F LS10358 [1,1,0,0,0,0|2,0,0]=4 194 B9R1.1 c1cc(ncc1Br)CO LS20572 [1,1,0,0,0,0|1,0,0]=3 195 B9R1.1 c1cc(ncc1CO)N LS40930 [1,1,0,0,0,0|1,0,0]=3 196 B9R1.2 C#Cc1cccc(c1)N LS10320 [1,1,0,0,0,0|0,0,2]=4 197 B9R1.2 C=Cc1cccc(c1)Br LS11651 [1,1,0,0,0,0|0,0,2]=4 198 B9R1.2 C=Cc1cccc(c1)Cl LS11652 [1,1,0,0,0,0|0,0,2]=4 199 B9R1.2 C=Cc1cccc(c1)F LS11648 [1,1,0,0,0,0|0,0,2]=4 200 B9R1.2 CNc1cccc(c1)Cl LS10187 [1,1,0,0,0,0|1,0,0]=3 201 B9R1.2 COc1cc(ccn1)Br LS21151 [1,1,0,0,0,0|2,0,0]=4 202 B9R1.2 COc1cc(ccn1)Cl LS20320 [1,1,0,0,0,0|2,0,0]=4 203 B9R1.2 COc1cc(ccn1)N LS20329 [1,1,0,0,0,0|2,0,0]=4 204 B9R1.2 COc1cccc(n1)Cl LS20709 [1,1,0,0,0,0|2,0,0]=4 205 B9R1.2 COc1cccc(n1)N LS20232 [1,1,0,0,0,0|2,0,0]=4 206 B9R1.2 Cc1cccc(c1)C=O LS11853 [1,1,0,0,0,0|0,0,2]=4 207 B9R1.2 Cc1cccc(c1)CBr LS11263 [1,1,0,0,0,0|1,0,0]=3 208 B9R1.2 Cc1cccc(c1)CCl LS11215 [1,1,0,0,0,0|1,0,0]=3 209 B9R1.2 Cc1cccc(c1)CN LS11219 [1,1,0,0,0,0|1,0,0]=3 210 B9R1.2 Cc1cccc(n1)CO LS20207 [1,1,0,0,0,0|1,0,0]=3 211 B9R1.2 c1cc(cc(c1)Br)CN LS11217 [1,1,0,0,0,0|1,0,0]=3 212 B9R1.2 c1cc(cc(c1)F)CO LS11387 [1,1,0,0,0,0|0,0,0]=2 213 B9R1.2 c1cc(cc(c1)I)C=O LS10324 [1,1,0,0,0,0|0,0,2]=4 214 B9R1.2 c1cc(cc(c1)I)CBr LS11267 [1,1,0,0,0,0|1,0,0]=3 215 B9R1.2 c1cc(cc(c1)O)C=O LS10593 [1,1,0,0,0,0|0,0,2]=4 216 B9R1.2 c1cnc(cc1CO)N LS21015 [1,1,0,0,0,0|1,0,0]=3 217 B9R1.8 CNNc1ccccc1 LS10173 [1,1,0,0,0,0|1,0,0]=3 218 B9R1.8 c1cc(cnc1)CC=O LS21221 [1,1,0,0,0,0|1,0,1]=4 219 B9R1.8 c1ccc(cc1)CCN LS10634 [1,1,0,0,0,0|0,0,0]=2 220 B9R1.8 c1ccc(cc1)CCN LS10635 [1,1,0,0,0,0|0,0,0]=2 221 B9R1.8 c1ccc(cc1)CNO LS11836 [1,1,0,0,0,0|0,0,0]=2 222 B9R1.8 c1ccc(cc1)CNO LS40338 [1,1,0,0,0,0|0,0,0]=2 223 B9R1.8 c1ccc(cc1)CON LS40003 [1,1,0,0,0,0|0,0,0]=2 224 B9R1.8 c1ccc(cc1)[Se]C#N LS11775 [1,1,0,0,0,0|1,0,1]=4 225 B9R1.8 c1ccnc(c1)CC#N LS20875 [1,1,0,0,0,0|1,0,1]=4 226 B9R1.8 c1cnccc1CCN LS21103 [1,1,0,0,0,0|1,0,0]=3 227 B9R1.15 C=Cc1ccccc1Br LS11653 [1,1,0,0,0,0|0,0,2]=4 228 B9R1.15 C=Cc1ccccc1Cl LS11654 [1,1,0,0,0,0|0,0,2]=4 229 B9R1.15 C=Cc1ccccc1F LS11647 [1,1,0,0,0,0|0,0,2]=4 230 B9R1.15 CCc1c(cncn1)F LS20618 [1,1,0,0,0,0|2,0,0]=4 231 B9R1.15 CNc1ccccc1Br LS11478 [1,1,0,0,0,0|1,0,0]=3 232 B9R1.15 CNc1ccccc1F LS10646 [1,1,0,0,0,0|1,0,0]=3 233 B9R1.15 COc1c(cccn1)I LS20331 [1,1,0,0,0,0|2,0,0]=4 234 B9R1.15 COc1cccnc1Br LS20368 [1,1,0,0,0,0|2,0,0]=4 235 B9R1.15 CSc1ccccc1Br LS11369 [1,1,0,0,0,0|1,0,0]=3 236 B9R1.15 Cc1ccccc1C#C LS11393 [1,1,0,0,0,0|0,0,2]=4 237 B9R1.15 Cc1ccccc1C=O LS11852 [1,1,0,0,0,0|0,0,2]=4 238 B9R1.15 Cc1ccccc1CBr LS11262 [1,1,0,0,0,0|1,0,0]=3 239 B9R1.15 Cc1ccccc1CN LS11218 [1,1,0,0,0,0|1,0,0]=3 240 B9R1.15 Cc1ccccc1CO LS11274 [1,1,0,0,0,0|0,0,0]=2 241 B9R1.15 c1cc(c(nc1)CO)O LS20165 [1,1,0,0,0,0|1,0,0]=3 242 B9R1.15 c1cc(c(nc1)Cl)CO LS20227 [1,1,0,0,0,0|1,0,0]=3 243 B9R1.15 c1cc(c(nc1)N)CO LS41435 [1,1,0,0,0,0|1,0,0]=3 244 B9R1.15 c1ccc(c(c1)C#N)Br LS11428 [1,1,0,0,0,0|1,0,1]=4 245 B9R1.15 c1ccc(c(c1)C#N)O LS10639 [1,1,0,0,0,0|1,0,1]=4 246 B9R1.15 c1ccc(c(c1)C=O)N LS10114 [1,1,0,0,0,0|0,0,2]=4 247 B9R1.15 c1ccc(c(c1)CBr)F LS11504 [1,1,0,0,0,0|1,0,0]=3 248 B9R1.15 c1ccc(c(c1)CBr)I LS11268 [1,1,0,0,0,0|1,0,0]=3 249 B9R1.15 c1ccc(c(c1)CN)Br LS11216 [1,1,0,0,0,0|1,0,0]=3 250 B9R1.15 c1ccc(c(c1)CO)F LS11270 [1,1,0,0,0,0|0,0,0]=2 251 B9R1.15 c1ccc(c(c1)CO)I LS11276 [1,1,0,0,0,0|0,0,0]=2 252 B9R1.15 c1ccc(c(c1)CO)N LS10594 [1,1,0,0,0,0|0,0,0]=2 253 B9R1.15 c1ccc(c(c1)NN)Br LS11826 [1,1,0,0,0,0|2,0,0]=4 254 B9R1.15 c1ccc(c(c1)NN)F LS11539 [1,1,0,0,0,0|2,0,0]=4 255 B11R1.20 CC(=O)Cc1ccc(cc1)Br LS11255 [0,1,0,0,0,1|0,0,2]=4 256 B11R1.20 CC(=O)Cc1ccc(cc1)Cl LS11258 [0,1,0,0,0,1|0,0,2]=4 257 B11R1.20 CC(=O)Cc1ccc(cc1)F LS11260 [0,1,0,0,0,1|0,0,2]=4 258 B11R1.20 CC(=O)Oc1ccc(cc1)F LS10377 [0,1,0,0,0,1|0,0,2]=4 259 B11R1.20 Cc1ccc(cc1)CC(=O)C LS11261 [0,1,0,0,0,1|0,0,2]=4 260 B11R1.20 Cc1ccc(cc1)NC(=O)C LS11875 [0,1,0,0,0,1|0,0,2]=4 261 B11R1.20 c1cc(ccc1CC(=O)O)Br LS10304 [0,1,0,0,0,1|1,0,1]=4 262 B11R1.20 c1cc(ccc1CC(=O)O)O LS10592 [0,1,0,0,0,1|1,0,1]=4 263 B11R1.36 CC(C)[C@H](c1ccccc1)O LS30202 [0,1,0,0,0,1|1,0,0]=3 264 B11R1.36 CC(c1ccccc1)C(=O)O LS10633 [0,1,0,0,0,1|1,0,1]=4 265 B11R1.36 C[C@H](c1ccccc1)C(=O)O LS30098 [0,1,0,0,0,1|1,0,1]=4 266 B11R1.36 c1ccc(cc1)C(C(=O)O)O LS00073 [0,1,0,0,0,1|1,0,1]=4 267 B11R1.86 CC(=O)Cc1ccccc1Br LS11253 [0,1,0,0,0,1|0,0,2]=4 268 B11R1.86 CC(=O)Cc1ccccc1Cl LS11256 [0,1,0,0,0,1|0,0,2]=4 269 B11R1.86 CC(=O)Cc1ccccc1F LS11259 [0,1,0,0,0,1|0,0,2]=4 270 B11R1.86 c1ccc(c(c1)CC(=O)O)O LS10642 [0,1,0,0,0,1|1,0,1]=4 271 B11R1.157 CC(=O)Cc1cccc(c1)Br LS11254 [0,1,0,0,0,1|0,0,2]=4 272 B11R1.157 CC(=O)Cc1cccc(c1)Cl LS11257 [0,1,0,0,0,1|0,0,2]=4 273 B11R1.509 CS(=O)(=O)Nc1ccccc1 LS40014 [0,1,0,0,0,1|1,0,1]=4 274 B11R1.509 C[N+](C)(C)Cc1ccccc1 LS40342 [0,1,0,0,0,1|2,0,0]=4 275 B11R1.509 C[N+](C)(C)Cc1ccccc1 LS41183 [0,1,0,0,0,1|2,0,0]=4 276 B11R1.509 c1ccc(cc1)OC(Cl)(Cl)Cl LS10133 [0,1,0,0,0,1|2,0,0]=4 277 B11R1.3 B(c1ccc(cc1)C#N)(O)O LS00153 [0,2,0,0,0,0|2,0,0]=4 278 B11R1.3 B(c1ccc(cc1)C=O)(O)O LS00096 [0,2,0,0,0,0|2,0,0]=4 279 B11R1.3 B(c1ccc(cc1)CBr)(O)O LS10869 [0,2,0,0,0,0|2,0,0]=4 280 B11R1.3 B(c1ccc(cc1)CC)(O)O LS10888 [0,2,0,0,0,0|2,0,0]=4 281 B11R1.3 B(c1ccc(cc1)CO)(O)O LS10891 [0,2,0,0,0,0|2,0,0]=4 282 B11R1.3 B(c1ccc(cc1)OC)(O)O LS10897 [0,2,0,0,0,0|2,0,0]=4 283 B11R1.3 B(c1ccc(cc1)SC)(O)O LS10900 [0,2,0,0,0,0|2,0,0]=4 284 B11R1.3 CC(=C)c1ccc(cc1)OC LS10061 [0,2,0,0,0,0|1,0,1]=4 285 B11R1.3 CN(C)c1ccc(cc1)C=O LS10650 [0,2,0,0,0,0|2,0,0]=4 286 B11R1.3 CN(C)c1ccc(cc1)OC LS10085 [0,2,0,0,0,0|2,0,0]=4 287 B11R1.3 COc1ccc(cc1)C(=O)O LS11457 [0,2,0,0,0,0|1,0,1]=4 288 B11R1.3 C[C@@H](c1ccc(cc1)OC)N LS30183 [0,2,0,0,0,0|1,0,0]=3 289 B11R1.3 C[C@H](c1ccc(cc1)OC)N LS30182 [0,2,0,0,0,0|1,0,0]=3 290 B11R1.3 c1cc(ccc1C=O)C(=O)O LS10649 [0,2,0,0,0,0|1,0,1]=4 291 B11R1.3 c1cc(ccc1CCl)C(=O)O LS11536 [0,2,0,0,0,0|1,0,1]=4 292 B11R1.19 CC(C)(C)c1ccc(cc1)Br LS11196 [0,2,0,0,0,0|1,0,0]=3 293 B11R1.19 CC(C)(c1ccc(cc1)Br)O LS11332 [0,2,0,0,0,0|0,0,0]=2 294 B11R1.19 Cc1ccc(cc1)S(=O)(=O)O LS30073 [0,2,0,0,0,0|2,0,0]=4 295 B11R1.19 Cc1ccc(cc1)S(=O)(=O)O LS30074 [0,2,0,0,0,0|2,0,0]=4 296 B11R1.19 c1cc(ccc1C(F)(F)F)N LS10568 [0,2,0,0,0,0|2,0,0]=4 297 B11R1.19 c1cc(ccc1C(F)(F)F)O LS10322 [0,2,0,0,0,0|2,0,0]=4 298 B11R1.19 c1cc(ccc1O)S(=O)(=O)O LS10671 [0,2,0,0,0,0|2,0,0]=4 299 B11R1.19 c1cc(ccc1S(=O)(=O)O)Cl LS10688 [0,2,0,0,0,0|2,0,0]=4 300 B11R1.21 B(c1ccc(c(c1)C)C)(O)O LS10947 [0,2,0,0,0,0|2,0,0]=4 301 B11R1.21 B(c1ccc(c(c1)C)F)(O)O LS11041 [0,2,0,0,0,0|2,0,0]=4 302 B11R1.21 B(c1ccc(c(c1)Cl)C)(O)O LS11005 [0,2,0,0,0,0|2,0,0]=4 303 B11R1.21 B(c1ccc(c(c1)Cl)Cl)(O)O LS10944 [0,2,0,0,0,0|2,0,0]=4 304 B11R1.21 