0 B10R1.13 B(c1ccc(cc1)Br)(O)O AB00202 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.13 B(c1ccc(cc1)C)(O)O AB01767 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.13 B(c1ccc(cc1)Cl)(O)O AB01763 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.13 B(c1ccc(cc1)F)(O)O AB01761 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.13 B(c1ccc(cc1)I)(O)O AB08832 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.13 B(c1ccc(cc1)N)(O)O AB08102 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.13 B(c1ccc(cc1)O)(O)O AB08076 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.13 B(c1ccc(cc1)S)(O)O AB13276 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.13 B(c1ccc(cn1)C)(O)O AB06946 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.13 B(c1ccc(nc1)C)(O)O AB30208 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.13 CC(=C)c1ccc(cc1)O CB10241 [0,0,0,0,0,0|1,0,2]=3 11 B10R1.13 CC(=O)c1ccc(cn1)Br AB21518 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.13 CC(=O)c1ccc(cn1)Cl AB41101 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.13 CC(=O)c1ccc(cn1)F AB62503 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.13 CC(=O)c1ccc(cn1)N AB60315 [0,0,0,0,0,0|3,0,1]=4 15 B10R1.13 CC(=O)c1ccc(cn1)O AB60308 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.13 CC(=O)c1ccc(nc1)Br AB21520 [0,0,0,0,0,0|3,0,1]=4 17 B10R1.13 CC(=O)c1ccc(nc1)Cl AB14033 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.13 CC(=O)c1ccc(nc1)F AB41115 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.13 CC(=O)c1ccc(nc1)N AB49552 [0,0,0,0,0,0|3,0,1]=4 20 B10R1.13 CC(=O)c1ccc(nc1)O AB60297 [0,0,0,0,0,0|3,0,1]=4 21 B10R1.13 CC(C)c1ccc(cn1)Br MB11629 [0,0,0,0,0,0|2,0,0]=2 22 B10R1.13 CC(C)c1ccc(cn1)N PB22166 [0,0,0,0,0,0|2,0,0]=2 23 B10R1.13 CC(C)c1ccc(cn1)O MB08432 [0,0,0,0,0,0|2,0,0]=2 24 B10R1.13 CC(C)c1ccc(nc1)Br MB10296 [0,0,0,0,0,0|2,0,0]=2 25 B10R1.13 CC(C)c1ccc(nn1)Cl MB11649 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.13 CC(C)c1cnc(cn1)Br AB64004 [0,0,0,0,0,0|3,0,0]=3 27 B10R1.13 CC(C)c1cnc(cn1)Cl AB70173 [0,0,0,0,0,0|3,0,0]=3 28 B10R1.13 CC(C)c1ncc(cn1)Br PB22629 [0,0,0,0,0,0|3,0,0]=3 29 B10R1.13 CC(C)c1ncc(cn1)Cl AB59147 [0,0,0,0,0,0|3,0,0]=3 30 B10R1.13 CC(C)c1ncc(cn1)N AB58991 [0,0,0,0,0,0|3,0,0]=3 31 B10R1.13 CC(C)c1ncc(cn1)O AB58598 [0,0,0,0,0,0|3,0,0]=3 32 B10R1.13 CC(c1ccc(cn1)F)N PB27166 [0,0,0,0,0,0|3,0,0]=3 33 B10R1.13 CC(c1ccc(nc1)Br)N AB67301 [0,0,0,0,0,0|3,0,0]=3 34 B10R1.13 CC(c1ccc(nc1)Cl)N AB67348 [0,0,0,0,0,0|3,0,0]=3 35 B10R1.13 CC(c1ncc(cn1)Cl)N AB59171 [0,0,0,0,0,0|4,0,0]=4 36 B10R1.13 CC(c1ncc(cn1)F)N PB11305 [0,0,0,0,0,0|4,0,0]=4 37 B10R1.13 CN(C)c1ccc(cc1)O CB10546 [0,0,0,0,0,0|2,0,0]=2 38 B10R1.13 CN(C)c1ccc(cc1)O MB02001 [0,0,0,0,0,0|2,0,0]=2 39 B10R1.13 CN(C)c1ccc(cn1)Br AB03372 [0,0,0,0,0,0|3,0,0]=3 40 B10R1.13 CN(C)c1ccc(cn1)Cl AB67483 [0,0,0,0,0,0|3,0,0]=3 41 B10R1.13 CN(C)c1ccc(cn1)N PB31328 [0,0,0,0,0,0|3,0,0]=3 42 B10R1.13 CN(C)c1ccc(cn1)O MB24899 [0,0,0,0,0,0|3,0,0]=3 43 B10R1.13 CN(C)c1ccc(nc1)Br MB00661 [0,0,0,0,0,0|3,0,0]=3 44 B10R1.13 CN(C)c1ccc(nn1)Cl MB02512 [0,0,0,0,0,0|4,0,0]=4 45 B10R1.13 CN(C)c1cnc(cn1)Br AB54253 [0,0,0,0,0,0|4,0,0]=4 46 B10R1.13 CN(C)c1cnc(nc1)Br MB14134 [0,0,0,0,0,0|4,0,0]=4 47 B10R1.13 CN(C)c1cnc(nc1)Cl AB60172 [0,0,0,0,0,0|4,0,0]=4 48 B10R1.13 CN(C)c1ncc(cn1)O AB58594 [0,0,0,0,0,0|4,0,0]=4 49 B10R1.13 C[C@@H](c1ccc(nc1)Cl)N AB49730 [0,0,0,0,0,0|3,0,0]=3 50 B10R1.13 C[C@@H](c1ncc(cn1)F)N AB73466 [0,0,0,0,0,0|4,0,0]=4 51 B10R1.13 C[C@H](c1ccc(nc1)Cl)N AB49726 [0,0,0,0,0,0|3,0,0]=3 52 B10R1.13 C[C@H](c1ncc(cn1)F)N AB73465 [0,0,0,0,0,0|4,0,0]=4 53 B10R1.13 Cc1ccc(cc1)C(=N)N AB01792 [0,0,0,0,0,0|2,0,1]=3 54 B10R1.13 Cc1ccc(cc1)C(=S)N AB04365 [0,0,0,0,0,0|2,0,1]=3 55 B10R1.13 Cc1ccc(cn1)C(=O)C AB03568 [0,0,0,0,0,0|2,0,1]=3 56 B10R1.13 Cc1ccc(cn1)C(=O)Cl AB44670 [0,0,0,0,0,0|3,0,1]=4 57 B10R1.13 Cc1ccc(cn1)C(=O)O AB00723 [0,0,0,0,0,0|3,0,1]=4 58 B10R1.13 Cc1ccc(cn1)C(C)N AB53828 [0,0,0,0,0,0|2,0,0]=2 59 B10R1.13 Cc1ccc(cn1)C(F)F AB76728 [0,0,0,0,0,0|3,0,0]=3 60 B10R1.13 Cc1ccc(cn1)[N+](=O)[O-] PB18660 [0,0,0,0,0,0|4,0,0]=4 61 B10R1.13 Cc1ccc(nc1)C(=O)C AB25779 [0,0,0,0,0,0|2,0,1]=3 62 B10R1.13 Cc1ccc(nc1)C(=O)O AB09798 [0,0,0,0,0,0|3,0,1]=4 63 B10R1.13 Cc1ccc(nn1)C(=O)C AB75459 [0,0,0,0,0,0|3,0,1]=4 64 B10R1.13 Cc1cnc(cn1)C(=O)C AB02269 [0,0,0,0,0,0|3,0,1]=4 65 B10R1.13 Cc1cnc(nc1)C(C)N AB59472 [0,0,0,0,0,0|3,0,0]=3 66 B10R1.13 c1cc(ccc1C(=N)N)Br AB06234 [0,0,0,0,0,0|3,0,1]=4 67 B10R1.13 c1cc(ccc1C(=N)N)Cl AB03527 [0,0,0,0,0,0|3,0,1]=4 68 B10R1.13 c1cc(ccc1C(=N)N)F AB18284 [0,0,0,0,0,0|3,0,1]=4 69 B10R1.13 c1cc(ccc1C(=N)N)I AB18403 [0,0,0,0,0,0|3,0,1]=4 70 B10R1.13 c1cc(ccc1C(=N)N)N AB01119 [0,0,0,0,0,0|3,0,1]=4 71 B10R1.13 c1cc(ccc1C(=N)N)O AB03766 [0,0,0,0,0,0|3,0,1]=4 72 B10R1.13 c1cc(ccc1C(=S)N)Br AB18142 [0,0,0,0,0,0|3,0,1]=4 73 B10R1.13 c1cc(ccc1C(=S)N)Cl AB01841 [0,0,0,0,0,0|3,0,1]=4 74 B10R1.13 c1cc(ccc1C(=S)N)F AB08498 [0,0,0,0,0,0|3,0,1]=4 75 B10R1.13 c1cc(ccc1C(=S)N)N AB01833 [0,0,0,0,0,0|3,0,1]=4 76 B10R1.13 c1cc(ccc1C(=S)N)O AB21285 [0,0,0,0,0,0|3,0,1]=4 77 B10R1.13 c1cc(ncc1Br)C(F)F AB65154 [0,0,0,0,0,0|4,0,0]=4 78 B10R1.13 c1cc(ncc1C(F)F)Br AB70749 [0,0,0,0,0,0|4,0,0]=4 79 B10R1.13 c1cc(ncc1C(F)F)Cl AB70755 [0,0,0,0,0,0|4,0,0]=4 80 B10R1.13 c1cc(ncc1C(F)F)F AB76727 [0,0,0,0,0,0|4,0,0]=4 81 B10R1.13 c1cc(ncc1C(F)F)N AB74782 [0,0,0,0,0,0|4,0,0]=4 82 B10R1.13 c1cc(ncc1N)C(F)F AB75496 [0,0,0,0,0,0|4,0,0]=4 83 B10R1.13 c1cc(ncc1O)C(F)F AB74785 [0,0,0,0,0,0|4,0,0]=4 84 B9R1.1 C#Cc1ccc(cc1)Cl PB21668 [1,0,0,0,0,0|1,0,2]=4 85 B9R1.1 CCc1ccc(cn1)N AB63590 [1,0,0,0,0,0|2,0,0]=3 86 B9R1.1 CCc1ccc(cn1)O MB03842 [1,0,0,0,0,0|2,0,0]=3 87 B9R1.1 CCc1ccc(nc1)Br MB10294 [1,0,0,0,0,0|2,0,0]=3 88 B9R1.1 CCc1cnc(cn1)Br AB64001 [1,0,0,0,0,0|3,0,0]=4 89 B9R1.1 CCc1cnc(cn1)Cl AB73111 [1,0,0,0,0,0|3,0,0]=4 90 B9R1.1 CCc1cnc(cn1)N AB60527 [1,0,0,0,0,0|3,0,0]=4 91 B9R1.1 CCc1cnc(nc1)Cl PB27514 [1,0,0,0,0,0|3,0,0]=4 92 B9R1.1 CCc1cnc(nc1)N AB51220 [1,0,0,0,0,0|3,0,0]=4 93 B9R1.1 CCc1ncc(cn1)N PB12017 [1,0,0,0,0,0|3,0,0]=4 94 B9R1.1 CNc1ccc(cn1)Br AB44353 [1,0,0,0,0,0|3,0,0]=4 95 B9R1.1 CNc1ccc(cn1)Cl AB07756 [1,0,0,0,0,0|3,0,0]=4 96 B9R1.1 CNc1ccc(cn1)O AB69733 [1,0,0,0,0,0|3,0,0]=4 97 B9R1.1 CNc1ccc(nc1)Br MB01005 [1,0,0,0,0,0|3,0,0]=4 98 B9R1.1 CNc1ccc(nc1)Cl AB60605 [1,0,0,0,0,0|3,0,0]=4 99 B9R1.1 COc1cc[n+](cc1)[O-] AB00619 [1,0,0,0,0,0|3,0,0]=4 100 B9R1.1 COc1ccc(cn1)Br AB08771 [1,0,0,0,0,0|3,0,0]=4 101 B9R1.1 COc1ccc(cn1)Cl AB23682 [1,0,0,0,0,0|3,0,0]=4 102 B9R1.1 COc1ccc(cn1)F AB13611 [1,0,0,0,0,0|3,0,0]=4 103 B9R1.1 COc1ccc(cn1)N PB27370 [1,0,0,0,0,0|3,0,0]=4 104 B9R1.1 COc1ccc(cn1)O CB10969 [1,0,0,0,0,0|3,0,0]=4 105 B9R1.1 COc1ccc(nc1)Br PB22062 [1,0,0,0,0,0|3,0,0]=4 106 B9R1.1 COc1ccc(nc1)Cl AB25956 [1,0,0,0,0,0|3,0,0]=4 107 B9R1.1 COc1ccc(nc1)F AB66773 [1,0,0,0,0,0|3,0,0]=4 108 B9R1.1 COc1ccc(nc1)I AB11726 [1,0,0,0,0,0|3,0,0]=4 109 B9R1.1 COc1ccc(nc1)N PB14487 [1,0,0,0,0,0|3,0,0]=4 110 B9R1.1 CSc1ccc(cn1)Br AB14151 [1,0,0,0,0,0|3,0,0]=4 111 B9R1.1 CSc1ccc(cn1)O MB25590 [1,0,0,0,0,0|3,0,0]=4 112 B9R1.1 CSc1ccc(nc1)Br MB03440 [1,0,0,0,0,0|3,0,0]=4 113 B9R1.1 Cc1ccc(cn1)C#N PB30561 [1,0,0,0,0,0|2,0,1]=4 114 B9R1.1 Cc1ccc(cn1)C=C PB17233 [1,0,0,0,0,0|1,0,2]=4 115 B9R1.1 Cc1ccc(cn1)C=O PB17503 [1,0,0,0,0,0|2,0,1]=4 116 B9R1.1 Cc1ccc(cn1)CCl AB59938 [1,0,0,0,0,0|2,0,0]=3 117 B9R1.1 Cc1ccc(cn1)CN PB20145 [1,0,0,0,0,0|2,0,0]=3 118 B9R1.1 Cc1ccc(cn1)NN PB15841 [1,0,0,0,0,0|3,0,0]=4 119 B9R1.1 Cc1ccc(cn1)OC AB52739 [1,0,0,0,0,0|2,0,0]=3 120 B9R1.1 Cc1ccc(nc1)C=O AB31466 [1,0,0,0,0,0|2,0,1]=4 121 B9R1.1 Cc1ccc(nc1)CCl AB59994 [1,0,0,0,0,0|2,0,0]=3 122 B9R1.1 Cc1ccc(nc1)CN AB48926 [1,0,0,0,0,0|2,0,0]=3 123 B9R1.1 Cc1ccc(nn1)CN PB19500 [1,0,0,0,0,0|3,0,0]=4 124 B9R1.1 Cc1ccc(nn1)CO AB44109 [1,0,0,0,0,0|3,0,0]=4 125 B9R1.1 Cc1ccc(nn1)OC AB51434 [1,0,0,0,0,0|3,0,0]=4 126 B9R1.1 Cc1cnc(cn1)CCl PB10823 [1,0,0,0,0,0|3,0,0]=4 127 B9R1.1 Cc1cnc(cn1)CN PB33936 [1,0,0,0,0,0|3,0,0]=4 128 B9R1.1 Cc1cnc(nc1)CCl PB19771 [1,0,0,0,0,0|3,0,0]=4 129 B9R1.1 Cc1cnc(nc1)CCl PB31488 [1,0,0,0,0,0|3,0,0]=4 130 B9R1.1 Cc1cnc(nc1)CN PB22419 [1,0,0,0,0,0|3,0,0]=4 131 B9R1.1 Cc1cnc(nc1)CO PB23808 [1,0,0,0,0,0|3,0,0]=4 132 B9R1.1 Cc1ncc(cn1)CCl PB22329 [1,0,0,0,0,0|3,0,0]=4 133 B9R1.1 Cc1ncc(cn1)CN PB14812 [1,0,0,0,0,0|3,0,0]=4 134 B9R1.1 Cc1ncc(cn1)CO PB17615 [1,0,0,0,0,0|3,0,0]=4 135 B9R1.1 [C-]#[N+]c1ccc(cc1)Cl MB03556 [1,0,0,0,0,0|2,0,1]=4 136 B9R1.1 c1cc(ccc1CBr)Br AB00113 [1,0,0,0,0,0|2,0,0]=3 137 B9R1.1 c1cc(ccc1CBr)Cl AB01810 [1,0,0,0,0,0|2,0,0]=3 138 B9R1.1 c1cc(ccc1CI)O MB06957 [1,0,0,0,0,0|2,0,0]=3 139 B9R1.1 c1cc(ccc1CN)O AB11678 [1,0,0,0,0,0|2,0,0]=3 140 B9R1.1 c1cc(ncc1Br)CCl AB60010 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.1 c1cc(ncc1Br)CN AB23456 [1,0,0,0,0,0|3,0,0]=4 142 B9R1.1 c1cc(ncc1Br)CO AB66533 [1,0,0,0,0,0|3,0,0]=4 143 B9R1.1 c1cc(ncc1Br)CO PB18645 [1,0,0,0,0,0|3,0,0]=4 144 B9R1.1 c1cc(ncc1CBr)F PB28287 [1,0,0,0,0,0|3,0,0]=4 145 B9R1.1 c1cc(ncc1CCl)Br AB59933 [1,0,0,0,0,0|3,0,0]=4 146 B9R1.1 c1cc(ncc1CCl)Cl AB03513 [1,0,0,0,0,0|3,0,0]=4 147 B9R1.1 c1cc(ncc1CCl)Cl AB59950 [1,0,0,0,0,0|3,0,0]=4 148 B9R1.1 c1cc(ncc1CCl)F PB13291 [1,0,0,0,0,0|3,0,0]=4 149 B9R1.1 c1cc(ncc1CCl)N AB59930 [1,0,0,0,0,0|3,0,0]=4 150 B9R1.1 c1cc(ncc1CN)Br AB27793 [1,0,0,0,0,0|3,0,0]=4 151 B9R1.1 c1cc(ncc1CN)Cl PB17175 [1,0,0,0,0,0|3,0,0]=4 152 B9R1.1 c1cc(ncc1CN)F PB19133 [1,0,0,0,0,0|3,0,0]=4 153 B9R1.1 c1cc(ncc1CO)Br PB14409 [1,0,0,0,0,0|3,0,0]=4 154 B9R1.1 c1cc(ncc1CO)Cl PB17199 [1,0,0,0,0,0|3,0,0]=4 155 B9R1.1 c1cc(ncc1CO)F PB14327 [1,0,0,0,0,0|3,0,0]=4 156 B9R1.1 c1cc(ncc1CO)N PB26211 [1,0,0,0,0,0|3,0,0]=4 157 B9R1.1 c1cc(ncc1Cl)CCl PB17759 [1,0,0,0,0,0|3,0,0]=4 158 B9R1.1 c1cc(ncc1Cl)CN AB60187 [1,0,0,0,0,0|3,0,0]=4 159 B9R1.1 c1cc(ncc1Cl)CO AB56068 [1,0,0,0,0,0|3,0,0]=4 160 B9R1.1 c1cc(ncc1F)CCl AB62501 [1,0,0,0,0,0|3,0,0]=4 161 B9R1.1 c1cc(ncc1F)CN AB60189 [1,0,0,0,0,0|3,0,0]=4 162 B9R1.1 c1cc(ncc1F)CO PB22210 [1,0,0,0,0,0|3,0,0]=4 163 B9R1.1 c1cc(ncc1N)CN AB23447 [1,0,0,0,0,0|3,0,0]=4 164 B9R1.1 c1cc(ncc1N)CO AB31872 [1,0,0,0,0,0|3,0,0]=4 165 B9R1.1 c1cc(ncc1O)CN MB14856 [1,0,0,0,0,0|3,0,0]=4 166 B9R1.6 CC(=O)c1ccccn1 AB00686 [1,0,0,0,0,0|2,0,1]=4 167 B9R1.6 CC(=O)c1cccnc1 AB00750 [1,0,0,0,0,0|2,0,1]=4 168 B9R1.6 CC(=O)c1ccncc1 AB00760 [1,0,0,0,0,0|2,0,1]=4 169 B9R1.6 CC(C)c1ccccn1 PB21659 [1,0,0,0,0,0|1,0,0]=2 170 B9R1.6 CC(c1ccccc1)Cl AB01249 [1,0,0,0,0,0|1,0,0]=2 171 B9R1.6 CC(c1ccccn1)N AB21604 [1,0,0,0,0,0|2,0,0]=3 172 B9R1.6 CC(c1cccnc1)N AB09764 [1,0,0,0,0,0|2,0,0]=3 173 B9R1.6 CC(c1ccncc1)N AB11609 [1,0,0,0,0,0|2,0,0]=3 174 B9R1.6 CC(c1ccncn1)N PB34498 [1,0,0,0,0,0|3,0,0]=4 175 B9R1.6 CC(c1ccnnc1)N PB22705 [1,0,0,0,0,0|3,0,0]=4 176 B9R1.6 CC(c1cnccn1)N PB14922 [1,0,0,0,0,0|3,0,0]=4 177 B9R1.6 CC(c1cncnc1)N PB22435 [1,0,0,0,0,0|3,0,0]=4 178 B9R1.6 CC(c1ncccn1)N AB59468 [1,0,0,0,0,0|3,0,0]=4 179 B9R1.6 CN(C)c1ncccn1 AB64628 [1,0,0,0,0,0|3,0,0]=4 180 B9R1.6 C[C@@H](c1cccnc1)N AB49737 [1,0,0,0,0,0|2,0,0]=3 181 B9R1.6 C[C@@H](c1ccncc1)N AB49749 [1,0,0,0,0,0|2,0,0]=3 182 B9R1.6 C[C@@H](c1cncnc1)N PB15383 [1,0,0,0,0,0|3,0,0]=4 183 B9R1.6 C[C@H](c1cccnc1)N AB49734 [1,0,0,0,0,0|2,0,0]=3 184 B9R1.6 C[C@H](c1ccncc1)N AB49745 [1,0,0,0,0,0|2,0,0]=3 185 B9R1.6 C[C@H](c1cncnc1)N PB28768 [1,0,0,0,0,0|3,0,0]=4 186 B9R1.6 c1cc(cnc1)C(F)F AB64034 [1,0,0,0,0,0|3,0,0]=4 187 B9R1.6 c1ccc(cc1)C(=N)N AB01943 [1,0,0,0,0,0|2,0,1]=4 188 B9R1.6 c1ccnc(c1)C(F)F AB64042 [1,0,0,0,0,0|3,0,0]=4 189 B11R1.3 B(c1ccc(cc1)CBr)(O)O AB08630 [0,1,0,0,0,0|3,0,0]=4 190 B11R1.3 B(c1ccc(cc1)CC)(O)O AB07463 [0,1,0,0,0,0|3,0,0]=4 191 B11R1.3 B(c1ccc(cc1)CCl)(O)O AB30901 [0,1,0,0,0,0|3,0,0]=4 192 B11R1.3 B(c1ccc(cc1)CN)(O)O AB09461 [0,1,0,0,0,0|3,0,0]=4 193 B11R1.3 B(c1ccc(cc1)CO)(O)O AB07121 [0,1,0,0,0,0|3,0,0]=4 194 B11R1.3 B(c1ccc(cc1)OC)(O)O AB01770 [0,1,0,0,0,0|3,0,0]=4 195 B11R1.3 B(c1ccc(cc1)SC)(O)O AB03347 [0,1,0,0,0,0|3,0,0]=4 196 B11R1.3 CC(=O)c1ccc(cc1)C#C AB21444 [0,1,0,0,0,0|1,0,2]=4 197 B11R1.3 CC(=O)c1ccc(cn1)OC PB14835 [0,1,0,0,0,0|2,0,1]=4 198 B11R1.3 CC(=O)c1ccc(nc1)OC AB22367 [0,1,0,0,0,0|2,0,1]=4 199 B11R1.3 CC(C)c1cnc(cn1)C=O AB73119 [0,1,0,0,0,0|2,0,1]=4 200 B11R1.3 CC(C)c1cnc(cn1)CCl AB73123 [0,1,0,0,0,0|2,0,0]=3 201 B11R1.3 CC(C)c1cnc(cn1)CN AB73125 [0,1,0,0,0,0|2,0,0]=3 202 B11R1.3 CC(C)c1cnc(nc1)CCl AB59467 [0,1,0,0,0,0|2,0,0]=3 203 B11R1.3 CC(C)c1cnc(nc1)CN AB59257 [0,1,0,0,0,0|2,0,0]=3 204 B11R1.3 CC(C)c1ncc(cn1)C=O AB30578 [0,1,0,0,0,0|2,0,1]=4 205 B11R1.3 CC(C)c1ncc(cn1)CCl AB58914 [0,1,0,0,0,0|2,0,0]=3 206 B11R1.3 CC(C)c1ncc(cn1)CN AB58539 [0,1,0,0,0,0|2,0,0]=3 207 B11R1.3 CC(c1ccc(nc1)OC)N AB67099 [0,1,0,0,0,0|2,0,0]=3 208 B11R1.3 CCc1ccc(cc1)C(=S)N AB23762 [0,1,0,0,0,0|2,0,1]=4 209 B11R1.3 CN(C)c1ccc(cc1)CO AB16431 [0,1,0,0,0,0|1,0,0]=2 210 B11R1.3 CN(C)c1ccc(cn1)C#C AB69048 [0,1,0,0,0,0|2,0,1]=4 211 B11R1.3 CN(C)c1ccc(cn1)C#N AB44360 [0,1,0,0,0,0|2,0,1]=4 212 B11R1.3 CN(C)c1ccc(cn1)C=O AB44362 [0,1,0,0,0,0|2,0,1]=4 213 B11R1.3 CN(C)c1ccc(cn1)CN AB44372 [0,1,0,0,0,0|2,0,0]=3 214 B11R1.3 CN(C)c1ccc(cn1)CO AB44151 [0,1,0,0,0,0|2,0,0]=3 215 B11R1.3 CN(C)c1ccc(nc1)C=O AB73189 [0,1,0,0,0,0|2,0,1]=4 216 B11R1.3 CN(C)c1cnc(nc1)CN PB26568 [0,1,0,0,0,0|3,0,0]=4 217 B11R1.3 CN(C)c1ncc(cn1)CCl AB58918 [0,1,0,0,0,0|3,0,0]=4 218 B11R1.3 CN(C)c1ncc(cn1)CN AB45474 [0,1,0,0,0,0|3,0,0]=4 219 B11R1.3 COc1ccc(cc1)C(=N)N AB06258 [0,1,0,0,0,0|2,0,1]=4 220 B11R1.3 COc1ccc(cc1)C(=O)N AB00908 [0,1,0,0,0,0|2,0,1]=4 221 B11R1.3 COc1ccc(cc1)C(=S)N AB01847 [0,1,0,0,0,0|2,0,1]=4 222 B11R1.3 c1cc(ncc1C(F)F)CCl AB74773 [0,1,0,0,0,0|3,0,0]=4 223 B11R1.3 c1cc(ncc1C(F)F)CN AB74779 [0,1,0,0,0,0|3,0,0]=4 224 B11R1.3 c1cc(ncc1CCl)C(F)F AB74767 [0,1,0,0,0,0|3,0,0]=4 225 B11R1.3 c1cc(ncc1CN)C(F)F AB74775 [0,1,0,0,0,0|3,0,0]=4 226 B11R1.19 CC(C)(C)c1ccc(cn1)Br MB10118 [0,1,0,0,0,0|2,0,0]=3 227 B11R1.19 CC(C)(C)c1ccc(cn1)Cl AB71814 [0,1,0,0,0,0|2,0,0]=3 228 B11R1.19 CC(C)(C)c1ccc(cn1)O MB11628 [0,1,0,0,0,0|2,0,0]=3 229 B11R1.19 CC(C)(C)c1ccc(nc1)Br MB10299 [0,1,0,0,0,0|2,0,0]=3 230 B11R1.19 CC(C)(C)c1ccc(nn1)Cl MB05223 [0,1,0,0,0,0|3,0,0]=4 231 B11R1.19 CC(C)(C)c1cnc(cn1)Br AB54264 [0,1,0,0,0,0|3,0,0]=4 232 B11R1.19 CC(C)(C)c1cnc(cn1)Cl AB70175 [0,1,0,0,0,0|3,0,0]=4 233 B11R1.19 CC(C)(C)c1cnc(cn1)N AB60525 [0,1,0,0,0,0|3,0,0]=4 234 B11R1.19 CC(C)(C)c1ncc(cn1)Br AB05297 [0,1,0,0,0,0|3,0,0]=4 235 B11R1.19 CC(C)(C)c1ncc(cn1)Cl AB59175 [0,1,0,0,0,0|3,0,0]=4 236 B11R1.19 CC(C)(C)c1ncc(cn1)N AB51466 [0,1,0,0,0,0|3,0,0]=4 237 B11R1.19 CC(C)(C)c1ncc(cn1)O AB58590 [0,1,0,0,0,0|3,0,0]=4 238 B11R1.19 CC(C)(c1ccc(cc1)Br)N AB29702 [0,1,0,0,0,0|1,0,0]=2 239 B11R1.19 CC(C)(c1ccc(cc1)Cl)N AB45929 [0,1,0,0,0,0|1,0,0]=2 240 B11R1.19 CC(C)(c1ccc(cc1)F)N AB42400 [0,1,0,0,0,0|1,0,0]=2 241 B11R1.19 CC(C)(c1ccc(nc1)Cl)N AB67365 [0,1,0,0,0,0|2,0,0]=3 242 B11R1.19 CS(=O)(=O)c1ccc(cc1)Br AB01453 [0,1,0,0,0,0|3,0,0]=4 243 B11R1.19 CS(=O)(=O)c1ccc(cc1)I AB07768 [0,1,0,0,0,0|3,0,0]=4 244 B11R1.19 CS(=O)(=O)c1ccc(cc1)N AB01467 [0,1,0,0,0,0|3,0,0]=4 245 B11R1.19 CS(=O)(=O)c1ccc(cc1)O AB02067 [0,1,0,0,0,0|3,0,0]=4 246 B11R1.19 Cc1ccc(cc1)C(C)(C)N AB45930 [0,1,0,0,0,0|0,0,0]=1 247 B11R1.19 