0 B10R1.13 BrC1=CC=C(C=C1)B(O)O BP20201 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.13 BrC1=CC=C(C=C1)[C@@H](C)O BP22550 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.13 BrC1=CC=C(C=C1)[C@H](C)O BP22551 [0,0,0,0,0,0|2,0,1]=3 3 B10R1.13 BrC1=NC=C(C=C1)B(O)O BP20095 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.13 CC1=CC=C(C=C1)B(O)O BP20156 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.13 CC1=CC=C(C=C1)[S@](=O)N BP22045 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.13 CC1=NC=C(C=C1)B(O)O BP20936 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.13 CC1=NC=C(C=C1)B(S)O BP20632 [0,0,0,0,0,0|3,1,0]=4 8 B10R1.13 ClC1=CC=C(C=C1)B(O)O BP20108 [0,0,0,0,0,0|2,0,1]=3 9 B10R1.13 ClC1=NC=C(C=C1)B(O)O BP20037 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.13 FC1=CC=C(C=C1)B(O)O BP20242 [0,0,0,0,0,0|2,0,1]=3 11 B10R1.13 FC1=NC=C(C(=O)O)C=C1 BP22084 [0,0,0,0,0,0|2,0,0]=2 12 B10R1.13 FC1=NC=C(C=C1)B(O)O BP20262 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.13 FC1=NC=C(C=C1)C(=O)Cl BP22078 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.13 IC1=CC=C(C=C1)B(O)O BP20532 [0,0,0,0,0,0|2,0,1]=3 15 B10R1.13 NC1=CC=C(C=C1)B(O)O BP20325 [0,0,0,0,0,0|2,0,1]=3 16 B10R1.13 NC1=CC=C(C=C1)B(O)O BP20326 [0,0,0,0,0,0|2,0,1]=3 17 B10R1.13 OC1=CC=C(C=C1)B(O)O BP20255 [0,0,0,0,0,0|1,0,1]=2 18 B10R1.13 OC=1C=CC(=NC1)C(=O)O BP22442 [0,0,0,0,0,0|1,0,0]=1 19 B10R1.13 SC1=CC=C(C=C1)B(O)O BP21861 [0,0,0,0,0,0|1,1,1]=3 20 B9R1.1 BrC1=NC=C(C=C1)C=O BP22440 [1,0,0,0,0,0|2,0,0]=3 21 B9R1.6 C1(=CC=CC=C1)B(O)O BP20145 [1,0,0,0,0,0|1,0,1]=3 22 B9R1.6 C[C@@H](c1ccncc1)O BP22558 [1,0,0,0,0,0|2,0,1]=4 23 B9R1.6 C[C@H](O)C1=CC=CC=C1 BP22543 [1,0,0,0,0,0|1,0,1]=3 24 B9R1.6 C[C@H](c1ccccc1)O BP22542 [1,0,0,0,0,0|1,0,1]=3 25 B9R1.6 C[C@H](c1ccncc1)O BP22557 [1,0,0,0,0,0|2,0,1]=4 26 B9R1.6 N1=C(C=CC=C1)[C@@H](C)O BP22555 [1,0,0,0,0,0|2,0,1]=4 27 B9R1.6 N1=C(C=CC=C1)[C@H](C)O BP22556 [1,0,0,0,0,0|2,0,1]=4 28 B9R1.6 N1=CC(=CC=C1)B(O)O BP20136 [1,0,0,0,0,0|2,0,1]=4 29 B9R1.6 N1=CC(=CC=C1)B(O)O BP21984 [1,0,0,0,0,0|2,0,1]=4 30 B9R1.6 N1=CC=C(C=C1)B(O)O BP20148 [1,0,0,0,0,0|2,0,1]=4 31 B11R1.3 BrCC1=CC=C(C=C1)B(O)O BP20200 [0,1,0,0,0,0|2,0,1]=4 32 B11R1.3 C(#N)C1=CC=C(C=C1)B(O)O BP20405 [0,1,0,0,0,0|2,0,1]=4 33 B11R1.3 C(=C)C1=CC=C(C=C1)B(O)O BP22162 [0,1,0,0,0,0|2,0,1]=4 34 B11R1.3 C(=O)C1=CC=C(C=C1)B(O)O BP20305 [0,1,0,0,0,0|1,0,2]=4 35 B11R1.3 C(C)C1=CC=C(C=C1)B(O)O BP20285 [0,1,0,0,0,0|2,0,1]=4 36 B11R1.3 COC1=CC=C(C=C1)B(O)O BP20268 [0,1,0,0,0,0|1,0,1]=3 37 B11R1.3 COC1=CC=C(C=C1)B(O)O BP22417 [0,1,0,0,0,0|1,0,1]=3 38 B11R1.3 COC1=NC=C(C=C1)B(O)O BP20170 [0,1,0,0,0,0|2,0,1]=4 39 B11R1.3 CSC1=CC=C(C=C1)B(O)O BP20160 [0,1,0,0,0,0|1,1,1]=4 40 B11R1.3 NCC1=CC=C(C=C1)B(O)O BP22172 [0,1,0,0,0,0|2,0,1]=4 41 B11R1.3 OCC1=CC=C(C=C1)B(O)O BP20270 [0,1,0,0,0,0|1,0,1]=3 42 B11R1.3 OCC1=CC=C(C=N1)B(O)O BP20691 [0,1,0,0,0,0|2,0,1]=4 43 B11R1.19 OC1=CC=C(C=C1)[B-](F)(F)F BP21782 [0,1,0,0,0,0|3,0,0]=4 44 B11R1.21 BrC1=C(C=C(C=C1)B(O)O)C BP21253 [0,1,0,0,0,0|2,0,1]=4 45 B11R1.21 BrC1=C(C=C(C=C1)B(O)O)Cl BP21277 [0,1,0,0,0,0|2,0,1]=4 46 B11R1.21 BrC1=C(C=C(C=C1)B(O)O)F BP20339 [0,1,0,0,0,0|2,0,1]=4 47 B11R1.21 BrC=1C=C(C=CC1C)B(O)O BP21173 [0,1,0,0,0,0|2,0,1]=4 48 B11R1.21 BrC=1C=C(C=CC1Cl)B(O)O BP21543 [0,1,0,0,0,0|2,0,1]=4 49 B11R1.21 BrC=1C=C(C=CC1F)B(O)O BP21205 [0,1,0,0,0,0|2,0,1]=4 50 B11R1.21 CC=1C=C(C=CC1C)B(O)O BP20066 [0,1,0,0,0,0|2,0,1]=4 51 B11R1.21 ClC1=C(C=C(C=C1)B(O)O)C BP20418 [0,1,0,0,0,0|2,0,1]=4 52 B11R1.21 ClC1=C(C=C(C=C1)B(O)O)F BP20106 [0,1,0,0,0,0|2,0,1]=4 53 B11R1.21 ClC=1C=C(C=CC1C)B(O)O BP20002 [0,1,0,0,0,0|2,0,1]=4 54 B11R1.21 ClC=1C=C(C=CC1Cl)B(O)O BP20063 [0,1,0,0,0,0|2,0,1]=4 55 B11R1.21 ClC=1C=C(C=CC1F)B(O)O BP20132 [0,1,0,0,0,0|2,0,1]=4 56 B11R1.21 ClC=1C=C(C=CC1O)B(O)O BP20795 [0,1,0,0,0,0|1,0,1]=3 57 B11R1.21 FC1=C(C=C(C=C1)B(O)O)C BP20244 [0,1,0,0,0,0|2,0,1]=4 58 B11R1.21 FC1=C(C=C(C=C1)B(O)O)O BP20793 [0,1,0,0,0,0|2,0,1]=4 59 B11R1.21 FC=1C=C(C(=O)O)C=CC1F BP22333 [0,1,0,0,0,0|1,0,0]=2 60 B11R1.21 FC=1C=C(C(=O)[O-])C=CC1F BP22334 [0,1,0,0,0,0|1,0,1]=3 61 B11R1.21 FC=1C=C(C=CC1C)B(O)O BP20309 [0,1,0,0,0,0|2,0,1]=4 62 B11R1.21 FC=1C=C(C=CC1F)B(O)O BP20064 [0,1,0,0,0,0|2,0,1]=4 63 B11R1.21 FC=1C=C(C=CC1F)B(O)O