B(c1ccc(c(c1)Cl)F)(O)O LS11001 [0,2,0,0,0,0|2,0,0]=4 305 B11R1.21 B(c1ccc(c(c1)Cl)O)(O)O LS11002 [0,2,0,0,0,0|2,0,0]=4 306 B11R1.21 B(c1ccc(c(c1)F)C)(O)O LS11014 [0,2,0,0,0,0|2,0,0]=4 307 B11R1.21 B(c1ccc(c(c1)F)Cl)(O)O LS11032 [0,2,0,0,0,0|2,0,0]=4 308 B11R1.21 B(c1ccc(c(c1)F)F)(O)O LS10945 [0,2,0,0,0,0|2,0,0]=4 309 B11R1.21 B(c1ccc(c(c1)N)C)(O)O LS10990 [0,2,0,0,0,0|2,0,0]=4 310 B11R1.21 B(c1ccc(c(c1)N)F)(O)O LS10989 [0,2,0,0,0,0|2,0,0]=4 311 B11R1.21 Cc1ccc(cc1Br)C(=O)O LS10330 [0,2,0,0,0,0|1,0,1]=4 312 B11R1.21 Cc1ccc(cc1Cl)C(=O)O LS10663 [0,2,0,0,0,0|1,0,1]=4 313 B11R1.21 Cc1ccc(cc1F)C(=O)O LS10532 [0,2,0,0,0,0|1,0,1]=4 314 B11R1.21 c1cc(c(cc1C(=O)O)F)F LS11167 [0,2,0,0,0,0|1,0,1]=4 315 B11R1.22 c1cc(ccc1C(=O)CN)Br LS11597 [0,2,0,0,0,0|0,0,2]=4 316 B11R1.22 c1cc(ccc1C(CN)O)O LS41256 [0,2,0,0,0,0|0,0,0]=2 317 B11R1.166 B(c1ccc(cc1C)C)(O)O LS10933 [0,2,0,0,0,0|2,0,0]=4 318 B11R1.166 B(c1ccc(cc1C)Cl)(O)O LS11030 [0,2,0,0,0,0|2,0,0]=4 319 B11R1.166 B(c1ccc(cc1C)F)(O)O LS11036 [0,2,0,0,0,0|2,0,0]=4 320 B11R1.166 B(c1ccc(cc1C)O)(O)O LS11044 [0,2,0,0,0,0|2,0,0]=4 321 B11R1.166 B(c1ccc(cc1Cl)C)(O)O LS11410 [0,2,0,0,0,0|2,0,0]=4 322 B11R1.166 B(c1ccc(cc1Cl)Cl)(O)O LS10929 [0,2,0,0,0,0|2,0,0]=4 323 B11R1.166 B(c1ccc(cc1Cl)F)(O)O LS10970 [0,2,0,0,0,0|2,0,0]=4 324 B11R1.166 B(c1ccc(cc1F)Br)(O)O LS11028 [0,2,0,0,0,0|2,0,0]=4 325 B11R1.166 B(c1ccc(cc1F)C)(O)O LS10981 [0,2,0,0,0,0|2,0,0]=4 326 B11R1.166 B(c1ccc(cc1F)Cl)(O)O LS10243 [0,2,0,0,0,0|2,0,0]=4 327 B11R1.166 B(c1ccc(cc1F)F)(O)O LS10930 [0,2,0,0,0,0|2,0,0]=4 328 B11R1.166 CC(=O)c1ccc(cc1Cl)Br LS10361 [0,2,0,0,0,0|0,0,2]=4 329 B11R1.166 CC(=O)c1ccc(cc1F)Cl LS10306 [0,2,0,0,0,0|0,0,2]=4 330 B11R1.166 CC(=O)c1ccc(cc1O)F LS10126 [0,2,0,0,0,0|0,0,2]=4 331 B11R1.166 CN(C)c1ccc(cc1Cl)Br LS10231 [0,2,0,0,0,0|2,0,0]=4 332 B11R1.166 Cc1cc(ccc1C(=O)O)F LS10581 [0,2,0,0,0,0|1,0,1]=4 333 B11R1.166 Cc1cc(ccc1C(C)C)O LS10720 [0,2,0,0,0,0|1,0,0]=3 334 B11R1.166 Cc1ccc(c(c1)F)C(=O)O LS10521 [0,2,0,0,0,0|1,0,1]=4 335 B11R1.166 c1cc(c(cc1Br)Br)C(=O)O LS10326 [0,2,0,0,0,0|1,0,1]=4 336 B11R1.166 c1cc(c(cc1Br)Cl)C(=O)O LS10346 [0,2,0,0,0,0|1,0,1]=4 337 B11R1.166 c1cc(c(cc1Br)F)C(=O)O LS10691 [0,2,0,0,0,0|1,0,1]=4 338 B11R1.166 