Cc1ccc(cn1)C(C)(C)N AB66958 [0,1,0,0,0,0|1,0,0]=2 248 B11R1.19 Cc1ccc(cn1)C(F)(F)F AB63092 [0,1,0,0,0,0|3,0,0]=4 249 B11R1.19 [B-](c1ccc(cc1)C)(F)(F)F AB08668 [0,1,0,0,0,0|3,0,0]=4 250 B11R1.19 c1cc(ccc1C(F)(F)F)I AB01779 [0,1,0,0,0,0|3,0,0]=4 251 B11R1.21 B(c1ccc(c(c1)C)C)(O)O AB07958 [0,1,0,0,0,0|3,0,0]=4 252 B11R1.21 B(c1ccc(c(c1)Cl)C)(O)O AB17244 [0,1,0,0,0,0|3,0,0]=4 253 B11R1.21 B(c1ccc(c(c1)N)C)(O)O AB08081 [0,1,0,0,0,0|3,0,0]=4 254 B11R1.21 B(c1ccc(c(c1)N)C)(O)O AB09464 [0,1,0,0,0,0|3,0,0]=4 255 B11R1.21 B(c1ccc(c(c1)O)C)(O)O AB08101 [0,1,0,0,0,0|3,0,0]=4 256 B11R1.21 CC(C)c1ccc(c(c1)Cl)O MB22550 [0,1,0,0,0,0|1,0,0]=2 257 B11R1.21 CC(C)c1ccc(c(c1)F)O MB22546 [0,1,0,0,0,0|1,0,0]=2 258 B11R1.21 CC(C)c1ccc(c(c1)I)O MB22548 [0,1,0,0,0,0|1,0,0]=2 259 B11R1.21 CC(C)c1ccc(c(c1)O)Br MB09104 [0,1,0,0,0,0|1,0,0]=2 260 B11R1.21 CC(C)c1ccc(c(c1)O)Cl MB22599 [0,1,0,0,0,0|1,0,0]=2 261 B11R1.21 CC(C)c1ccc(c(c1)O)F MB22510 [0,1,0,0,0,0|1,0,0]=2 262 B11R1.21 CC(C)c1ccc(c(c1)O)I MB14755 [0,1,0,0,0,0|1,0,0]=2 263 B11R1.21 CC(C)c1ccc(c(c1)O)N MB22521 [0,1,0,0,0,0|1,0,0]=2 264 B11R1.21 CC(C)c1ccc(c(n1)Cl)N AB73366 [0,1,0,0,0,0|2,0,0]=3 265 B11R1.21 CC(C)c1ccc(c(n1)F)F AB73369 [0,1,0,0,0,0|2,0,0]=3 266 B11R1.21 CC(C)c1ccc(c(n1)N)N AB73420 [0,1,0,0,0,0|2,0,0]=3 267 B11R1.21 CC(C)c1ncc(c(n1)N)N AB73252 [0,1,0,0,0,0|3,0,0]=4 268 B11R1.21 CN(C)c1ccc(c(c1)Br)O MB24862 [0,1,0,0,0,0|2,0,0]=3 269 B11R1.21 CN(C)c1ccc(c(c1)Cl)O MB24865 [0,1,0,0,0,0|2,0,0]=3 270 B11R1.21 CN(C)c1ccc(c(c1)F)O MB24855 [0,1,0,0,0,0|2,0,0]=3 271 B11R1.21 CN(C)c1ccc(c(c1)I)O MB24856 [0,1,0,0,0,0|2,0,0]=3 272 B11R1.21 CN(C)c1ccc(c(c1)N)O MB24858 [0,1,0,0,0,0|2,0,0]=3 273 B11R1.21 CN(C)c1ccc(c(c1)O)Br MB24903 [0,1,0,0,0,0|2,0,0]=3 274 B11R1.21 CN(C)c1ccc(c(c1)O)Cl MB24907 [0,1,0,0,0,0|2,0,0]=3 275 B11R1.21 CN(C)c1ccc(c(c1)O)F MB24813 [0,1,0,0,0,0|2,0,0]=3 276 B11R1.21 CN(C)c1ccc(c(c1)O)I MB24818 [0,1,0,0,0,0|2,0,0]=3 277 B11R1.21 CN(C)c1ccc(c(c1)O)N MB24826 [0,1,0,0,0,0|2,0,0]=3 278 B11R1.21 Cc1c(cc(cn1)C(=O)C)Cl AB74646 [0,1,0,0,0,0|2,0,1]=4 279 B11R1.21 Cc1c(cc(cn1)C(=O)C)F AB83026 [0,1,0,0,0,0|2,0,1]=4 280 B11R1.21 Cc1cc(ccc1O)C(C)C MB22526 [0,1,0,0,0,0|1,0,0]=2 281 B11R1.21 Cc1cc(ccc1O)N(C)C MB23339 [0,1,0,0,0,0|2,0,0]=3 282 B11R1.21 Cc1cc(cnc1C)C(=O)C AB75410 [0,1,0,0,0,0|2,0,1]=4 283 B11R1.21 Cc1cc(ncc1Br)N(C)C AB44355 [0,1,0,0,0,0|3,0,0]=4 284 B11R1.21 Cc1cc(ncc1C)C(=O)C AB74626 [0,1,0,0,0,0|2,0,1]=4 285 B11R1.21 Cc1ccc(cc1C)C(=N)N AB21798 [0,1,0,0,0,0|2,0,1]=4 286 B11R1.21 Cc1ccc(cc1C)C(=S)N AB26899 [0,1,0,0,0,0|2,0,1]=4 287 B11R1.21 Cc1ccc(cc1O)C(=O)N AB63532 [0,1,0,0,0,0|2,0,1]=4 288 B11R1.21 Cc1ccc(cc1O)C(C)C MB00118 [0,1,0,0,0,0|0,0,0]=1 289 B11R1.21 Cc1ccc(cc1O)N(C)C MB23415 [0,1,0,0,0,0|1,0,0]=2 290 B11R1.21 Cc1ccc(cc1O)[N+](=O)[O-] AB01960 [0,1,0,0,0,0|3,0,0]=4 291 B11R1.21 Cc1ccc(nc1C)C(=O)C AB74623 [0,1,0,0,0,0|2,0,1]=4 292 B11R1.21 Cc1ccc(nc1Cl)C(=O)C AB75095 [0,1,0,0,0,0|2,0,1]=4 293 B11R1.21 Cc1ccc(nc1F)C(=O)C AB75167 [0,1,0,0,0,0|2,0,1]=4 294 B11R1.21 Cc1cnc(cc1Cl)C(=O)C AB83277 [0,1,0,0,0,0|2,0,1]=4 295 B11R1.21 Cc1cnc(cc1F)C(=O)C AB82953 [0,1,0,0,0,0|2,0,1]=4 296 B11R1.22 CNC(=O)c1ccc(cc1)O MB02709 [0,1,0,0,0,0|2,0,1]=4 297 B11R1.22 COC(=N)c1ccc(cc1)F AB60956 [0,1,0,0,0,0|2,0,1]=4 298 B11R1.22 COC(=N)c1ccc(cc1)N AB60980 [0,1,0,0,0,0|2,0,1]=4 299 B11R1.22 COC(=N)c1ccc(cc1)O AB01949 [0,1,0,0,0,0|2,0,1]=4 300 B11R1.22 COS(=O)c1ccc(cc1)Cl AB45287 [0,1,0,0,0,0|3,0,0]=4 301 B11R1.22 C[C@@H](CN)c1ccc(cc1)Br AB85104 [0,1,0,0,0,0|1,0,0]=2 302 B11R1.22 C[C@H](CN)c1ccc(cc1)Br AB85095 [0,1,0,0,0,0|1,0,0]=2 303 B11R1.22 C[C@H](CN)c1ccc(cc1)F AB85098 [0,1,0,0,0,0|1,0,0]=2 304 B11R1.22 Cc1ccc(cc1)C(=O)C=O AB05249 [0,1,0,0,0,0|1,0,2]=4 305 B11R1.22 Cc1ccc(cc1)C(=O)C=O AB05288 [0,1,0,0,0,0|1,0,2]=4 306 B11R1.22 c1cc(ccc1C(=O)CN)Br CB10172 [0,1,0,0,0,0|2,0,1]=4 307 B11R1.22 c1cc(ccc1C(=O)CO)F MB02453 [0,1,0,0,0,0|2,0,1]=4 308 B11R1.166 B(c1ccc(cc1C)C)(O)O AB12317 [0,1,0,0,0,0|3,0,0]=4 309 B11R1.166 B(c1ccc(cc1Cl)C)(O)O AB14287 [0,1,0,0,0,0|3,0,0]=4 310 B11R1.166 B(c1ccc(cc1F)C)(O)O PB26163 [0,1,0,0,0,0|3,0,0]=4 311 B11R1.166 B(c1ccc(cc1O)C)(O)O PB11677 [0,1,0,0,0,0|3,0,0]=4 312 B11R1.166 CC(=O)c1ccc(cc1F)Br MB02747 [0,1,0,0,0,0|2,0,1]=4 313 B11R1.166 CC(=O)c1ccc(cc1F)N MB05492 [0,1,0,0,0,0|2,0,1]=4 314 B11R1.166 CC(=O)c1ccc(cc1O)Br AB15427 [0,1,0,0,0,0|2,0,1]=4 315 B11R1.166 CC(C)c1ccc(cc1Br)O MB22589 [0,1,0,0,0,0|1,0,0]=2 316 B11R1.166 CC(C)c1ccc(cc1Cl)O MB22592 [0,1,0,0,0,0|1,0,0]=2 317 B11R1.166 CC(C)c1ccc(cc1F)O MB22574 [0,1,0,0,0,0|1,0,0]=2 318 B11R1.166 CC(C)c1ccc(cc1I)O MB22578 [0,1,0,0,0,0|1,0,0]=2 319 B11R1.166 CC(C)c1ccc(cc1O)Br MB22598 [0,1,0,0,0,0|1,0,0]=2 320 B11R1.166 CC(C)c1ccc(cc1O)Cl MB22600 [0,1,0,0,0,0|1,0,0]=2 321 B11R1.166 CC(C)c1ccc(cc1O)F MB22513 [0,1,0,0,0,0|1,0,0]=2 322 B11R1.166 CC(C)c1ccc(cc1O)I MB22516 [0,1,0,0,0,0|1,0,0]=2 323 B11R1.166 CC(C)c1ccc(cc1O)N MB22522 [0,1,0,0,0,0|1,0,0]=2 324 B11R1.166 CN(C)c1ccc(cc1Br)O MB24896 [0,1,0,0,0,0|2,0,0]=3 325 B11R1.166 CN(C)c1ccc(cc1Cl)O MB24897 [0,1,0,0,0,0|2,0,0]=3 326 B11R1.166 CN(C)c1ccc(cc1F)O MB24879 [0,1,0,0,0,0|2,0,0]=3 327 B11R1.166 CN(C)c1ccc(cc1I)O MB24881 [0,1,0,0,0,0|2,0,0]=3 328 B11R1.166 CN(C)c1ccc(cc1N)O MB24885 [0,1,0,0,0,0|2,0,0]=3 329 B11R1.166 CN(C)c1ccc(cc1O)Br MB24904 [0,1,0,0,0,0|2,0,0]=3 330 B11R1.166 CN(C)c1ccc(cc1O)Cl MB24909 [0,1,0,0,0,0|2,0,0]=3 331 B11R1.166 CN(C)c1ccc(cc1O)F MB24817 [0,1,0,0,0,0|2,0,0]=3 332 B11R1.166 CN(C)c1ccc(cc1O)I MB24820 [0,1,0,0,0,0|2,0,0]=3 333 B11R1.166 CN(C)c1ccc(cc1O)N MB24828 [0,1,0,0,0,0|2,0,0]=3 334 B11R1.166 Cc1cc(c(cn1)C(=O)C)Cl AB64940 [0,1,0,0,0,0|2,0,1]=4 335 B11R1.166 Cc1cc(c(cn1)C(=O)C)F AB83044 [0,1,0,0,0,0|2,0,1]=4 336 B11R1.166 Cc1cc(c(cn1)C(=O)C)N AB50225 [0,1,0,0,0,0|2,0,1]=4 337 B11R1.166 Cc1cc(c(cn1)C(=O)C)O AB75251 [0,1,0,0,0,0|2,0,1]=4 338 B11R1.166 Cc1cc(c(nc1)C(=O)C)C AB50219 [0,1,0,0,0,0|2,0,1]=4 339 B11R1.166 Cc1cc(c(nc1)C(=O)C)Cl AB75090 [0,1,0,0,0,0|2,0,1]=4 340 B11R1.166 Cc1cc(c(nc1)C(=O)C)F AB75164 [0,1,0,0,0,0|2,0,1]=4 341 B11R1.166 Cc1cc(c(nc1)C(=O)C)N AB77150 [0,1,0,0,0,0|2,0,1]=4 342 B11R1.166 Cc1cc(c(nc1)C(=O)C)O AB75244 [0,1,0,0,0,0|2,0,1]=4 343 B11R1.166 Cc1cc(ccc1N(C)C)Br AB31930 [0,1,0,0,0,0|2,0,0]=3 344 B11R1.166 Cc1cc(ccc1N(C)C)O MB08301 [0,1,0,0,0,0|2,0,0]=3 345 B11R1.166 Cc1cc(ncc1C(=O)C)C AB50221 [0,1,0,0,0,0|2,0,1]=4 346 B11R1.166 Cc1ccc(c(c1)C)C(=N)N AB18393 [0,1,0,0,0,0|2,0,1]=4 347 B11R1.166 Cc1ccc(c(c1)Cl)C(=N)N AB18279 [0,1,0,0,0,0|2,0,1]=4 348 B11R1.166 Cc1ccc(c(c1)O)C(=O)N MB02488 [0,1,0,0,0,0|2,0,1]=4 349 B11R1.166 Cc1ccc(c(c1)O)C(C)C MB00129 [0,1,0,0,0,0|0,0,0]=1 350 B11R1.166 Cc1ccc(c(c1)O)N(C)C MB23428 [0,1,0,0,0,0|1,0,0]=2 351 B11R1.166 Cc1ccc(c(n1)Cl)C(=O)C AB64666 [0,1,0,0,0,0|2,0,1]=4 352 B11R1.166 Cc1ccc(c(n1)N)C(=O)C AB83843 [0,1,0,0,0,0|2,0,1]=4 353 B11R1.166 Cc1ccc(c(n1)O)C(=O)C AB84278 [0,1,0,0,0,0|2,0,1]=4 354 B11R2.34 c1c(cnc(n1)C2CC2)Br PB33220 [0,0,0,1,0,0|3,0,0]=4 355 B11R2.34 c1c(cnc(n1)C2CC2)N PB31538 [0,0,0,1,0,0|3,0,0]=4 356 B11R2.34 c1c(ncc(n1)Br)C2CC2 MB09639 [0,0,0,1,0,0|3,0,0]=4 357 B11R2.34 c1cc(ncc1Br)C2CC2 AB65328 [0,0,0,1,0,0|2,0,0]=3 358 B11R2.34 c1cc(ncc1C2CC2)Br MB10291 [0,0,0,1,0,0|2,0,0]=3 359 B11R2.34 c1cc(nnc1C2CC2)Cl MB13911 [0,0,0,1,0,0|3,0,0]=4 360 B9R1.35 CC(C)c1cc(on1)N AB23736 [0,0,0,0,1,0|3,0,0]=4 361 B9R1.35 CC(C)c1cnc(o1)Cl AB68315 [0,0,0,0,1,0|3,0,0]=4 362 B9R1.35 CC(C)c1cnc(o1)N AB64703 [0,0,0,0,1,0|3,0,0]=4 363 B9R1.35 CC(C)c1coc(n1)Br AB68314 [0,0,0,0,1,0|3,0,0]=4 364 B9R1.35 CC(C)c1coc(n1)Cl AB68311 [0,0,0,0,1,0|3,0,0]=4 365 B9R1.35 CC(C)c1coc(n1)N AB68299 [0,0,0,0,1,0|3,0,0]=4 