BP22418 [0,1,0,0,0,0|2,0,1]=4 64 B11R1.21 FC=1C=C(C=CC1O)B(O)O BP20396 [0,1,0,0,0,0|1,0,1]=3 65 B11R1.21 NC=1C=C(C=CC1C)B(O)O BP20323 [0,1,0,0,0,0|2,0,1]=4 66 B11R1.21 NC=1C=C(C=CC1C)B(O)O BP20324 [0,1,0,0,0,0|2,0,1]=4 67 B11R1.21 NC=1C=C(C=CC1Cl)B(O)O BP20322 [0,1,0,0,0,0|2,0,1]=4 68 B11R1.21 NC=1C=C(C=CC1Cl)B(O)O BP20833 [0,1,0,0,0,0|2,0,1]=4 69 B11R1.21 NC=1C=C(C=CC1Cl)B(O)O BP22211 [0,1,0,0,0,0|2,0,1]=4 70 B11R1.21 NC=1C=C(C=CC1F)B(O)O BP21922 [0,1,0,0,0,0|2,0,1]=4 71 B11R1.21 OC1=C(C=C(C=C1)B(O)O)C BP21580 [0,1,0,0,0,0|1,0,1]=3 72 B11R1.21 OC=1C=C(C=CC1C)B(O)O BP20594 [0,1,0,0,0,0|2,0,1]=4 73 B11R1.166 B(c1ccc(cc1C)Br)(O)O BP21464 [0,1,0,0,0,0|2,0,1]=4 74 B11R1.166 B(c1ccc(cc1C)O)(O)O BP20600 [0,1,0,0,0,0|1,0,1]=3 75 B11R1.166 B(c1ccc(cc1O)F)(O)O BP20394 [0,1,0,0,0,0|2,0,1]=4 76 B11R1.166 BrC1=C(C=CC(=C1)Cl)B(O)O BP21482 [0,1,0,0,0,0|2,0,1]=4 77 B11R1.166 BrC1=C(C=CC(=C1)F)B(O)O BP21278 [0,1,0,0,0,0|2,0,1]=4 78 B11R1.166 BrC1=CC(=C(C=C1)B(O)O)Cl BP21041 [0,1,0,0,0,0|2,0,1]=4 79 B11R1.166 BrC1=CC(=C(C=C1)B(O)O)F BP20356 [0,1,0,0,0,0|2,0,1]=4 80 B11R1.166 BrC1=CC(=C(C=C1)B(O)O)O BP21327 [0,1,0,0,0,0|2,0,1]=4 81 B11R1.166 CC1=C(C=CC(=C1)C)B(O)O BP20070 [0,1,0,0,0,0|2,0,1]=4 82 B11R1.166 ClC1=C(C(=O)O)C=CC(=N1)Cl BP22409 [0,1,0,0,0,0|2,0,0]=3 83 B11R1.166 ClC1=C(C=CC(=C1)C)B(O)O BP20127 [0,1,0,0,0,0|2,0,1]=4 84 B11R1.166 ClC1=C(C=CC(=C1)Cl)B(O)O BP20082 [0,1,0,0,0,0|2,0,1]=4 85 B11R1.166 ClC1=C(C=CC(=C1)F)B(O)O BP20007 [0,1,0,0,0,0|2,0,1]=4 86 B11R1.166 ClC1=C(C=CC(=C1)O)B(O)O BP20794 [0,1,0,0,0,0|1,0,1]=3 87 B11R1.166 ClC1=CC(=C(C=C1)B(O)O)C BP20105 [0,1,0,0,0,0|2,0,1]=4 88 B11R1.166 ClC1=CC(=C(C=C1)B(O)O)F BP20104 [0,1,0,0,0,0|2,0,1]=4 89 B11R1.166 FC1=C(C(=O)[O-])C=CC(=C1)F BP22329 [0,1,0,0,0,0|1,0,1]=3 90 B11R1.166 FC1=C(C=CC(=C1)C)B(O)O BP20260 [0,1,0,0,0,0|2,0,1]=4 91 B11R1.166 FC1=C(C=CC(=C1)F)B(O)O BP20083 [0,1,0,0,0,0|2,0,1]=4 92 B11R1.166 FC1=C(C=CC(=C1)O)B(O)O BP21300 [0,1,0,0,0,0|1,0,1]=3 93 B11R1.166 FC1=CC(=C(C=C1)B(O)O)C BP20243 [0,1,0,0,0,0|2,0,1]=4 94 B11R1.166 FC1=NC(=CC=C1C(=O)O)F BP22411 [0,1,0,0,0,0|2,0,0]=3 95 B11R1.166 OC1=C(C=CC(=C1)C)B(O)O BP21712 [0,1,0,0,0,0|2,0,1]=4 96 B11R2.34 ClC1=CC=C([C@@H]2CO2)C=C1 BP22553 [0,0,0,1,0,0|2,0,1]=4 97 B11R2.34 ClC1=CC=C([C@H]2CO2)C=C1 BP22554 [0,0,0,1,0,0|2,0,1]=4 98 B11R2.34 FC1=CC=C(C=C1)[C@H]2OC2 BP22560 [0,0,0,1,0,0|2,0,1]=4 99 B8R1.3 BrC1=CC=C(C=C1)I BP22374 [2,0,0,0,0,0|2,0,0]=4 100 B8R1.3 CC=1C=CC(=NC1)O BP22083 [2,0,0,0,0,0|1,0,1]=4 101 B10R1.61 BrC1=C(C=CC=C1)B(O)O BP20361 [1,1,0,0,0,0|1,0,1]=4 102 B10R1.61 CC1=C(C=CC=C1)B(O)O BP20264 [1,1,0,0,0,0|1,0,1]=4 103 B10R1.61 ClC1=C(C=CC=C1)B(O)O BP20128 [1,1,0,0,0,0|1,0,1]=4 104 B10R1.61 FC1=C(C=CC=C1)B(O)O BP20314 [1,1,0,0,0,0|1,0,1]=4 105 B10R1.61 IC1=C(C=CC=C1)B(O)O BP21024 [1,1,0,0,0,0|1,0,1]=4 106 B10R1.61 NC1=C(C=CC=C1)B(O)O BP21919 [1,1,0,0,0,0|1,0,1]=4 107 B10R1.61 OC1=C(C=CC=C1)B(O)O BP20524 [1,1,0,0,0,0|1,0,1]=4 108 B10R1.113 BrC=1C=C(C(=O)O)C=CC1 BP22394 [1,1,0,0,0,0|0,0,0]=2 109 B10R1.113 BrC=1C=C(C=CC1)B(O)O BP20197 [1,1,0,0,0,0|1,0,1]=4 110 B10R1.113 CC=1C=C(C=CC1)B(O)O BP20159 [1,1,0,0,0,0|1,0,1]=4 111 B10R1.113 ClC=1C=C(C=CC1)B(O)O BP20133 [1,1,0,0,0,0|1,0,1]=4 112 B10R1.113 FC=1C=C(C=CC1)B(O)O BP20298 [1,1,0,0,0,0|1,0,1]=4 113 B10R1.113 IC=1C=C(C=CC1)B(O)O BP20530 [1,1,0,0,0,0|1,0,1]=4 114 B10R1.113 NC=1C=C(C=CC1)B(O)O BP20023 [1,1,0,0,0,0|1,0,1]=4 115 B10R1.113 NC=1C=C(C=CC1)B(O)O BP20024 [1,1,0,0,0,0|1,0,1]=4 116 B10R1.113 NC=1C=C(C=CC1)B(O)O BP20027 [1,1,0,0,0,0|1,0,1]=4 117 B10R1.113 NC=1C=C(C=CC1)B(O)O BP21863 [1,1,0,0,0,0|1,0,1]=4 118 B10R1.113 OC=1C=C(C=CC1)B(O)O BP20269 [1,1,0,0,0,0|1,0,1]=4 119 B10R1.113 SC=1C=C(C=CC1)B(O)O BP22147 [1,1,0,0,0,0|1,0,1]=4 120 B12R1.48 B(c1ccc(c(c1)F)OC)(O)O BP20881 [0,2,0,0,0,0|1,0,1]=4 121 B12R1.48 BrC=1C=C(C=CC1OC)B(O)O BP21813 [0,2,0,0,0,0|1,0,1]=4 122 B12R1.48 COC1=C(C=C(C=C1)B(O)O)C BP20552 [0,2,0,0,0,0|1,0,1]=4 123 B12R1.48 ClC=1C=C(C=CC1CO)B(O)O BP21627 [0,2,0,0,0,0|1,0,1]=4 124 B12R1.48 ClC=1C=C(C=CC1OC)B(O)O BP20429 [0,2,0,0,0,0|1,0,1]=4 125 B12R1.48 FC=1C=C(C=CC1CO)B(O)O BP20991 [0,2,0,0,0,0|1,0,1]=4 126 B12R1.48 FC=1C=C(C=CC1OC)B(O)O BP20316 [0,2,0,0,0,0|1,0,1]=4 127 B12R1.48 NC=1C=C(C(=O)O)C=CC1OC BP22375 [0,2,0,0,0,0|0,0,0]=2 128 B12R1.48 OC=1C=C(C=CC1OC)B(O)O