c1cc(c(cc1Br)N)C(=O)O LS11470 [0,2,0,0,0,0|1,0,1]=4 339 B11R1.166 c1cc(c(cc1Cl)Cl)C(=O)O LS10673 [0,2,0,0,0,0|1,0,1]=4 340 B11R1.166 c1cc(c(cc1Cl)N)C(=O)O LS11433 [0,2,0,0,0,0|1,0,1]=4 341 B11R1.166 c1cc(c(cc1Cl)O)C(=O)O LS10716 [0,2,0,0,0,0|1,0,1]=4 342 B11R1.166 c1cc(c(cc1F)N)C(=O)O LS10234 [0,2,0,0,0,0|1,0,1]=4 343 B11R1.166 c1cc(c(cc1F)O)C(=O)O LS11396 [0,2,0,0,0,0|1,0,1]=4 344 B11R1.166 c1cc(c(cc1N)Cl)C(=O)O LS10725 [0,2,0,0,0,0|1,0,1]=4 345 B11R1.166 c1cc(c(cc1O)Cl)C(=O)O LS11739 [0,2,0,0,0,0|1,0,1]=4 346 B11R1.12 CN[C@@H](CO)c1ccccc1 LS30211 [0,2,0,0,0,0|0,0,0]=2 347 B11R1.12 CN[C@H](CO)c1ccccc1 LS30210 [0,2,0,0,0,0|0,0,0]=2 348 B11R1.16 C[C@@H](c1ccccc1)N=C=O LS30276 [0,2,0,0,0,0|0,0,1]=3 349 B11R1.16 c1ccc(cc1)[C@@H](CCCl)O LS30119 [0,2,0,0,0,0|0,0,0]=2 350 B11R1.23 CCC(=O)c1cccc(c1)Cl LS41311 [0,2,0,0,0,0|0,0,2]=4 351 B11R1.23 c1cc(cc(c1)Cl)C(=O)CCl LS10356 [0,2,0,0,0,0|0,0,2]=4 352 B11R1.222 CCC(=O)c1ccccc1Cl LS11338 [0,2,0,0,0,0|0,0,2]=4 353 B11R1.222 CNC(=O)c1ccccc1N LS11490 [0,2,0,0,0,0|0,0,2]=4 354 B11R1.222 COC(=O)c1ccccc1Cl LS10628 [0,2,0,0,0,0|0,0,2]=4 355 B11R1.222 Cc1ccccc1C(=O)CBr LS11319 [0,2,0,0,0,0|0,0,2]=4 356 B11R1.87 Cc1ccccc1C(F)(F)F LS10424 [0,2,0,0,0,0|2,0,0]=4 357 B11R1.155 CC(C)(C)c1cccc(c1)Br LS11194 [0,2,0,0,0,0|1,0,0]=3 358 B11R1.155 CC(C)(C)c1cccc(c1)N LS10290 [0,2,0,0,0,0|1,0,0]=3 359 B11R1.155 CC(C)(c1cccc(c1)Br)O LS10604 [0,2,0,0,0,0|0,0,0]=2 360 B11R1.155 Cc1cccc(c1)C(F)(F)F LS10423 [0,2,0,0,0,0|2,0,0]=4 361 B11R1.53 B(c1ccccc1C#N)(O)O LS10807 [0,2,0,0,0,0|2,0,0]=4 362 B11R1.53 B(c1ccccc1C=O)(O)O LS00094 [0,2,0,0,0,0|2,0,0]=4 363 B11R1.53 B(c1ccccc1C=O)(O)O LS00094 [0,2,0,0,0,0|2,0,0]=4 364 B11R1.53 B(c1ccccc1CBr)(O)O LS10791 [0,2,0,0,0,0|2,0,0]=4 365 B11R1.53 B(c1ccccc1CC)(O)O LS10539 [0,2,0,0,0,0|2,0,0]=4 366 B11R1.53 B(c1ccccc1CO)(O)O LS10798 [0,2,0,0,0,0|2,0,0]=4 367 B11R1.53 B(c1ccccc1OC)(O)O LS10801 [0,2,0,0,0,0|2,0,0]=4 368 B11R1.53 B(c1ccccc1SC)(O)O LS00116 [0,2,0,0,0,0|2,0,0]=4 369 B11R1.53 COc1ccccc1C(=O)O LS11456 [0,2,0,0,0,0|1,0,1]=4 370 B11R1.156 B(c1c(cccc1Br)F)(O)O LS11301 [0,2,0,0,0,0|2,0,0]=4 371 B11R1.156 B(c1c(cccc1C)C)(O)O LS10942 [0,2,0,0,0,0|2,0,0]=4 372 B11R1.156 B(c1c(cccc1Cl)Cl)(O)O LS10938 [0,2,0,0,0,0|2,0,0]=4 373 B11R1.156 B(c1c(cccc1F)F)(O)O LS10939 [0,2,0,0,0,0|2,0,0]=4 374 B11R1.156 CC(=O)c1c(cccc1Br)F LS11304 [0,2,0,0,0,0|0,0,2]=4 375 B11R1.156 CC(=O)c1c(cccc1F)F LS11166 [0,2,0,0,0,0|0,0,2]=4 376 B11R1.156 Cc1cccc(c1C(=O)O)O LS10070 [0,2,0,0,0,0|1,0,1]=4 377 B11R1.156 c1cc(c(c(c1)Br)C(=O)O)Cl LS10321 [0,2,0,0,0,0|1,0,1]=4 378 B11R1.156 c1cc(c(c(c1)Br)C(=O)O)F LS11335 [0,2,0,0,0,0|1,0,1]=4 379 B11R1.156 c1cc(c(c(c1)Br)C(=O)O)N LS10138 [0,2,0,0,0,0|1,0,1]=4 380 B11R1.156 c1cc(c(c(c1)Cl)C(=O)O)Cl LS11437 [0,2,0,0,0,0|1,0,1]=4 381 B11R1.156 c1cc(c(c(c1)Cl)C(=O)O)N LS11434 [0,2,0,0,0,0|1,0,1]=4 382 B11R1.156 c1cc(c(c(c1)F)C(=O)O)N LS10583 [0,2,0,0,0,0|1,0,1]=4 383 B11R1.156 c1cc(c(c(c1)F)C(=O)O)O LS10249 [0,2,0,0,0,0|1,0,1]=4 384 B11R1.159 B(c1cccc(c1C)C)(O)O LS10927 [0,2,0,0,0,0|2,0,0]=4 385 B11R1.159 B(c1cccc(c1C)F)(O)O LS11009 [0,2,0,0,0,0|2,0,0]=4 386 B11R1.159 B(c1cccc(c1Cl)Cl)(O)O LS10923 [0,2,0,0,0,0|2,0,0]=4 387 B11R1.159 B(c1cccc(c1F)Br)(O)O LS11300 [0,2,0,0,0,0|2,0,0]=4 388 B11R1.159 B(c1cccc(c1F)Cl)(O)O LS10998 [0,2,0,0,0,0|2,0,0]=4 389 B11R1.159 B(c1cccc(c1F)F)(O)O LS10924 [0,2,0,0,0,0|2,0,0]=4 390 B11R1.159 B(c1cccc(c1O)Br)(O)O LS10991 [0,2,0,0,0,0|2,0,0]=4 391 B11R1.159 CC(=O)c1cccc(c1F)Br LS10318 [0,2,0,0,0,0|0,0,2]=4 392 B11R1.159 CC(c1cccc(c1F)Br)O LS11305 [0,2,0,0,0,0|0,0,0]=2 393 B11R1.159 Cc1c(cccc1F)C(=O)O LS10580 [0,2,0,0,0,0|1,0,1]=4 394 B11R1.159 Cc1c(cccc1I)C(=O)O LS10045 [0,2,0,0,0,0|1,0,1]=4 395 B11R1.159 Cc1cccc(c1C)C(=O)O LS11825 [0,2,0,0,0,0|1,0,1]=4 396 B11R1.159 Cc1cccc(c1I)C(=O)O LS10145 [0,2,0,0,0,0|1,0,1]=4 397 B11R1.159 Cc1cccc(c1N)C(=O)O LS11462 [0,2,0,0,0,0|1,0,1]=4 398 B11R1.159 c1cc(c(c(c1)Br)F)C(=O)O LS10579 [0,2,0,0,0,0|1,0,1]=4 399 B11R1.159 c1cc(c(c(c1)Br)N)C(=O)O LS11484 [0,2,0,0,0,0|1,0,1]=4 400 B11R1.159 c1cc(c(c(c1)Cl)Cl)C(=O)O LS11460 [0,2,0,0,0,0|1,0,1]=4 401 B11R1.159 c1cc(c(c(c1)Cl)F)C(=O)O LS11404 [0,2,0,0,0,0|1,0,1]=4 402 B11R1.159 c1cc(c(c(c1)Cl)N)C(=O)O LS11486 [0,2,0,0,0,0|1,0,1]=4 403 B11R1.159 c1cc(c(c(c1)F)Br)C(=O)O LS10584 [0,2,0,0,0,0|1,0,1]=4 404 B11R1.159 c1cc(c(c(c1)F)F)C(=O)O LS11162 [0,2,0,0,0,0|1,0,1]=4 405 B11R1.159 c1cc(c(c(c1)F)N)C(=O)O LS11485 [0,2,0,0,0,0|1,0,1]=4 406 