366 B9R1.35 CC(C)c1nc(cs1)Br MB04003 [0,0,0,0,1,0|3,0,0]=4 367 B9R1.35 CC(C)c1ncc(s1)Br MB09628 [0,0,0,0,1,0|3,0,0]=4 368 B9R1.35 CC(C)n1cc(cn1)Br AB52604 [0,0,0,0,1,0|3,0,0]=4 369 B9R1.35 CC(c1cc(sc1)Cl)N PB38111 [0,0,0,0,1,0|3,0,0]=4 370 B9R1.35 CC(c1cc(sc1)Cl)O PB23084 [0,0,0,0,1,0|3,0,0]=4 371 B9R1.35 CC(c1cn(cn1)C)O PB34949 [0,0,0,0,1,0|3,0,0]=4 372 B9R1.35 CC(c1cnn(c1)C)N PB20139 [0,0,0,0,1,0|3,0,0]=4 373 B9R1.35 Cc1[nH]c(cn1)C(C)N AB58094 [0,0,0,0,1,0|3,0,0]=4 374 B9R1.35 Cc1[nH]c(nn1)C(C)C MB19547 [0,0,0,0,1,0|3,0,0]=4 375 B9R1.35 Cc1[nH]cc(n1)C(C)C AB24901 [0,0,0,0,1,0|2,0,0]=3 376 B9R1.35 Cc1ccc(s1)C(=O)C AB01148 [0,0,0,0,1,0|2,0,1]=4 377 B9R1.35 Cc1csc(n1)[C@H](C)N AB68276 [0,0,0,0,1,0|3,0,0]=4 378 B9R1.35 Cc1nc(cs1)C(C)N AB28273 [0,0,0,0,1,0|3,0,0]=4 379 B11R1.20 CC(=O)Oc1ccc(cc1)Cl AB06566 [0,0,0,0,0,1|2,0,1]=4 380 B11R1.20 CC(C)Cc1cnc(cn1)Br AB72274 [0,0,0,0,0,1|3,0,0]=4 381 B11R1.20 CC(C)Cc1cnc(cn1)Cl AB73109 [0,0,0,0,0,1|3,0,0]=4 382 B11R1.20 CC(C)Cc1cnc(cn1)N AB60522 [0,0,0,0,0,1|3,0,0]=4 383 B11R1.20 CC(C)Cc1cnc(nc1)N AB60175 [0,0,0,0,0,1|3,0,0]=4 384 B11R1.20 CC(C)Cc1ncc(cn1)N AB58993 [0,0,0,0,0,1|3,0,0]=4 385 B11R1.20 CC(C)Oc1ccc(cc1)O MB06553 [0,0,0,0,0,1|1,0,0]=2 386 B11R1.20 CC(C)Oc1ccc(cn1)Br MB04495 [0,0,0,0,0,1|2,0,0]=3 387 B11R1.20 CC(C)Oc1ccc(cn1)N AB40632 [0,0,0,0,0,1|2,0,0]=3 388 B11R1.20 CC(C)Oc1ccc(cn1)O MB23136 [0,0,0,0,0,1|2,0,0]=3 389 B11R1.20 CC(C)Oc1ccc(nc1)Br MB13762 [0,0,0,0,0,1|2,0,0]=3 390 B11R1.20 CC(C)Oc1ccc(nn1)Br MB08578 [0,0,0,0,0,1|3,0,0]=4 391 B11R1.20 CC(C)Oc1ccc(nn1)Cl MB01121 [0,0,0,0,0,1|3,0,0]=4 392 B11R1.20 CC(C)Oc1cnc(cn1)Br AB54269 [0,0,0,0,0,1|3,0,0]=4 393 B11R1.20 CC(C)Oc1ncc(cn1)Br MB11470 [0,0,0,0,0,1|3,0,0]=4 394 B11R1.20 CC(Cc1ccc(cc1)Br)N MB00407 [0,0,0,0,0,1|2,0,0]=3 395 B11R1.20 CC(Cc1ccc(cc1)Cl)N MB01958 [0,0,0,0,0,1|2,0,0]=3 396 B11R1.20 CN(C)Cc1ccc(cc1)Br AB01531 [0,0,0,0,0,1|2,0,0]=3 397 B11R1.20 CN(C)Cc1ccc(cc1)N AB01571 [0,0,0,0,0,1|2,0,0]=3 398 B11R1.20 C[C@@H](Cc1ccc(cc1)Br)N AB76442 [0,0,0,0,0,1|2,0,0]=3 399 B11R1.20 C[C@@H](Cc1ccc(cc1)F)N AB76433 [0,0,0,0,0,1|2,0,0]=3 400 B11R1.20 C[C@H](Cc1ccc(cc1)Br)N AB76429 [0,0,0,0,0,1|2,0,0]=3 401 B11R1.20 C[C@H](Cc1ccc(cc1)F)N AB76425 [0,0,0,0,0,1|2,0,0]=3 402 B11R1.20 Cc1ccc(cc1)CC(=N)N AB29086 [0,0,0,0,0,1|2,0,1]=4 403 B11R1.20 Cc1ccc(cc1)CC(C)N MB01961 [0,0,0,0,0,1|1,0,0]=2 404 B8R1.2 CNc1cccnc1 AB09114 [2,0,0,0,0,0|2,0,0]=4 405 B8R1.2 COc1cccnc1 AB06864 [2,0,0,0,0,0|2,0,0]=4 406 B8R1.2 c1cc(cnc1)CCl AB01984 [2,0,0,0,0,0|2,0,0]=4 407 B8R1.2 c1cc(cnc1)CN AB00752 [2,0,0,0,0,0|2,0,0]=4 408 B8R1.2 c1ccnc(c1)CBr MB02148 [2,0,0,0,0,0|2,0,0]=4 409 B8R1.2 c1ccnc(c1)CCl AB22495 [2,0,0,0,0,0|2,0,0]=4 410 B8R1.2 c1ccnc(c1)CN AB00731 [2,0,0,0,0,0|2,0,0]=4 411 B8R1.2 c1cnccc1CCl AB15539 [2,0,0,0,0,0|2,0,0]=4 412 B8R1.2 c1cnccc1CN AB00767 [2,0,0,0,0,0|2,0,0]=4 413 B8R1.3 Cc1ccc(cn1)Br AB06624 [2,0,0,0,0,0|2,0,0]=4 414 B8R1.3 Cc1ccc(cn1)Cl AB17956 [2,0,0,0,0,0|2,0,0]=4 415 B8R1.3 Cc1ccc(cn1)F PB18589 [2,0,0,0,0,0|2,0,0]=4 416 B8R1.3 Cc1ccc(cn1)N PB32227 [2,0,0,0,0,0|2,0,0]=4 417 B8R1.3 Cc1ccc(cn1)O PB30543 [2,0,0,0,0,0|2,0,0]=4 418 B8R1.3 Cc1ccc(nc1)Br PB17145 [2,0,0,0,0,0|2,0,0]=4 419 B8R1.3 Cc1ccc(nc1)Cl AB07104 [2,0,0,0,0,0|2,0,0]=4 420 B8R1.3 Cc1ccc(nc1)F AB01857 [2,0,0,0,0,0|2,0,0]=4 421 B8R1.3 Cc1ccc(nc1)N AB17938 [2,0,0,0,0,0|2,0,0]=4 422 B8R1.3 Cc1ccc(nc1)O AB13138 [2,0,0,0,0,0|2,0,0]=4 423 B10R1.1 C#CCc1ccc(cc1)Br AB61388 [1,1,0,0,0,0|1,0,1]=4 424 B10R1.1 C#CCc1ccc(cc1)Cl AB61380 [1,1,0,0,0,0|1,0,1]=4 425 B10R1.1 C#CCc1ccc(cc1)F AB61384 [1,1,0,0,0,0|1,0,1]=4 426 B10R1.1 C#CCc1ccc(cc1)I AB73225 [1,1,0,0,0,0|1,0,1]=4 427 B10R1.1 CCNc1ccc(cn1)Br AB51199 [1,1,0,0,0,0|2,0,0]=4 428 B10R1.1 CCOc1ccc(cn1)Br AB05210 [1,1,0,0,0,0|2,0,0]=4 429 B10R1.1 CCOc1ccc(cn1)N AB09602 [1,1,0,0,0,0|2,0,0]=4 430 B10R1.1 CNCc1ccc(cn1)Br AB49704 [1,1,0,0,0,0|2,0,0]=4 431 B10R1.1 CNCc1ccc(cn1)Cl AB67610 [1,1,0,0,0,0|2,0,0]=4 432 B10R1.1 CNCc1ccc(cn1)F AB67668 [1,1,0,0,0,0|2,0,0]=4 433 B10R1.1 CNCc1ccc(cn1)N AB67748 [1,1,0,0,0,0|2,0,0]=4 434 B10R1.1 CNCc1ccc(nc1)Br AB67269 [1,1,0,0,0,0|2,0,0]=4 435 B10R1.1 CNCc1ccc(nc1)Cl AB52618 [1,1,0,0,0,0|2,0,0]=4 436 B10R1.1 Cc1ccc(cc1)CC=O AB02059 [1,1,0,0,0,0|0,0,1]=3 437 B10R1.1 Cc1ccc(cc1)\C=C\Br AB73509 [1,1,0,0,0,0|0,0,2]=4 438 B10R1.1 Cc1ccc(cn1)CCN AB55173 [1,1,0,0,0,0|1,0,0]=3 439 B10R1.1 Cc1ccc(cn1)CNC AB63786 [1,1,0,0,0,0|1,0,0]=3 440 B10R1.1 Cc1ccc(nc1)CCN AB31467 [1,1,0,0,0,0|1,0,0]=3 441 B10R1.1 Cc1ccc(nc1)CNC AB67504 [1,1,0,0,0,0|1,0,0]=3 442 B10R1.1 Cc1cnc(cn1)CCN AB69468 [1,1,0,0,0,0|2,0,0]=4 443 B10R1.1 Cc1cnc(nc1)CCN AB59260 [1,1,0,0,0,0|2,0,0]=4 444 B10R1.1 Cc1ncc(cn1)CCN AB59372 [1,1,0,0,0,0|2,0,0]=4 445 B10R1.1 c1cc(ccc1CC#N)F AB00175 [1,1,0,0,0,0|1,0,1]=4 446 B10R1.1 c1cc(ccc1CC=O)Br AB11790 [1,1,0,0,0,0|1,0,1]=4 447 B10R1.1 c1cc(ccc1CC=O)Cl AB11793 [1,1,0,0,0,0|1,0,1]=4 448 B10R1.1 c1cc(ccc1CC=O)F AB11805 [1,1,0,0,0,0|1,0,1]=4 449 B10R1.1 c1cc(ccc1CC=O)N AB27688 [1,1,0,0,0,0|1,0,1]=4 450 B10R1.1 c1cc(ccc1CCBr)N MB02970 [1,1,0,0,0,0|1,0,0]=3 451 B10R1.1 c1cc(ccc1CCN)Br AB00934 [1,1,0,0,0,0|1,0,0]=3 452 B10R1.1 c1cc(ccc1CCN)Cl AB28066 [1,1,0,0,0,0|1,0,0]=3 453 B10R1.1 c1cc(ccc1CCN)F AB03730 [1,1,0,0,0,0|1,0,0]=3 454 B10R1.1 c1cc(ccc1CCN)N AB00936 [1,1,0,0,0,0|1,0,0]=3 455 B10R1.1 c1cc(ccc1CCO)Br AB00280 [1,1,0,0,0,0|1,0,0]=3 456 B10R1.1 c1cc(ccc1CNN)Br PB32548 [1,1,0,0,0,0|2,0,0]=4 457 B10R1.1 c1cc(ccc1CNN)Cl PB29444 [1,1,0,0,0,0|2,0,0]=4 458 B10R1.1 c1cc(ccc1CNN)F PB20964 [1,1,0,0,0,0|2,0,0]=4 459 B10R1.1 c1cc(ncc1Br)CCN PB20258 [1,1,0,0,0,0|2,0,0]=4 460 B10R1.1 c1cc(ncc1Br)CCO PB14792 [1,1,0,0,0,0|2,0,0]=4 461 B10R1.1 c1cc(ncc1CCBr)Br AB72326 [1,1,0,0,0,0|2,0,0]=4 462 B10R1.1 c1cc(ncc1CCBr)Cl AB72323 [1,1,0,0,0,0|2,0,0]=4 463 B10R1.1 c1cc(ncc1CCN)Br AB45460 [1,1,0,0,0,0|2,0,0]=4 464 B10R1.1 c1cc(ncc1CCN)Cl AB45438 [1,1,0,0,0,0|2,0,0]=4 465 B10R1.1 c1cc(ncc1CCN)N AB76809 [1,1,0,0,0,0|2,0,0]=4 466 B10R1.1 c1cc(ncc1Cl)CCN AB65492 [1,1,0,0,0,0|2,0,0]=4 467 B10R1.1 c1cc(ncc1F)CCN AB45484 [1,1,0,0,0,0|2,0,0]=4 468 B10R1.1 c1cc(ncc1N)CCN AB67762 [1,1,0,0,0,0|2,0,0]=4 469 B10R1.1 c1cc(ncc1O)CCN AB67805 [1,1,0,0,0,0|2,0,0]=4 470 B10R1.3 CCc1ccc(cc1)NN AB10141 [1,1,0,0,0,0|1,0,0]=3 471 B10R1.3 CCc1ccc(nc1)CCl AB60001 [1,1,0,0,0,0|1,0,0]=3 472 B10R1.3 CCc1cnc(nc1)CN AB58975 [1,1,0,0,0,0|2,0,0]=4 473 B10R1.3 CNc1ccc(nc1)OC AB60608 [1,1,0,0,0,0|2,0,0]=4 474 B10R1.3 COc1ccc(cc1)C#N AB00162 [1,1,0,0,0,0|1,0,1]=4 475 B10R1.3 COc1ccc(cc1)NN AB11940 [1,1,0,0,0,0|2,0,0]=4 476 B10R1.3 COc1ccc(cn1)CCl AB59942 [1,1,0,0,0,0|2,0,0]=4 477 B10R1.3 COc1ccc(cn1)CCl AB59945 [1,1,0,0,0,0|2,0,0]=4 478 B10R1.3 COc1ccc(cn1)CN PB34107 [1,1,0,0,0,0|2,0,0]=4 479 B10R1.3 COc1ccc(cn1)CO PB17339 [1,1,0,0,0,0|2,0,0]=4 480 B10R1.3 COc1ccc(nc1)CCl AB59864 [1,1,0,0,0,0|2,0,0]=4 481 B10R1.3 COc1ccc(nc1)CCl PB31547 [1,1,0,0,0,0|2,0,0]=4 482 B10R1.3 COc1ccc(nc1)CN AB59858 [1,1,0,0,0,0|2,0,0]=4 483 B10R1.3 COc1ccc(nc1)CO PB32580 [1,1,0,0,0,0|2,0,0]=4 484 B10R1.3 CSc1ccc(cc1)CCl AB05549 [1,1,0,0,0,0|1,0,0]=3 485 B10R1.3 CSc1ccc(cc1)CO AB00982 [1,1,0,0,0,0|1,0,0]=3 486 B10R1.3 c1cc(ccc1CN)CO AB23442 [1,1,0,0,0,0|1,0,0]=3 487 B10R1.3 c1cc(ncc1CO)CN AB63417 [1,1,0,0,0,0|2,0,0]=4 488 B10R1.3 c1cc(ncc1CO)CO AB14995 [1,1,0,0,0,0|2,0,0]=4 489 B10R1.25 CCc1c(cc(cn1)Br)N PB11662 [1,1,0,0,0,0|2,0,0]=4 490 B10R1.25 CCc1ccc(cc1Br)O MB23966 [1,1,0,0,0,0|1,0,0]=3 491 B10R1.25 CCc1ccc(cc1C)O MB23913 [1,1,0,0,0,0|1,0,0]=3 492 B10R1.25 CCc1ccc(cc1Cl)O MB23969 [1,1,0,0,0,0|1,0,0]=3 493 B10R1.25 CCc1ccc(cc1F)O MB14963 [1,1,0,0,0,0|1,0,0]=3 494 B10R1.25 