BP21818 [0,2,0,0,0,0|1,0,1]=4 129 B12R1.48 OCC1=C(C=C(C=C1)B(O)O)C BP20772 [0,2,0,0,0,0|1,0,1]=4 130 B12R1.113 C(C)OC1=CC=C(C=C1)B(O)O BP20286 [0,2,0,0,0,0|1,0,1]=4 131 B12R1.113 COCC1=CC=C(C=C1)B(O)O BP20573 [0,2,0,0,0,0|1,0,1]=4 132 B12R1.113 ON=CC1=CC=C(C=C1)B(O)O BP20760 [0,2,0,0,0,0|1,0,1]=4 133 B12R1.256 B(c1ccc(cc1)C(=O)Cl)(O)O BP20403 [0,2,0,0,0,0|1,0,0]=3 134 B12R1.256 C(=O)(O)C1=CC=C(C=C1)B(O)O BP20123 [0,2,0,0,0,0|0,0,0]=2 135 B12R1.256 C(C)(=O)C1=CC=C(C=C1)B(O)O BP20025 [0,2,0,0,0,0|1,0,0]=3 136 B12R1.256 C1(=CC=C(C=C1)B(O)O)B(O)O BP21898 [0,2,0,0,0,0|1,0,1]=4 137 B12R1.256 NC(=O)C1=CC=C(C=C1)B(O)O BP20026 [0,2,0,0,0,0|1,0,0]=3 138 B12R1.256 [N+](=O)([O-])C1=CC=C(C=C1)B(O)O BP22164 [0,2,0,0,0,0|1,0,1]=4 139 B12R1.452 BrC1=C(C=CC(=C1)OC)B(O)O BP21734 [0,2,0,0,0,0|1,0,1]=4 140 B12R1.452 COC1=CC(=C(C=C1)B(O)O)C BP20553 [0,2,0,0,0,0|1,0,1]=4 141 B12R1.452 ClC1=C(C=CC(=C1)OC)B(O)O BP20126 [0,2,0,0,0,0|1,0,1]=4 142 B12R1.452 FC1=C(C=CC(=C1)OC)B(O)O BP20510 [0,2,0,0,0,0|1,0,1]=4 143 B12R1.452 OCC1=CC(=C(C=C1)B(O)O)C BP21021 [0,2,0,0,0,0|1,0,1]=4 144 B12R1.56 C(=O)C=1C=C(C=CC1O)B(O)O BP21657 [0,2,0,0,0,0|1,0,1]=4 145 B12R1.56 OC1=C(C=C(C=C1)B(O)O)OC BP21645 [0,2,0,0,0,0|1,0,1]=4 146 B12R1.232 FC1=C(C(=O)O)C=C(C(=C1)F)F BP22340 [0,2,0,0,0,0|1,0,0]=3 147 B12R1.232 FC1=C(C=C(C(=C1)O)F)B(O)O BP21355 [0,2,0,0,0,0|1,0,1]=4 148 B12R1.893 FC1=C(C(=O)O)C=CC(=C1F)F BP22338 [0,2,0,0,0,0|1,0,0]=3 149 B12R1.893 FC1=C(C(=O)[O-])C=CC(=C1F)F BP22339 [0,2,0,0,0,0|1,0,1]=4 150 B12R1.893 FC1=C(C=CC(=C1F)O)B(O)O BP20977 [0,2,0,0,0,0|1,0,1]=4 151 B12R1.1005 CC=1C=C(C=C(C1O)C)B(O)O BP21092 [0,2,0,0,0,0|1,0,1]=4 152 B12R1.1005 ClC=1C=C(C=C(C1O)Cl)B(O)O BP21258 [0,2,0,0,0,0|1,0,1]=4 153 B12R1.1005 ClC=1C=C(C=C(C1O)F)B(O)O BP20883 [0,2,0,0,0,0|1,0,1]=4 154 B12R1.1005 FC=1C=C(C=C(C1O)F)B(O)O BP21221 [0,2,0,0,0,0|1,0,1]=4 155 B12R1.1000 FC1=C(C(=CC(=C1)O)F)B(O)O BP20909 [0,2,0,0,0,0|1,0,1]=4 156 B10R2.6 C1(=CC=CC=C1)[C@@H]2OC2 BP22549 [1,0,0,1,0,0|1,0,1]=4 157 B10R2.6 C1[C@@H](C2=CC=CC=C2)O1 BP22548 [1,0,0,1,0,0|1,0,1]=4 158 B10R1.18 C(C1=CC=CC=C1)B(O)O BP20214 [1,0,0,0,0,1|1,0,1]=4