B11R1.159 c1cc(c(c(c1)I)F)C(=O)O LS10522 [0,2,0,0,0,0|1,0,1]=4 407 B11R1.159 c1cc(c(c(c1)N)F)C(=O)O LS10012 [0,2,0,0,0,0|1,0,1]=4 408 B11R1.159 c1cc(c(c(c1)N)N)C(=O)O LS11459 [0,2,0,0,0,0|1,0,1]=4 409 B11R1.159 c1cc(c(c(c1)O)O)C(=O)O LS10681 [0,2,0,0,0,0|1,0,1]=4 410 B11R1.167 B(c1cc(ccc1C)C)(O)O LS10937 [0,2,0,0,0,0|2,0,0]=4 411 B11R1.167 B(c1cc(ccc1C)Cl)(O)O LS11051 [0,2,0,0,0,0|2,0,0]=4 412 B11R1.167 B(c1cc(ccc1C)F)(O)O LS11054 [0,2,0,0,0,0|2,0,0]=4 413 B11R1.167 B(c1cc(ccc1Cl)Cl)(O)O LS10934 [0,2,0,0,0,0|2,0,0]=4 414 B11R1.167 B(c1cc(ccc1Cl)F)(O)O LS10975 [0,2,0,0,0,0|2,0,0]=4 415 B11R1.167 B(c1cc(ccc1F)C)(O)O LS10983 [0,2,0,0,0,0|2,0,0]=4 416 B11R1.167 B(c1cc(ccc1F)Cl)(O)O LS11048 [0,2,0,0,0,0|2,0,0]=4 417 B11R1.167 B(c1cc(ccc1F)F)(O)O LS10935 [0,2,0,0,0,0|2,0,0]=4 418 B11R1.167 B(c1cc(ccc1O)Cl)(O)O LS11049 [0,2,0,0,0,0|2,0,0]=4 419 B11R1.167 B(c1cc(ccc1O)F)(O)O LS11052 [0,2,0,0,0,0|2,0,0]=4 420 B11R1.167 CC(=O)c1cc(ccc1Br)Cl LS11579 [0,2,0,0,0,0|0,0,2]=4 421 B11R1.167 CC(=O)c1cc(ccc1Br)F LS10365 [0,2,0,0,0,0|0,0,2]=4 422 B11R1.167 CC(=O)c1cc(ccc1F)Br LS10106 [0,2,0,0,0,0|0,0,2]=4 423 B11R1.167 CC(=O)c1cc(ccc1I)F LS10113 [0,2,0,0,0,0|0,0,2]=4 424 B11R1.167 CC(=O)c1cc(ccc1O)O LS11715 [0,2,0,0,0,0|0,0,2]=4 425 B11R1.167 Cc1ccc(c(c1)C(=O)O)I LS10696 [0,2,0,0,0,0|1,0,1]=4 426 B11R1.167 Cc1ccc(cc1C(=O)O)Br LS10562 [0,2,0,0,0,0|1,0,1]=4 427 B11R1.167 Cc1ccc(cc1C(=O)O)F LS10582 [0,2,0,0,0,0|1,0,1]=4 428 B11R1.167 Cc1ccc(cc1C(=O)O)I LS11399 [0,2,0,0,0,0|1,0,1]=4 429 B11R1.167 c1cc(c(cc1Br)C(=O)O)Cl LS11201 [0,2,0,0,0,0|1,0,1]=4 430 B11R1.167 c1cc(c(cc1Br)C(=O)O)F LS10585 [0,2,0,0,0,0|1,0,1]=4 431 B11R1.167 c1cc(c(cc1Br)C(=O)O)N LS10708 [0,2,0,0,0,0|1,0,1]=4 432 B11R1.167 c1cc(c(cc1Cl)C(=O)O)Cl LS11832 [0,2,0,0,0,0|1,0,1]=4 433 B11R1.167 c1cc(c(cc1Cl)C(=O)O)N LS10348 [0,2,0,0,0,0|1,0,1]=4 434 B11R1.167 c1cc(c(cc1Cl)C(=O)O)O LS11420 [0,2,0,0,0,0|1,0,1]=4 435 B11R1.167 c1cc(c(cc1F)C(=O)O)F LS11164 [0,2,0,0,0,0|1,0,1]=4 436 B11R1.167 c1cc(c(cc1F)C(=O)O)N LS11464 [0,2,0,0,0,0|1,0,1]=4 437 B11R1.167 c1cc(c(cc1F)C(=O)O)O LS10523 [0,2,0,0,0,0|1,0,1]=4 438 B11R1.167 c1cc(c(cc1N)C(=O)O)O LS11426 [0,2,0,0,0,0|1,0,1]=4 439 B11R1.167 c1cc(c(cc1O)C(=O)O)F LS10475 [0,2,0,0,0,0|1,0,1]=4 