CCc1ccc(cc1I)O MB23946 [1,1,0,0,0,0|1,0,0]=3 495 B10R1.25 CCc1ccc(cc1N)O MB23949 [1,1,0,0,0,0|1,0,0]=3 496 B10R1.25 CCc1ccc(cc1O)Br MB23992 [1,1,0,0,0,0|1,0,0]=3 497 B10R1.25 CCc1ccc(cc1O)Cl MB23993 [1,1,0,0,0,0|1,0,0]=3 498 B10R1.25 CCc1ccc(cc1O)F MB23841 [1,1,0,0,0,0|1,0,0]=3 499 B10R1.25 CCc1ccc(cc1O)I MB23846 [1,1,0,0,0,0|1,0,0]=3 500 B10R1.25 CCc1ccc(cc1O)N MB23852 [1,1,0,0,0,0|1,0,0]=3 501 B10R1.25 CCc1ccc(nc1N)C AB03677 [1,1,0,0,0,0|1,0,0]=3 502 B10R1.25 CCn1ccc(cc1=O)Br PB38061 [1,1,0,0,0,0|2,0,0]=4 503 B10R1.25 CCn1ccc(cc1=O)N PB23013 [1,1,0,0,0,0|2,0,0]=4 504 B10R1.25 CNc1ccc(cc1F)O MB31256 [1,1,0,0,0,0|2,0,0]=4 505 B10R1.25 CNc1ccc(cc1I)O MB37121 [1,1,0,0,0,0|2,0,0]=4 506 B10R1.25 CNc1ccc(cc1N)O MB30558 [1,1,0,0,0,0|2,0,0]=4 507 B10R1.25 CNc1ccc(cc1O)Cl MB25839 [1,1,0,0,0,0|2,0,0]=4 508 B10R1.25 CNc1ccc(cc1O)N MB33015 [1,1,0,0,0,0|2,0,0]=4 509 B10R1.25 COc1ccc(cc1Cl)Br AB03565 [1,1,0,0,0,0|2,0,0]=4 510 B10R1.25 COc1ccc(cc1Cl)O MB13556 [1,1,0,0,0,0|2,0,0]=4 511 B10R1.25 COc1ccc(cc1F)Br AB01075 [1,1,0,0,0,0|2,0,0]=4 512 B10R1.25 COc1ccc(cc1I)O MB26647 [1,1,0,0,0,0|2,0,0]=4 513 B10R1.25 COc1ccc(cc1N)O MB34521 [1,1,0,0,0,0|2,0,0]=4 514 B10R1.25 COc1ccc(cc1O)Cl MB09234 [1,1,0,0,0,0|2,0,0]=4 515 B10R1.25 COc1ccc(cc1O)I MB38179 [1,1,0,0,0,0|2,0,0]=4 516 B10R1.25 CSc1ccc(cc1Br)O MB25524 [1,1,0,0,0,0|2,0,0]=4 517 B10R1.25 CSc1ccc(cc1Cl)O MB38487 [1,1,0,0,0,0|2,0,0]=4 518 B10R1.25 CSc1ccc(cc1F)O MB25544 [1,1,0,0,0,0|2,0,0]=4 519 B10R1.25 CSc1ccc(cc1N)O MB34593 [1,1,0,0,0,0|2,0,0]=4 520 B10R1.25 CSc1ccc(cc1O)Br MB35434 [1,1,0,0,0,0|2,0,0]=4 521 B10R1.25 CSc1ccc(cc1O)F MB25440 [1,1,0,0,0,0|2,0,0]=4 522 B10R1.25 CSc1ccc(cc1O)I MB29501 [1,1,0,0,0,0|2,0,0]=4 523 B10R1.25 CSc1ccc(cc1O)N MB36502 [1,1,0,0,0,0|2,0,0]=4 524 B10R1.25 Cc1cc(c(cn1)CCl)Cl AB83327 [1,1,0,0,0,0|2,0,0]=4 525 B10R1.25 Cc1cc(c(cn1)CCl)F AB83045 [1,1,0,0,0,0|2,0,0]=4 526 B10R1.25 Cc1cc(c(cn1)CN)Br AB68171 [1,1,0,0,0,0|2,0,0]=4 527 B10R1.25 Cc1cc(c(cn1)CN)Cl AB68154 [1,1,0,0,0,0|2,0,0]=4 528 B10R1.25 Cc1cc(c(cn1)CN)F AB83048 [1,1,0,0,0,0|2,0,0]=4 529 B10R1.25 Cc1cc(c(nc1)CCl)C AB44395 [1,1,0,0,0,0|2,0,0]=4 530 B10R1.25 Cc1cc(c(nc1)CCl)Cl AB75094 [1,1,0,0,0,0|2,0,0]=4 531 B10R1.25 Cc1cc(c(nc1)CCl)F AB76356 [1,1,0,0,0,0|2,0,0]=4 532 B10R1.25 Cc1cc(c(nc1)CN)C AB53521 [1,1,0,0,0,0|2,0,0]=4 533 B10R1.25 Cc1cc(c(nc1)CN)Cl AB75093 [1,1,0,0,0,0|2,0,0]=4 534 B10R1.25 Cc1cc(c(nc1)CN)F AB75165 [1,1,0,0,0,0|2,0,0]=4 535 B10R1.25 Cc1cc(c(nc1)CO)C AB53524 [1,1,0,0,0,0|2,0,0]=4 536 B10R1.25 Cc1cc(c(nc1)OC)N AB66728 [1,1,0,0,0,0|2,0,0]=4 537 B10R1.25 Cc1cc(ccc1NC)O MB05083 [1,1,0,0,0,0|2,0,0]=4 538 B10R1.25 Cc1cc(ccc1OC)O MB07842 [1,1,0,0,0,0|2,0,0]=4 539 B10R1.25 Cc1cc(ncc1CCl)C AB75393 [1,1,0,0,0,0|2,0,0]=4 540 B10R1.25 Cc1cc(ncc1CN)C AB62611 [1,1,0,0,0,0|2,0,0]=4 541 B10R1.25 Cc1ccc(c(c1)F)NN AB27888 [1,1,0,0,0,0|2,0,0]=4 542 B10R1.25 Cc1ccc(c(c1)N)C#N AB04357 [1,1,0,0,0,0|1,0,1]=4 543 B10R1.25 Cc1ccc(c(c1)N)C=O AB58436 [1,1,0,0,0,0|1,0,1]=4 544 B10R1.25 Cc1ccc(c(c1)O)C#N AB11820 [1,1,0,0,0,0|1,0,1]=4 545 B10R1.25 Cc1ccc(c(c1)O)CN MB15038 [1,1,0,0,0,0|1,0,0]=3 546 B10R1.25 Cc1ccc(c(c1)O)NC MB33283 [1,1,0,0,0,0|1,0,0]=3 547 B10R1.25 Cc1ccc(c(c1)O)SC MB02032 [1,1,0,0,0,0|1,0,0]=3 548 B10R1.25 Cc1ccc(c(n1)Br)CN AB68158 [1,1,0,0,0,0|2,0,0]=4 549 B10R1.25 Cc1ccc(c(n1)Br)OC AB25427 [1,1,0,0,0,0|2,0,0]=4 550 B10R1.25 Cc1ccc(c(n1)Cl)CN AB23323 [1,1,0,0,0,0|2,0,0]=4 551 B10R1.25 Cc1ccc(c(n1)N)CCl AB76121 [1,1,0,0,0,0|2,0,0]=4 552 B10R1.25 c1cc(c(cc1Br)N)CO AB42495 [1,1,0,0,0,0|2,0,0]=4 553 B10R1.25 c1cc(c(cc1Br)O)CN MB08429 [1,1,0,0,0,0|2,0,0]=4 554 B10R1.25 c1cc(c(cc1Cl)Br)CO MB06939 [1,1,0,0,0,0|2,0,0]=4 555 B10R1.25 c1cc(c(cc1Cl)O)CN MB26819 [1,1,0,0,0,0|2,0,0]=4 556 B10R1.25 c1cc(c(cc1F)Br)CO AB06857 [1,1,0,0,0,0|2,0,0]=4 557 B10R1.25 c1cc(c(cc1F)N)CN AB50268 [1,1,0,0,0,0|2,0,0]=4 558 B10R1.25 c1cc(c(cc1F)O)CN MB14866 [1,1,0,0,0,0|2,0,0]=4 559 B10R1.25 c1cc(c(cc1I)O)CN MB10252 [1,1,0,0,0,0|2,0,0]=4 560 B10R1.25 c1cc(c(cc1N)F)CBr AB56061 [1,1,0,0,0,0|2,0,0]=4 561 B10R1.25 c1cc(c(cc1N)F)CN AB50282 [1,1,0,0,0,0|2,0,0]=4 562 B10R1.25 c1cc(c(cc1N)O)CN MB10253 [1,1,0,0,0,0|2,0,0]=4 563 B10R1.25 c1cc(c(cc1O)Cl)CN MB02722 [1,1,0,0,0,0|2,0,0]=4 564 B10R1.25 c1cc(c(cc1O)F)CN MB02723 [1,1,0,0,0,0|2,0,0]=4 565 B10R1.25 c1cc(c(cc1O)N)CN MB29325 [1,1,0,0,0,0|2,0,0]=4 566 B10R1.176 CCc1ccc(c(c1)C)O MB23862 [1,1,0,0,0,0|1,0,0]=3 567 B10R1.176 CCc1ccc(c(c1)Cl)O MB23911 [1,1,0,0,0,0|1,0,0]=3 568 B10R1.176 CCc1ccc(c(c1)F)O MB23895 [1,1,0,0,0,0|1,0,0]=3 569 B10R1.176 CCc1ccc(c(c1)I)O MB23898 [1,1,0,0,0,0|1,0,0]=3 570 B10R1.176 CCc1ccc(c(c1)N)O MB00456 [1,1,0,0,0,0|1,0,0]=3 571 B10R1.176 CCc1ccc(c(c1)O)Br MB09100 [1,1,0,0,0,0|1,0,0]=3 572 B10R1.176 CCc1ccc(c(c1)O)Cl MB01396 [1,1,0,0,0,0|1,0,0]=3 573 B10R1.176 CCc1ccc(c(c1)O)F MB23840 [1,1,0,0,0,0|1,0,0]=3 574 B10R1.176 CCc1ccc(c(c1)O)I MB23844 [1,1,0,0,0,0|1,0,0]=3 575 B10R1.176 CCc1ccc(c(c1)O)N MB03784 [1,1,0,0,0,0|1,0,0]=3 576 B10R1.176 CNc1ccc(c(c1)Br)O MB30977 [1,1,0,0,0,0|2,0,0]=4 577 B10R1.176 CNc1ccc(c(c1)Cl)O MB15061 [1,1,0,0,0,0|2,0,0]=4 578 B10R1.176 CNc1ccc(c(c1)F)O MB33460 [1,1,0,0,0,0|2,0,0]=4 579 B10R1.176 CNc1ccc(c(c1)I)O MB28237 [1,1,0,0,0,0|2,0,0]=4 580 B10R1.176 CNc1ccc(c(c1)N)O MB27818 [1,1,0,0,0,0|2,0,0]=4 581 B10R1.176 CNc1ccc(c(c1)O)Br MB32226 [1,1,0,0,0,0|2,0,0]=4 582 B10R1.176 CNc1ccc(c(c1)O)Cl MB28131 [1,1,0,0,0,0|2,0,0]=4 583 B10R1.176 CNc1ccc(c(c1)O)F MB37912 [1,1,0,0,0,0|2,0,0]=4 584 B10R1.176 CNc1ccc(c(c1)O)I MB26459 [1,1,0,0,0,0|2,0,0]=4 585 B10R1.176 CNc1ccc(c(c1)O)N MB25952 [1,1,0,0,0,0|2,0,0]=4 586 B10R1.176 COc1ccc(c(c1)Br)I CB11658 [1,1,0,0,0,0|2,0,0]=4 587 B10R1.176 COc1ccc(c(c1)Br)N AB49251 [1,1,0,0,0,0|2,0,0]=4 588 B10R1.176 COc1ccc(c(c1)Br)O AB10935 [1,1,0,0,0,0|2,0,0]=4 589 B10R1.176 COc1ccc(c(c1)F)N AB09440 [1,1,0,0,0,0|2,0,0]=4 590 B10R1.176 COc1ccc(c(c1)I)N AB42374 [1,1,0,0,0,0|2,0,0]=4 591 B10R1.176 COc1ccc(c(c1)I)O MB07821 [1,1,0,0,0,0|2,0,0]=4 592 B10R1.176 COc1ccc(c(c1)N)I AB45640 [1,1,0,0,0,0|2,0,0]=4 593 B10R1.176 COc1ccc(c(c1)N)N AB02069 [1,1,0,0,0,0|2,0,0]=4 594 B10R1.176 COc1ccc(c(c1)N)O AB25358 [1,1,0,0,0,0|2,0,0]=4 595 B10R1.176 COc1ccc(c(c1)O)Br MB02872 [1,1,0,0,0,0|2,0,0]=4 596 B10R1.176 COc1ccc(c(c1)O)F MB25573 [1,1,0,0,0,0|2,0,0]=4 597 B10R1.176 COc1ccc(c(c1)O)I MB12203 [1,1,0,0,0,0|2,0,0]=4 598 B10R1.176 CSc1ccc(c(c1)Br)O MB09158 [1,1,0,0,0,0|2,0,0]=4 599 B10R1.176 CSc1ccc(c(c1)Cl)O MB31036 [1,1,0,0,0,0|2,0,0]=4 600 B10R1.176 CSc1ccc(c(c1)F)O MB25631 [1,1,0,0,0,0|2,0,0]=4 601 B10R1.176 CSc1ccc(c(c1)I)O MB38361 [1,1,0,0,0,0|2,0,0]=4 602 B10R1.176 CSc1ccc(c(c1)N)O MB34167 [1,1,0,0,0,0|2,0,0]=4 603 B10R1.176 CSc1ccc(c(c1)O)Cl MB33637 [1,1,0,0,0,0|2,0,0]=4 604 B10R1.176 CSc1ccc(c(c1)O)F MB25520 [1,1,0,0,0,0|2,0,0]=4 605 B10R1.176 CSc1ccc(c(c1)O)I MB38424 [1,1,0,0,0,0|2,0,0]=4 606 B10R1.176 Cc1c(cc(cn1)CCl)Cl AB74647 [1,1,0,0,0,0|2,0,0]=4 607 B10R1.176 Cc1c(cc(cn1)CCl)F AB76305 [1,1,0,0,0,0|2,0,0]=4 608 B10R1.176 Cc1c(cc(cn1)CN)Cl AB74649 [1,1,0,0,0,0|2,0,0]=4 609 B10R1.176 Cc1c(cc(cn1)CN)F AB76308 [1,1,0,0,0,0|2,0,0]=4 610 B10R1.176 Cc1c(cc(cn1)OC)N AB73554 [1,1,0,0,0,0|2,0,0]=4 611 B10R1.176 Cc1cc(ccc1Br)CO AB50387 [1,1,0,0,0,0|2,0,0]=4 612 B10R1.176 Cc1cc(ccc1O)CN MB05062 [1,1,0,0,0,0|2,0,0]=4 613 B10R1.176 Cc1cc(ccc1O)NC MB07546 [1,1,0,0,0,0|2,0,0]=4 614 B10R1.176 Cc1cc(cnc1C)CCl AB75391 [1,1,0,0,0,0|2,0,0]=4 615 B10R1.176 Cc1cc(cnc1C)CN AB70585 [1,1,0,0,0,0|2,0,0]=4 616 B10R1.176 Cc1cc(cnc1C)OC AB85300 [1,1,0,0,0,0|2,0,0]=4 617 B10R1.176 Cc1cc(ncc1C)CCl AB64952 [1,1,0,0,0,0|2,0,0]=4 618 B10R1.176 Cc1cc(ncc1C)CN