440 B11R1.74 B(c1cc(cc(c1)Br)Br)(O)O LS10951 [0,2,0,0,0,0|2,0,0]=4 441 B11R1.74 B(c1cc(cc(c1)Br)Cl)(O)O LS10992 [0,2,0,0,0,0|2,0,0]=4 442 B11R1.74 B(c1cc(cc(c1)C)C)(O)O LS10955 [0,2,0,0,0,0|2,0,0]=4 443 B11R1.74 B(c1cc(cc(c1)Cl)Cl)(O)O LS10536 [0,2,0,0,0,0|2,0,0]=4 444 B11R1.74 B(c1cc(cc(c1)Cl)F)(O)O LS11006 [0,2,0,0,0,0|2,0,0]=4 445 B11R1.74 B(c1cc(cc(c1)F)F)(O)O LS10953 [0,2,0,0,0,0|2,0,0]=4 446 B11R1.74 B(c1cc(cc(c1)F)O)(O)O LS11015 [0,2,0,0,0,0|2,0,0]=4 447 B11R1.74 CC(=O)c1cc(cc(c1)F)F LS11171 [0,2,0,0,0,0|0,0,2]=4 448 B11R1.74 Cc1cc(cc(c1)N(C)C)C LS11804 [0,2,0,0,0,0|2,0,0]=4 449 B11R1.74 Cc1cc(cc(c1)N)C(=O)O LS10247 [0,2,0,0,0,0|1,0,1]=4 450 B11R1.74 c1c(cc(cc1Br)I)C(=O)O LS10332 [0,2,0,0,0,0|1,0,1]=4 451 B11R1.74 c1c(cc(cc1F)F)C(=O)O LS11169 [0,2,0,0,0,0|1,0,1]=4 452 B11R1.266 B(c1cccc(c1)C#N)(O)O LS10832 [0,2,0,0,0,0|2,0,0]=4 453 B11R1.266 B(c1cccc(c1)C=O)(O)O LS00095 [0,2,0,0,0,0|2,0,0]=4 454 B11R1.266 B(c1cccc(c1)CBr)(O)O LS10828 [0,2,0,0,0,0|2,0,0]=4 455 B11R1.266 B(c1cccc(c1)CO)(O)O LS10838 [0,2,0,0,0,0|2,0,0]=4 456 B11R1.266 B(c1cccc(c1)OC)(O)O LS10845 [0,2,0,0,0,0|2,0,0]=4 457 B11R1.266 B(c1cccc(c1)SC)(O)O LS10849 [0,2,0,0,0,0|2,0,0]=4 458 B11R1.266 COc1cccc(c1)C(=O)O LS11528 [0,2,0,0,0,0|1,0,1]=4 459 B11R2.10 CC1=Cc2ccccc2C1 LS00050 [0,0,0,1,0,1|1,0,1]=4 460 B11R2.10 c1ccc2c(c1)CC(=O)O2 LS40288 [0,0,0,1,0,1|0,0,2]=4 461 B11R2.10 c1ccc2c(c1)CC(C2)N LS40608 [0,0,0,1,0,1|1,0,0]=3 462 B11R2.10 c1ccc2c(c1)CC(C2)O LS40651 [0,0,0,1,0,1|0,0,0]=2 463 B11R2.10 c1ccc2c(c1)nc(o2)S LS40249 [0,0,0,1,0,1|1,0,1]=4 464 B11R2.1 c1ccc2c(c1)CCC2N LS40652 [0,1,0,1,0,0|1,0,0]=3 465 B11R2.1 c1ccc2c(c1)CC[C@H]2N LS30488 [0,1,0,1,0,0|1,0,0]=3 466 B11R2.40 c1ccc(cc1)C2(CC2)N LS10606 [0,1,0,1,0,0|1,0,0]=3 467 B7R1.1 CCc1[nH]ccn1 LS20052 [1,0,0,0,1,0|2,0,0]=4 468 B7R1.1 c1c(nc[nH]1)CO LS20464 [1,0,0,0,1,0|2,0,0]=4 469 B7R1.1 c1cc(sc1)CO LS20642 [1,0,0,0,1,0|1,0,0]=3 470 B7R1.1 c1cn(cn1)CO LS20270 [1,0,0,0,1,0|2,0,0]=4 471 B11R1.91 B(CCc1ccccc1)(O)O LS10785 [0,0,0,0,0,2|2,0,0]=4 472 B11R1.91 CC(=O)CCc1ccccc1 LS10597 [0,0,0,0,0,2|0,0,2]=4 473 B11R1.91 CC(CCc1ccccc1)N LS10632 [0,0,0,0,0,2|1,0,0]=3 474 B11R1.91 c1ccc(cc1)\C=C\C(=O)O LS00072 [0,0,0,0,0,2|1,0,1]=4