AB65468 [1,1,0,0,0,0|2,0,0]=4 619 B10R1.176 Cc1ccc(cc1Br)C#N AB29736 [1,1,0,0,0,0|1,0,1]=4 620 B10R1.176 Cc1ccc(cc1O)C#N MB06106 [1,1,0,0,0,0|1,0,1]=4 621 B10R1.176 Cc1ccc(cc1O)C=O MB01933 [1,1,0,0,0,0|1,0,1]=4 622 B10R1.176 Cc1ccc(cc1O)NC MB25401 [1,1,0,0,0,0|1,0,0]=3 623 B10R1.176 Cc1ccc(cc1O)OC MB11905 [1,1,0,0,0,0|1,0,0]=3 624 B10R1.176 Cc1ccc(cc1O)SC MB25438 [1,1,0,0,0,0|1,0,0]=3 625 B10R1.176 Cc1ccc(nc1C)CCl AB64955 [1,1,0,0,0,0|2,0,0]=4 626 B10R1.176 Cc1ccc(nc1C)CN AB65463 [1,1,0,0,0,0|2,0,0]=4 627 B10R1.176 Cc1ccc(nc1Cl)CCl AB75101 [1,1,0,0,0,0|2,0,0]=4 628 B10R1.176 Cc1ccc(nc1Cl)CN AB75099 [1,1,0,0,0,0|2,0,0]=4 629 B10R1.176 Cc1ccc(nc1F)CCl AB72849 [1,1,0,0,0,0|2,0,0]=4 630 B10R1.176 Cc1ccc(nc1F)CN AB72850 [1,1,0,0,0,0|2,0,0]=4 631 B10R1.176 Cc1ccc(nc1N)OC AB73563 [1,1,0,0,0,0|2,0,0]=4 632 B10R1.176 Cc1cnc(cc1Br)CCl AB70165 [1,1,0,0,0,0|2,0,0]=4 633 B10R1.176 Cc1cnc(cc1Br)CN AB70168 [1,1,0,0,0,0|2,0,0]=4 634 B10R1.176 Cc1cnc(cc1Cl)CCl AB70036 [1,1,0,0,0,0|2,0,0]=4 635 B10R1.176 Cc1cnc(cc1Cl)CN AB70034 [1,1,0,0,0,0|2,0,0]=4 636 B10R1.176 Cc1cnc(cc1F)CCl AB82954 [1,1,0,0,0,0|2,0,0]=4 637 B10R1.176 Cc1cnc(cc1F)CN AB82957 [1,1,0,0,0,0|2,0,0]=4 638 B10R1.176 Cc1cnc(cc1N)OC AB73589 [1,1,0,0,0,0|2,0,0]=4 639 B10R1.176 Cn1ccc(cc1=O)CN PB15227 [1,1,0,0,0,0|2,0,0]=4 640 B10R1.176 Cn1ccc(cc1=O)CO PB18199 [1,1,0,0,0,0|2,0,0]=4 641 B10R1.176 c1cc(c(cc1CBr)I)F AB44169 [1,1,0,0,0,0|2,0,0]=4 642 B10R1.176 c1cc(c(cc1CN)Br)O MB02719 [1,1,0,0,0,0|2,0,0]=4 643 B10R1.176 c1cc(c(cc1CN)Cl)O MB03734 [1,1,0,0,0,0|2,0,0]=4 644 B10R1.176 c1cc(c(cc1CN)F)N AB50278 [1,1,0,0,0,0|2,0,0]=4 645 B10R1.176 c1cc(c(cc1CN)F)O MB03723 [1,1,0,0,0,0|2,0,0]=4 646 B10R1.176 c1cc(c(cc1CN)I)O MB27028 [1,1,0,0,0,0|2,0,0]=4 647 B10R1.176 c1cc(c(cc1CN)N)O MB37291 [1,1,0,0,0,0|2,0,0]=4 648 B10R1.176 c1cc(c(cc1CN)O)Br MB27292 [1,1,0,0,0,0|2,0,0]=4 649 B10R1.176 c1cc(c(cc1CN)O)Cl MB25545 [1,1,0,0,0,0|2,0,0]=4 650 B10R1.176 c1cc(c(cc1CN)O)F MB35973 [1,1,0,0,0,0|2,0,0]=4 651 B10R1.176 c1cc(c(cc1CN)O)I MB25685 [1,1,0,0,0,0|2,0,0]=4 652 B10R1.176 c1cc(c(cc1CN)O)N MB29053 [1,1,0,0,0,0|2,0,0]=4 653 B10R1.176 c1cc(c(cc1CO)F)Br AB44195 [1,1,0,0,0,0|2,0,0]=4 654 B10R1.15 CC(c1cccnc1)NC CB11165 [1,1,0,0,0,0|1,0,0]=3 655 B10R1.15 C[C@@H](CN)c1ccccc1 AB04898 [1,1,0,0,0,0|0,0,0]=2 656 B10R1.15 C[C@H](CN)c1ccccc1 AB04902 [1,1,0,0,0,0|0,0,0]=2 657 B10R1.15 c1cc(cnc1)C(CCl)O MB06178 [1,1,0,0,0,0|2,0,0]=4 658 B10R1.15 c1cc(cnc1)C(CN)O AB16395 [1,1,0,0,0,0|2,0,0]=4 659 B10R1.15 c1cc(cnc1)C(CO)N AB12437 [1,1,0,0,0,0|2,0,0]=4 660 B10R1.28 CC(C)(C)c1ccccn1 CB10120 [1,1,0,0,0,0|1,0,0]=3 661 B10R1.28 CC(C)(c1ccccn1)N AB48746 [1,1,0,0,0,0|1,0,0]=3 662 B10R1.28 CC(C)(c1cccnc1)N AB48740 [1,1,0,0,0,0|1,0,0]=3 663 B10R1.28 CC(C)(c1ccncc1)N AB48742 [1,1,0,0,0,0|1,0,0]=3 664 B10R1.61 CC(C)c1c(cccn1)O MB22687 [1,1,0,0,0,0|1,0,0]=3 665 B10R1.61 CC(C)c1c(nccn1)Cl AB70582 [1,1,0,0,0,0|2,0,0]=4 666 B10R1.61 CC(C)c1ccncc1O MB22678 [1,1,0,0,0,0|1,0,0]=3 667 B10R1.61 CC(C)c1cnccc1O MB22684 [1,1,0,0,0,0|1,0,0]=3 668 B10R1.61 CC(C)c1cncnc1Cl AB55647 [1,1,0,0,0,0|2,0,0]=4 669 B10R1.61 CC(c1cccnc1Br)N AB41828 [1,1,0,0,0,0|2,0,0]=4 670 B10R1.61 CC(c1cccnc1Cl)N AB67346 [1,1,0,0,0,0|2,0,0]=4 671 B10R1.61 CC(c1cnccc1Cl)N AB68000 [1,1,0,0,0,0|2,0,0]=4 672 B10R1.61 CN(C)c1c(cccn1)Br AB67478 [1,1,0,0,0,0|2,0,0]=4 673 B10R1.61 CN(C)c1c(cccn1)Cl AB67480 [1,1,0,0,0,0|2,0,0]=4 674 B10R1.61 CN(C)c1c(cccn1)O MB24991 [1,1,0,0,0,0|2,0,0]=4 675 B10R1.61 CN(C)c1ccccc1O MB08302 [1,1,0,0,0,0|1,0,0]=3 676 B10R1.61 CN(C)c1ccncc1O MB24982 [1,1,0,0,0,0|2,0,0]=4 677 B10R1.61 CN(C)c1cnccc1O MB24989 [1,1,0,0,0,0|2,0,0]=4 678 B10R1.61 Cc1c(cccn1)C(C)C AB65910 [1,1,0,0,0,0|1,0,0]=3 679 B10R1.61 Cc1c(cccn1)C(C)N AB66938 [1,1,0,0,0,0|2,0,0]=4 680 B10R1.61 Cc1ccncc1C(C)N AB67850 [1,1,0,0,0,0|2,0,0]=4 681 B10R1.113 CC(C)c1cc(ccn1)O MB11626 [1,1,0,0,0,0|1,0,0]=3 682 B10R1.113 CC(C)c1cc(cnc1)Br MB14162 [1,1,0,0,0,0|1,0,0]=3 683 B10R1.113 CC(C)c1cc(cnc1)O MB22682 [1,1,0,0,0,0|1,0,0]=3 684 B10R1.113 CC(C)c1cc(ncn1)Br MB09511 [1,1,0,0,0,0|2,0,0]=4 685 B10R1.113 CC(C)c1cc(ncn1)Cl AB51366 [1,1,0,0,0,0|2,0,0]=4 686 B10R1.113 CC(C)c1cc(ncn1)N AB54959 [1,1,0,0,0,0|2,0,0]=4 687 B10R1.113 CC(C)c1cc(ncn1)O AB54885 [1,1,0,0,0,0|2,0,0]=4 688 B10R1.113 CC(C)c1cccc(n1)Br MB09496 [1,1,0,0,0,0|1,0,0]=3 689 B10R1.113 CC(C)c1ccnc(c1)Cl MB13722 [1,1,0,0,0,0|1,0,0]=3 690 B10R1.113 CC(C)c1nccc(n1)Br AB63999 [1,1,0,0,0,0|2,0,0]=4 691 B10R1.113 CC(C)c1nccc(n1)Cl AB51255 [1,1,0,0,0,0|2,0,0]=4 692 B10R1.113 CC(c1cc(cnc1)Br)N AB41075 [1,1,0,0,0,0|2,0,0]=4 693 B10R1.113 CC(c1cccc(n1)Br)N AB67302 [1,1,0,0,0,0|2,0,0]=4 694 B10R1.113 CC(c1cccc(n1)Cl)N AB67350 [1,1,0,0,0,0|2,0,0]=4 695 B10R1.113 CC(c1ccnc(c1)Cl)N AB67353 [1,1,0,0,0,0|2,0,0]=4 696 B10R1.113 CN(C)c1cc(ccn1)Br AB64930 [1,1,0,0,0,0|2,0,0]=4 697 B10R1.113 CN(C)c1cc(ccn1)Cl AB49336 [1,1,0,0,0,0|2,0,0]=4 698 B10R1.113 CN(C)c1cc(ccn1)O MB15076 [1,1,0,0,0,0|2,0,0]=4 699 B10R1.113 CN(C)c1cc(cnc1)Br MB12044 [1,1,0,0,0,0|2,0,0]=4 700 B10R1.113 CN(C)c1cc(cnc1)O MB24985 [1,1,0,0,0,0|2,0,0]=4 701 B10R1.113 CN(C)c1cccc(n1)Br AB54123 [1,1,0,0,0,0|2,0,0]=4 702 B10R1.113 CN(C)c1cccc(n1)Cl AB67484 [1,1,0,0,0,0|2,0,0]=4 703 B10R1.113 CN(C)c1ccnc(c1)Br CB11468 [1,1,0,0,0,0|2,0,0]=4 704 B10R1.113 CN(C)c1ccnc(c1)Cl MB06813 [1,1,0,0,0,0|2,0,0]=4 705 B10R1.113 C[C@@H](c1cccc(c1)N)N AB29091 [1,1,0,0,0,0|1,0,0]=3 706 B10R1.113 C[C@@H](c1ccnc(c1)Cl)N AB49742 [1,1,0,0,0,0|2,0,0]=4 707 B10R1.113 C[C@H](c1cccc(c1)O)N AB21156 [1,1,0,0,0,0|1,0,0]=3 708 B10R1.113 C[C@H](c1ccnc(c1)Cl)N AB49740 [1,1,0,0,0,0|2,0,0]=4 709 B10R1.113 Cc1cc(ccn1)C(C)N AB66941 [1,1,0,0,0,0|2,0,0]=4 710 B10R1.113 Cc1cccc(n1)C(C)N AB25816 [1,1,0,0,0,0|2,0,0]=4 711 B10R1.31 CC(C)c1cc(on1)CCl AB51039 [0,1,0,0,1,0|2,0,0]=4 712 B10R1.31 CC(C)c1cc(on1)CN AB28464 [0,1,0,0,1,0|2,0,0]=4 713 B10R1.31 CC(C)c1csc(n1)CCl AB68287 [0,1,0,0,1,0|2,0,0]=4 714 B10R1.31 CC(C)c1nc(co1)CCl AB42970 [0,1,0,0,1,0|2,0,0]=4 715 B10R1.31 CC(C)c1nc(cs1)CCl AB26696 [0,1,0,0,1,0|2,0,0]=4 716 B10R1.55 CC(C)(C)c1ccc(s1)N AB72603 [0,1,0,0,1,0|2,0,0]=4 717 B12R1.4 CC(=O)Cc1ccc(cc1)OC AB00957 [0,1,0,0,0,1|1,0,1]=4 718 B12R1.4 CC(C)Cc1cnc(cn1)CCl AB73117 [0,1,0,0,0,1|2,0,0]=4 719 B12R1.4 CC(C)Cc1cnc(cn1)CN AB73115 [0,1,0,0,0,1|2,0,0]=4 720 B12R1.4 CC(C)Oc1ccc(cc1)NN AB27890 [0,1,0,0,0,1|1,0,0]=3 721 B12R1.4 CC(Cc1ccc(cc1)OC)N MB01555 [0,1,0,0,0,1|1,0,0]=3 722 B12R1.4 C[C@@H](Cc1ccc(cc1)OC)N AB70588 [0,1,0,0,0,1|1,0,0]=3 723 B12R1.4 C[C@H](Cc1ccc(cc1)OC)N AB51426 [0,1,0,0,0,1|1,0,0]=3 724 B12R1.19 CC(C)Oc1ccc(c(c1)Br)O MB23095 [0,1,0,0,0,1|1,0,0]=3 725 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)O MB23097 [0,1,0,0,0,1|1,0,0]=3 726 B12R1.19 CC(C)Oc1ccc(c(c1)F)N AB09448 [0,1,0,0,0,1|1,0,0]=3 727 B12R1.19 CC(C)Oc1ccc(c(c1)F)O MB23076 [0,1,0,0,0,1|1,0,0]=3 728 B12R1.19 CC(C)Oc1ccc(c(c1)I)O MB23080 [0,1,0,0,0,1|1,0,0]=3 729 B12R1.19 CC(C)Oc1ccc(c(c1)N)O MB23087 [0,1,0,0,0,1|1,0,0]=3 730 B12R1.19 CC(C)Oc1ccc(c(c1)O)Br MB23146 [0,1,0,0,0,1|1,0,0]=3 731 B12R1.19 CC(C)Oc1ccc(c(c1)O)Cl MB23153 [0,1,0,0,0,1|1,0,0]=3 732 B12R1.19 CC(C)Oc1ccc(c(c1)O)F MB23035 [0,1,0,0,0,1|1,0,0]=3 733 B12R1.19 CC(C)Oc1ccc(c(c1)O)I MB23037 [0,1,0,0,0,1|1,0,0]=3 734 B12R1.19 CC(C)Oc1ccc(c(c1)O)N MB23047 [0,1,0,0,0,1|1,0,0]=3 735 B12R1.19 Cc1cc(ccc1O)OC(C)C MB23056 [0,1,0,0,0,1|1,0,0]=3 736 B12R1.19 Cc1ccc(cc1Br)NC(=O)C AB07992 [0,1,0,0,0,1|1,0,1]=4 737 B12R1.19 Cc1ccc(cc1O)OC(C)C MB23001 [0,1,0,0,0,1|0,0,0]=2 738 B12R1.20 CN(C)C(=O)c1ccc(cc1)O MB01715 [0,1,0,0,0,1|2,0,0]=4 739 B12R1.20 C[C@H]([C@H](c1ccc(cc1)O)O)N MB00597 [0,1,0,0,0,1|2,0,0]=4 740 B12R1.49 CC(CN)Oc1ccc(cc1)Br AB38871 [0,1,0,0,0,1|1,0,0]=3 741 B12R1.49 CC(CN)Oc1ccc(cc1)Cl AB38863 [0,1,0,0,0,1|1,0,0]=3 742 B12R1.49 CC(CN)Oc1ccc(cc1)F AB12553 [0,1,0,0,0,1|1,0,0]=3 743 B12R1.49 Cc1ccc(cc1)CC(=N)OC AB60933 [0,1,0,0,0,1|1,0,1]=4 744 B12R1.49 Cc1ccc(cc1)OC(C)CN AB16399 [0,1,0,0,0,1|0,0,0]=2 745 B12R1.49 Cc1ccc(cn1)OC(C)CN AB38918 [0,1,0,0,0,1|1,0,0]=3 746 B12R1.49 c1cc(ccc1C[C@@H](CO)N)O MB00396 [0,1,0,0,0,1|2,0,0]=4 747 B12R1.106 CC(C)(C)Cc1ccc(cc1)O AB16670 [0,1,0,0,0,1|1,0,0]=3 748 B12R1.106 CC(C)(C)Oc1ccc(cn1)Br MB06466 [0,1,0,0,0,1|2,0,0]=4 749 B12R1.106 CC(C)(C)Oc1ccc(cn1)O MB25551 [0,1,0,0,0,1|2,0,0]=4 750 B12R1.106 CC(C)(C)Oc1ccc(nc1)Br MB09482 [0,1,0,0,0,1|2,0,0]=4 751 B12R1.106 CC(C)(C)Oc1ccc(nc1)Cl MB20018 [0,1,0,0,0,1|2,0,0]=4 752 B12R1.106 CC(C)(Cc1ccc(cc1)Br)N AB64460 [0,1,0,0,0,1|1,0,0]=3 753 B12R1.106 CC(C)(Cc1ccc(cc1)Cl)N AB02276 [0,1,0,0,0,1|1,0,0]=3 754 B12R1.106 CC(C)(Cc1ccc(cc1)F)N AB03122 [0,1,0,0,0,1|1,0,0]=3 755 B12R1.106 CC(C)(Cc1ccc(cc1)I)N AB68848 [0,1,0,0,0,1|1,0,0]=3 756 B12R1.106 CC(C)(Cc1ccc(cc1)N)N AB68843 [0,1,0,0,0,1|1,0,0]=3 757 B12R1.106 CC(C)(Cc1ccc(cc1)O)N AB07591 [0,1,0,0,0,1|1,0,0]=3 758 B12R1.106 CC(C)(Cc1ccc(nc1)Br)N AB77419 [0,1,0,0,0,1|2,0,0]=4 759 B12R1.106 CC(C)(Cc1ccc(nc1)Cl)N AB77417 [0,1,0,0,0,1|2,0,0]=4 760 B12R1.106 Cc1ccc(cc1)CC(C)(C)N AB54574 [0,1,0,0,0,1|0,0,0]=2 761 B12R1.233 CC(C)Oc1c(cc(cn1)Br)I AB31061 [0,1,0,0,0,1|2,0,0]=4 762 B12R1.233 CC(C)Oc1ccc(cc1Br)O MB23132 [0,1,0,0,0,1|1,0,0]=3 763 B12R1.233 CC(C)Oc1ccc(cc1Cl)O MB13560 [0,1,0,0,0,1|1,0,0]=3 764 B12R1.233 CC(C)Oc1ccc(cc1F)O MB23119 [0,1,0,0,0,1|1,0,0]=3 765 B12R1.233 CC(C)Oc1ccc(cc1I)O MB23120 [0,1,0,0,0,1|1,0,0]=3 766 B12R1.233 CC(C)Oc1ccc(cc1N)O MB23121 [0,1,0,0,0,1|1,0,0]=3 767 B12R1.233 CC(C)Oc1ccc(cc1O)Br MB23150 [0,1,0,0,0,1|1,0,0]=3 768 B12R1.233 CC(C)Oc1ccc(cc1O)Cl MB13550 [0,1,0,0,0,1|1,0,0]=3 769 B12R1.233 CC(C)Oc1ccc(cc1O)F MB14580 [0,1,0,0,0,1|1,0,0]=3 770 B12R1.233 CC(C)Oc1ccc(cc1O)I MB23040 [0,1,0,0,0,1|1,0,0]=3 771 B12R1.233 CC(C)Oc1ccc(cc1O)N MB23049 [0,1,0,0,0,1|1,0,0]=3 772 B12R1.233 Cc1cc(ccc1OC(C)C)O MB13553 [0,1,0,0,0,1|1,0,0]=3 773 B12R1.233 Cc1ccc(c(c1)O)OC(C)C MB13554 [0,1,0,0,0,1|0,0,0]=2 774 B12R1.5 COc1ccc(cc1)C(=N)OC AB04684 [0,2,0,0,0,0|1,0,1]=4 775 B12R1.5 C[C@H](CN)c1ccc(cc1)OC AB85099 [0,2,0,0,0,0|0,0,0]=2 776 B12R1.6 CC(C)(C)c1ccc(cc1)C#N AB02903 [0,2,0,0,0,0|0,0,1]=3 777 B12R1.6 CC(C)(C)c1ccc(cn1)C=O AB49282 [0,2,0,0,0,0|1,0,1]=4 778 B12R1.6 CC(C)(C)c1cnc(cn1)CCl AB76487 [0,2,0,0,0,0|2,0,0]=4 779 B12R1.6 CC(C)(C)c1cnc(cn1)CN AB77172 [0,2,0,0,0,0|2,0,0]=4 780 B12R1.6 CC(C)(C)c1cnc(nc1)CCl AB59394 [0,2,0,0,0,0|2,0,0]=4 781 B12R1.6 CC(C)(C)c1cnc(nc1)CN AB59206 [0,2,0,0,0,0|2,0,0]=4 782 B12R1.6 CC(C)(C)c1ncc(cn1)CCl AB58906 [0,2,0,0,0,0|2,0,0]=4 783 B12R1.6 CC(C)(C)c1ncc(cn1)CN AB58505 [0,2,0,0,0,0|2,0,0]=4 784 B12R1.6 CC(C)(c1ccc(cc1)C#N)N AB68827 [0,2,0,0,0,0|0,0,1]=3 785 B12R1.6 CC(C)(c1ccc(cc1)OC)N AB43157 [0,2,0,0,0,0|0,0,0]=2 786 B12R1.6 CC(C)(c1ccc(nc1)OC)N AB67113 [0,2,0,0,0,0|1,0,0]=3 787 B12R1.6 CS(=O)(=O)c1ccc(cc1)CN AB23397 [0,2,0,0,0,0|2,0,0]=4 788 B12R1.48 CC(C)c1ccc(c(c1)O)C#N AB50290 [0,2,0,0,0,0|0,0,1]=3 789 B12R1.48 CC(C)c1ccc(c(c1)O)C=O MB22474 [0,2,0,0,0,0|0,0,1]=3 790 B12R1.48 CC(C)c1ccc(c(c1)O)CN MB29796 [0,2,0,0,0,0|0,0,0]=2 791 B12R1.48 CC(C)c1ccc(c(c1)O)OC MB13567 [0,2,0,0,0,0|0,0,0]=2 792 B12R1.48 CC(C)c1ccc(c(c1)O)SC MB31451 [0,2,0,0,0,0|0,0,0]=2 793 B12R1.48 CCc1ccc(cc1O)C(C)C MB23789 [0,2,0,0,0,0|0,0,0]=2 794 B12R1.48 CCc1ccc(cc1O)N(C)C MB23826 [0,2,0,0,0,0|1,0,0]=3 795 B12R1.48 CN(C)c1ccc(c(c1)O)C#N MB11877 [0,2,0,0,0,0|1,0,1]=4 796 B12R1.48 CN(C)c1ccc(c(c1)O)C=O MB00354 [0,2,0,0,0,0|1,0,1]=4 797 B12R1.48 CN(C)c1ccc(c(c1)O)OC MB33601 [0,2,0,0,0,0|1,0,0]=3 798 B12R1.48 CNc1ccc(cc1O)N(C)C MB38063 [0,2,0,0,0,0|1,0,0]=3 799 B12R1.113 CC(=O)c1ccc(cc1)CC#C AB73223 [0,2,0,0,0,0|1,0,1]=4 800 B12R1.113 CC(C)c1cnc(nc1)CCN AB59351 [0,2,0,0,0,0|2,0,0]=4 801 B12R1.113 CC(C)c1ncc(cn1)CCN AB63244 [0,2,0,0,0,0|2,0,0]=4 802 B12R1.113 CN(C)c1ccc(cc1)CC=O AB48491 [0,2,0,0,0,0|1,0,0]=3 803 B12R1.113 CN(C)c1ccc(cn1)CC#N AB44368 [0,2,0,0,0,0|2,0,0]=4 804 B12R1.256 B(c1ccc(cc1)C(C)C)(O)O AB08067 [0,2,0,0,0,0|1,0,0]=3 805 B12R1.256 B(c1ccc(cc1)N(C)C)(O)O AB08086 [0,2,0,0,0,0|2,0,0]=4 806 B12R1.256 CC(=O)c1ccc(nc1)N(C)C AB67490 [0,2,0,0,0,0|2,0,0]=4 807 B12R1.256 CC(C)c1ccc(cn1)[N+](=O)[O-] PB13389 [0,2,0,0,0,0|2,0,0]=4 808 B12R1.256 CN(C)c1ccc(cc1)C(=N)N AB18271 [0,2,0,0,0,0|1,0,1]=4 809 B12R1.452 CC(=O)c1ccc(cc1F)OC PB30564 [0,2,0,0,0,0|1,0,1]=4 810 B12R1.452 CC(C)c1ccc(cc1F)OC PB12327 [0,2,0,0,0,0|0,0,0]=2 811 B12R1.452 CC(C)c1ccc(cc1O)C#N MB22460 [0,2,0,0,0,0|0,0,1]=3 812 B12R1.452 CC(C)c1ccc(cc1O)C=O MB22475 [0,2,0,0,0,0|0,0,1]=3 813 B12R1.452 CC(C)c1ccc(cc1O)CN MB36998 [0,2,0,0,0,0|0,0,0]=2 814 B12R1.452 CC(C)c1ccc(cc1O)NC MB35415 [0,2,0,0,0,0|0,0,0]=2 815 B12R1.452 CC(C)c1ccc(cc1O)OC MB37919 [0,2,0,0,0,0|0,0,0]=2 816 B12R1.452 CC(C)c1ccc(cc1O)SC MB37763 [0,2,0,0,0,0|0,0,0]=2 817 B12R1.452 CCc1ccc(c(c1)O)C(C)C MB23788 [0,2,0,0,0,0|0,0,0]=2 818 B12R1.452 CCc1ccc(c(c1)O)N(C)C MB23848 [0,2,0,0,0,0|1,0,0]=3 819 B12R1.452 CN(C)c1ccc(cc1O)C#N MB29438 [0,2,0,0,0,0|1,0,1]=4 820 B12R1.452 CN(C)c1ccc(cc1O)C=O MB35354 [0,2,0,0,0,0|1,0,1]=4 821 B12R1.452 CN(C)c1ccc(cc1O)CN MB38570 [0,2,0,0,0,0|1,0,0]=3 822 B12R1.452 CN(C)c1ccc(cc1O)OC MB27728 [0,2,0,0,0,0|1,0,0]=3 823 B12R1.452 CN(C)c1ccc(cc1O)SC MB28789 [0,2,0,0,0,0|1,0,0]=3 824 B12R1.452 CNc1ccc(c(c1)O)N(C)C MB30484 [0,2,0,0,0,0|1,0,0]=3 825 B12R1.452 Cc1cc(ccc1N(C)C)C=O CB10492 [0,2,0,0,0,0|1,0,1]=4 826 B12R1.9 CC(C)(C#N)c1ccc(cc1)N PB13096 [0,2,0,0,0,0|1,0,0]=3 827 B12R1.9 CC(C)(CN)c1ccc(nc1)Cl AB67359 [0,2,0,0,0,0|2,0,0]=4 828 B12R1.9 CC(CN)(c1ccc(cc1)Cl)O AB31025 [0,2,0,0,0,0|1,0,0]=3 829 B12R1.9 CC(CN)(c1ccc(cc1)Cl)O AB49882 [0,2,0,0,0,0|1,0,0]=3 830 B12R1.9 Cc1ccc(cc1)C(CN)(F)F AB84703 [0,2,0,0,0,0|1,0,0]=3 831 B12R1.9 c1cc(ccc1C(CN)(F)F)Br AB76208 [0,2,0,0,0,0|2,0,0]=4 832 B12R1.9 c1cc(ccc1C(CN)(F)F)Cl AB76550 [0,2,0,0,0,0|2,0,0]=4 833 B12R1.9 c1cc(ccc1C(CN)(F)F)F AB76475 [0,2,0,0,0,0|2,0,0]=4 834 B12R1.23 CC(C)(C)c1cc(c(cn1)Cl)N AB73594 [0,2,0,0,0,0|2,0,0]=4 835 B12R1.23 CC(C)(C)c1cc(c(cn1)N)Cl AB72469 [0,2,0,0,0,0|2,0,0]=4 836 B12R1.23 CC(C)(C)c1ccc(c(c1)F)O MB21792 [0,2,0,0,0,0|1,0,0]=3 837 B12R1.23 CC(C)(C)c1ccc(c(c1)I)O MB09025 [0,2,0,0,0,0|1,0,0]=3 838 B12R1.23 CC(C)(C)c1ccc(c(c1)O)Br MB14748 [0,2,0,0,0,0|1,0,0]=3 839 B12R1.23 CC(C)(C)c1ccc(c(c1)O)Cl MB21819 [0,2,0,0,0,0|1,0,0]=3 840 B12R1.23 CC(C)(C)c1ccc(c(c1)O)F MB21766 [0,2,0,0,0,0|1,0,0]=3 841 B12R1.23 CC(C)(C)c1ccc(c(c1)O)I MB14746 [0,2,0,0,0,0|1,0,0]=3 842 B12R1.23 CC(C)(C)c1ccc(c(c1)O)N MB21776 [0,2,0,0,0,0|1,0,0]=3 843 B12R1.23 CC(C)(C)c1ccc(c(n1)Cl)N AB73354 [0,2,0,0,0,0|2,0,0]=4 844 B12R1.23 CC(C)(C)c1ccc(c(n1)F)F AB73370 [0,2,0,0,0,0|2,0,0]=4 845 B12R1.23 CC(C)(C)c1ccc(c(n1)N)N AB66685 [0,2,0,0,0,0|2,0,0]=4 846 B12R1.23 CC(C)(c1ccc(c(c1)Cl)F)N AB65060 [0,2,0,0,0,0|1,0,0]=3 847 B12R1.23 CC(C)(c1ccc(c(c1)F)F)N AB68826 [0,2,0,0,0,0|1,0,0]=3 848 B12R1.23 Cc1ccc(cc1Cl)S(=O)(=O)C PB26102 [0,2,0,0,0,0|2,0,0]=4 849 B12R1.23 Cc1ccc(cc1O)C(C)(C)C MB02448 [0,2,0,0,0,0|0,0,0]=2 850 B12R1.23 Cc1ccc(cc1O)C(F)(F)F MB07747 [0,2,0,0,0,0|2,0,0]=4 851 B12R1.126 CC(C)(C)c1ccc(cc1Br)O MB21813 [0,2,0,0,0,0|1,0,0]=3 852 B12R1.126 CC(C)(C)c1ccc(cc1Cl)O MB21815 [0,2,0,0,0,0|1,0,0]=3 853 B12R1.126 CC(C)(C)c1ccc(cc1F)O MB21800 [0,2,0,0,0,0|1,0,0]=3 854 B12R1.126 CC(C)(C)c1ccc(cc1I)O MB21801 [0,2,0,0,0,0|1,0,0]=3 855 B12R1.126 CC(C)(C)c1ccc(cc1N)O MB21802 [0,2,0,0,0,0|1,0,0]=3 856 B12R1.126 CC(C)(C)c1ccc(cc1O)Br MB09250 [0,2,0,0,0,0|1,0,0]=3 857 B12R1.126 CC(C)(C)c1ccc(cc1O)Cl MB21821 [0,2,0,0,0,0|1,0,0]=3 858 B12R1.126 CC(C)(C)c1ccc(cc1O)F MB21768 [0,2,0,0,0,0|1,0,0]=3 859 B12R1.126 CC(C)(C)c1ccc(cc1O)I MB21772 [0,2,0,0,0,0|1,0,0]=3 860 B12R1.126 CC(C)(C)c1ccc(cc1O)N MB21780 [0,2,0,0,0,0|1,0,0]=3 861 B12R1.126 Cc1cc(ccc1C(C)(C)C)O MB23393 [0,2,0,0,0,0|1,0,0]=3 862 B12R1.126 Cc1ccc(c(c1)O)C(F)(F)F MB23404 [0,2,0,0,0,0|2,0,0]=4 863 B12R1.56 CC(C)c1ccc(c(c1)C#N)O MB15050 [0,2,0,0,0,0|1,0,0]=3 864 B12R1.56 CC(C)c1ccc(c(c1)NC)O MB30243 [0,2,0,0,0,0|1,0,0]=3 865 B12R1.56 CC(C)c1ccc(c(c1)OC)O MB01575 [0,2,0,0,0,0|1,0,0]=3 866 B12R1.56 CC(C)c1ccc(c(c1)SC)O MB25794 [0,2,0,0,0,0|1,0,0]=3 867 B12R1.56 CCc1cc(ccc1O)C(C)C MB23619 [0,2,0,0,0,0|1,0,0]=3 868 B12R1.56 CCc1cc(ccc1O)N(C)C MB23642 [0,2,0,0,0,0|2,0,0]=4 869 B12R1.56 CN(C)c1ccc(c(c1)C#N)O MB24832 [0,2,0,0,0,0|2,0,0]=4 870 B12R1.56 CN(C)c1ccc(c(c1)C=O)O MB09028 [0,2,0,0,0,0|2,0,0]=4 871 B12R1.56 CN(C)c1ccc(c(c1)CN)O MB36862 [0,2,0,0,0,0|2,0,0]=4 872 B12R1.56 CN(C)c1ccc(c(c1)OC)O MB38324 [0,2,0,0,0,0|2,0,0]=4 873 B12R1.56 CN(C)c1ccc(c(c1)SC)O MB29146 [0,2,0,0,0,0|2,0,0]=4 874 B12R1.56 CNc1cc(ccc1O)N(C)C MB29170 [0,2,0,0,0,0|2,0,0]=4 875 B12R1.232 CC(C)c1cc(c(cc1O)O)Br MB19823 [0,2,0,0,0,0|1,0,0]=3 876 B12R1.367 Cc1ccc(cc1F)C(=O)OC AB23209 [0,2,0,0,0,0|1,0,1]=4 877 B12R1.367 Cc1ccc(cc1O)C(=O)NC AB63536 [0,2,0,0,0,0|1,0,1]=4 878 B12R1.367 Cc1ccc(cc1O)C(=O)OC AB04849 [0,2,0,0,0,0|1,0,1]=4 879 B12R1.16 c1cc(ccc1C(CCO)N)Br AB20223 [0,2,0,0,0,0|2,0,0]=4 880 B12R1.16 c1cc(ccc1C(CCO)N)Cl AB14423 [0,2,0,0,0,0|2,0,0]=4 881 B12R1.16 c1cc(ccc1C(CCO)N)F AB14430 [0,2,0,0,0,0|2,0,0]=4 882 B12R1.1703 Cc1ccc(c(c1)Br)C(=O)OC AB16571 [0,2,0,0,0,0|1,0,1]=4 883 B12R1.1703 Cc1ccc(c(c1)O)C(=O)NC MB09401 [0,2,0,0,0,0|1,0,1]=4 884 B12R1.57 CC(C)c1ccc(cc1C#N)O MB22554 [0,2,0,0,0,0|1,0,0]=3 885 B12R1.57 CC(C)c1ccc(cc1C=O)O MB22572 [0,2,0,0,0,0|1,0,0]=3 886 B12R1.57 CC(C)c1ccc(cc1CN)O MB38827 [0,2,0,0,0,0|1,0,0]=3 887 B12R1.57 CC(C)c1ccc(cc1NC)O MB35650 [0,2,0,0,0,0|1,0,0]=3 888 B12R1.57 CC(C)c1ccc(cc1OC)O MB33914 [0,2,0,0,0,0|1,0,0]=3 889 B12R1.57 CC(C)c1ccc(cc1SC)O MB30926 [0,2,0,0,0,0|1,0,0]=3 890 B12R1.57 CCc1cc(ccc1C(C)C)O MB23739 [0,2,0,0,0,0|1,0,0]=3 891 B12R1.57 CCc1cc(ccc1N(C)C)O MB23760 [0,2,0,0,0,0|2,0,0]=4 892 B12R1.57 CN(C)c1ccc(cc1C=O)O MB34074 [0,2,0,0,0,0|2,0,0]=4 893 B12R1.57 CN(C)c1ccc(cc1CN)O MB35314 [0,2,0,0,0,0|2,0,0]=4 894 B12R1.57 CN(C)c1ccc(cc1OC)O MB25710 [0,2,0,0,0,0|2,0,0]=4 895 B12R1.57 CN(C)c1ccc(cc1SC)O MB32058 [0,2,0,0,0,0|2,0,0]=4 896 B12R1.57 CNc1cc(ccc1N(C)C)O MB34495 [0,2,0,0,0,0|2,0,0]=4 897 B10R2.6 c1cnc(nc1)C2CC2 PB25710 [1,0,0,1,0,0|2,0,0]=4 898 B10R2.14 Cn1cc(nc1)C2CC2 PB37432 [0,0,0,1,1,0|2,0,0]=4 899 B12R2.79 Cc1ccc(cc1)[C@@H]2C[C@H]2N MB69375 [0,0,0,1,0,1|1,0,0]=3 900 B12R2.79 c1cc(ccc1[C@@H]2C[C@H]2N)F MB69383 [0,0,0,1,0,1|2,0,0]=4 901 B12R2.294 Cc1ccc(cc1)OC2CC2 MB35889 [0,0,0,1,0,1|0,0,0]=2 902 B12R2.294 Cc1ccc(cn1)OC2CC2 MB34620 [0,0,0,1,0,1|1,0,0]=3 903 B12R2.294 c1cc(ccc1N)OC2CC2 MB11809 [0,0,0,1,0,1|1,0,0]=3 904 B12R2.294 c1cc(ccc1O)OC2CC2 MB20165 [0,0,0,1,0,1|1,0,0]=3 905 B12R2.294 c1cc(ccc1OC2CC2)Br MB06312 [0,0,0,1,0,1|1,0,0]=3 906 B12R2.294 c1cc(ccc1OC2CC2)Cl MB49590 [0,0,0,1,0,1|1,0,0]=3 907 B12R2.294 c1cc(ccc1OC2CC2)F MB37870 [0,0,0,1,0,1|1,0,0]=3 908 B12R2.294 c1cc(ccc1OC2CC2)I MB25540 [0,0,0,1,0,1|1,0,0]=3 909 B12R2.294 c1cc(ncc1Br)NC2CC2 MB06609 [0,0,0,1,0,1|2,0,0]=4 910 B12R2.294 c1cc(ncc1Br)OC2CC2 MB19974 [0,0,0,1,0,1|2,0,0]=4 911 B12R2.294 c1cc(ncc1Cl)OC2CC2 MB19967 [0,0,0,1,0,1|2,0,0]=4 912 B12R2.294 c1cc(ncc1NC2CC2)Br MB13798 [0,0,0,1,0,1|2,0,0]=4 913 B12R2.294 c1cc(ncc1OC2CC2)Br MB14106 [0,0,0,1,0,1|2,0,0]=4 914 B12R2.294 c1cc(ncc1OC2CC2)Cl MB30047 [0,0,0,1,0,1|2,0,0]=4 915 B12R2.294 c1cc(ncc1OC2CC2)F MB37475 [0,0,0,1,0,1|2,0,0]=4 916 B12R2.294 c1cc(ncc1OC2CC2)I MB32565 [0,0,0,1,0,1|2,0,0]=4 917 B12R2.294 c1cc(ncc1OC2CC2)N MB50371 [0,0,0,1,0,1|2,0,0]=4 918 B12R2.606 c1cc2c(cc1Br)CC(C2)N AB22071 [0,0,0,1,0,1|2,0,0]=4 919 B12R2.606 c1cc2c(cc1Br)CC(C2)N AB55794 [0,0,0,1,0,1|2,0,0]=4 920 B12R2.606 c1cc2c(cc1Br)CC(C2)O AB66019 [0,0,0,1,0,1|2,0,0]=4 921 B12R2.606 c1cc2c(cc1Cl)CC(C2)N AB69974 [0,0,0,1,0,1|2,0,0]=4 922 B12R2.606 c1cc2c(cc1F)CC(C2)N AB43712 [0,0,0,1,0,1|2,0,0]=4 923 B12R2.9 c1c(ncc(n1)C2CC2)CCl AB73127 [0,1,0,1,0,0|2,0,0]=4 924 B12R2.9 c1c(ncc(n1)C2CC2)CN AB73130 [0,1,0,1,0,0|2,0,0]=4 925 B12R2.9 c1cc(ncc1C2CC2)C#N MB13536 [0,1,0,1,0,0|1,0,1]=4 926 B12R2.9 c1cc(ncc1C=O)C2CC2 AB71851 [0,1,0,1,0,0|1,0,1]=4 927 B12R2.9 c1cc(ncc1CCl)C2CC2 AB74687 [0,1,0,1,0,0|1,0,0]=3 928 B12R2.9 c1cc(ncc1CN)C2CC2 AB74684 [0,1,0,1,0,0|1,0,0]=3 929 B12R2.290 Cc1ccc(cc1)C2(CC2)N AB32578 [0,1,0,1,0,0|0,0,0]=2 930 B12R2.290 Cc1ccc(cn1)C2(CC2)N AB66890 [0,1,0,1,0,0|1,0,0]=3 931 B12R2.290 c1cc(ccc1C2(CC2)N)Br AB39547 [0,1,0,1,0,0|1,0,0]=3 932 B12R2.290 c1cc(ccc1C2(CC2)N)Cl AB32576 [0,1,0,1,0,0|1,0,0]=3 933 B12R2.290 c1cc(ccc1C2(CC2)N)F AB39550 [0,1,0,1,0,0|1,0,0]=3 934 B12R2.290 c1cc(ncc1Br)C2(CC2)N AB62764 [0,1,0,1,0,0|2,0,0]=4 935 B12R2.290 c1cc(ncc1C2(CC2)N)Br AB67274 [0,1,0,1,0,0|2,0,0]=4 936 B12R2.290 c1cc(ncc1C2(CC2)N)Cl AB67316 [0,1,0,1,0,0|2,0,0]=4 937 B12R2.291 c1c(c(cnc1C2CC2)Cl)N AB73597 [0,1,0,1,0,0|2,0,0]=4 938 B12R2.612 CN1CCc2c1ccc(c2)N AB49440 [0,1,0,1,0,0|2,0,0]=4 939 B12R2.612 Cc1ccc2c(c1)CCC2N AB38267 [0,1,0,1,0,0|1,0,0]=3 940 B12R2.612 Cc1ccc2c(c1)CC[C@@H]2N AB38272 [0,1,0,1,0,0|1,0,0]=3 941 B12R2.612 Cc1ccc2c(c1)CC[C@H]2N AB38268 [0,1,0,1,0,0|1,0,0]=3 942 B12R2.612 Cc1ccc2c(c1)CNC2=O MB07070 [0,1,0,1,0,0|1,0,1]=4 943 B12R2.612 c1cc2c(cc1Br)CCC2N AB38395 [0,1,0,1,0,0|2,0,0]=4 944 B12R2.612 c1cc2c(cc1Br)CCC2O AB30452 [0,1,0,1,0,0|2,0,0]=4 945 B12R2.612 c1cc2c(cc1Br)CC[C@@H]2N AB29101 [0,1,0,1,0,0|2,0,0]=4 946 B12R2.612 c1cc2c(cc1Br)CC[C@H]2N AB29099 [0,1,0,1,0,0|2,0,0]=4 947 B12R2.612 c1cc2c(cc1Br)OCC2N AB51059 [0,1,0,1,0,0|2,0,0]=4 948 B12R2.612 c1cc2c(cc1Cl)CCC2N AB38345 [0,1,0,1,0,0|2,0,0]=4 949 B12R2.612 c1cc2c(cc1Cl)CC[C@@H]2N AB38352 [0,1,0,1,0,0|2,0,0]=4 950 B12R2.612 c1cc2c(cc1Cl)CC[C@H]2N AB38349 [0,1,0,1,0,0|2,0,0]=4 951 B12R2.612 c1cc2c(cc1Cl)OCC2N AB56718 [0,1,0,1,0,0|2,0,0]=4 952 B12R2.612 c1cc2c(cc1F)CCC2N AB38284 [0,1,0,1,0,0|2,0,0]=4 953 B12R2.612 c1cc2c(cc1F)CC[C@@H]2N AB29094 [0,1,0,1,0,0|2,0,0]=4 954 B12R2.612 c1cc2c(cc1F)CC[C@H]2N AB29097 [0,1,0,1,0,0|2,0,0]=4 955 B12R2.612 c1cc2c(cc1F)OCC2N AB56716 [0,1,0,1,0,0|2,0,0]=4 956 B12R2.612 c1cc2c(cc1O)CC[C@H]2N AB43048 [0,1,0,1,0,0|2,0,0]=4 957 B12R2.1317 c1cn(c(=O)cc1Br)C2CC2 MB19872 [0,1,0,1,0,0|2,0,0]=4 958 B8R1.1 Cc1cc(oc1)CN PB24200 [1,0,0,0,1,0|2,0,0]=4 959 B8R1.1 Cc1cc(sc1)CCl AB72607 [1,0,0,0,1,0|2,0,0]=4 960 B8R1.1 Cc1cc(sc1)CN AB25763 [1,0,0,0,1,0|2,0,0]=4 961 B8R1.1 Cc1ccc(s1)CCl AB50993 [1,0,0,0,1,0|2,0,0]=4 962 B8R1.1 Cc1ccc(s1)CN AB07827 [1,0,0,0,1,0|2,0,0]=4 963 B8R1.1 Cn1ccc(c1)CN AB48514 [1,0,0,0,1,0|2,0,0]=4 964 B8R1.1 Cn1ccc(c1)CO AB09760 [1,0,0,0,1,0|2,0,0]=4 965 B8R1.7 CC(c1ccoc1)N AB27902 [1,0,0,0,1,0|2,0,0]=4 966 B8R1.7 CC(c1ccoc1)N AB66830 [1,0,0,0,1,0|2,0,0]=4 967 B10R1.18 CC(C)Oc1ccccn1 AB63711 [1,0,0,0,0,1|1,0,0]=3 968 B10R1.18 CC(Cc1ccccn1)N AB12969 [1,0,0,0,0,1|2,0,0]=4 969 B10R1.18 CC(Cc1cccnc1)N AB23775 [1,0,0,0,0,1|2,0,0]=4 970 B10R1.18 CC(Cc1ccncc1)N AB28531 [1,0,0,0,0,1|2,0,0]=4 971 B10R1.18 C[C@@H](Cc1ccccc1)N AB03711 [1,0,0,0,0,1|1,0,0]=3 972 B10R1.18 C[C@H](Cc1ccccc1)N AB07478 [1,0,0,0,0,1|1,0,0]=3 973 B12R1.21 CN(C)CCc1ccc(cc1)N AB18473 [0,0,0,0,0,2|2,0,0]=4 974 B12R1.21 Cc1ccc(cc1)OCC(=O)C AB26110 [0,0,0,0,0,2|1,0,1]=4