0 B11R1.3 B(c1ccc(cc1)CBr)(O)O LS10869 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.3 B(c1ccc(cc1)CC)(O)O LS10888 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.3 B(c1ccc(cc1)CO)(O)O LS10891 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.3 CC(=C)c1ccc(cc1)OC LS10061 [0,0,0,0,0,0|2,0,2]=4 4 B11R1.3 CN(C)c1ccc(cc1)C=O LS10650 [0,0,0,0,0,0|1,0,2]=3 5 B11R1.3 CN(C)c1ccc(cc1)OC LS10085 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.3 C[C@@H](c1ccc(cc1)OC)N LS30183 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.3 C[C@H](c1ccc(cc1)OC)N LS30182 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.3 c1cc(ccc1CCl)C(=O)O LS11536 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.3 c1cc(ccc1CO)[N+](=O)[O-] LS10721 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.3 c1cc(ccc1CCl)C#N LS11851 [1,0,0,0,0,0|2,0,1]=4 11 B10R1.3 c1cc(ccc1CCl)CCl LS11854 [1,0,0,0,0,0|2,0,0]=3 12 B10R1.13 B(c1ccc(cc1)C)(O)O LS00088 [1,0,0,0,0,0|3,0,0]=4 13 B10R1.13 B(c1ccc(cc1)O)(O)O LS10892 [1,0,0,0,0,0|3,0,0]=4 14 B10R1.13 CC(=O)c1ccc(cc1)Br LS11874 [1,0,0,0,0,0|2,0,1]=4 15 B10R1.13 CC(=O)c1ccc(cc1)F LS11575 [1,0,0,0,0,0|2,0,1]=4 16 B10R1.13 CC(=O)c1ccc(cc1)N LS10360 [1,0,0,0,0,0|2,0,1]=4 17 B10R1.13 CC(=O)c1ccc(cc1)O LS10359 [1,0,0,0,0,0|1,0,1]=3 18 B10R1.13 CN(C)c1ccc(cc1)Br LS10693 [1,0,0,0,0,0|2,0,0]=3 19 B10R1.13 CN(C)c1ccc(cc1)Cl LS10239 [1,0,0,0,0,0|2,0,0]=3 20 B12R1.5 COC(=O)c1ccc(cc1)CBr LS10680 [0,1,0,0,0,0|2,0,1]=4 21 B12R1.6 CC(C)(c1ccc(cc1)OC)O LS10171 [0,1,0,0,0,0|2,0,0]=3 22 B12R1.113 B(c1ccc(cc1)COC)(O)O LS10896 [0,1,0,0,0,0|3,0,0]=4 23 B12R1.113 c1cc(ccc1CCO)[N+](=O)[O-] LS10575 [0,1,0,0,0,0|3,0,0]=4 24 B12R1.256 B(c1ccc(cc1)C(=O)C)(O)O LS10863 [0,1,0,0,0,0|2,0,1]=4 25 B12R1.256 B(c1ccc(cc1)C(C)C)(O)O LS10905 [0,1,0,0,0,0|1,0,0]=2 26 B12R1.256 B(c1ccc(cc1)N(C)C)(O)O LS10883 [0,1,0,0,0,0|2,0,0]=3 27 B12R1.452 CN(C)c1ccc(cc1Cl)[N+]#N LS40442 [0,1,0,0,0,0|3,0,0]=4 28 B12R1.4 CCc1ccc(cc1)CC(=O)C LS10066 [0,0,0,0,0,1|2,0,1]=4 29 B9R1.1 CCc1ccc(cc1)F LS11765 [2,0,0,0,0,0|1,0,0]=3 30 B9R1.1 CCc1ccc(cn1)Br LS21179 [2,0,0,0,0,0|2,0,0]=4 31 B9R1.1 COc1ccc(cc1)O LS10474 [2,0,0,0,0,0|1,0,0]=3 32 B9R1.1 COc1ccc(cc1)S LS11831 [2,0,0,0,0,0|1,1,0]=4 33 B9R1.1 Cc1ccc(cc1)C#C LS10578 [2,0,0,0,0,0|0,0,2]=4 34 B9R1.1 Cc1ccc(cc1)CBr LS11264 [2,0,0,0,0,0|1,0,0]=3 35 B9R1.1 Cc1ccc(cc1)CN LS11220 [2,0,0,0,0,0|1,0,0]=3 36 B9R1.1 Cc1ccc(cc1)CO LS11273 [2,0,0,0,0,0|0,0,0]=2 37 B9R1.1 Cc1ccc(nc1)OC LS20323 [2,0,0,0,0,0|2,0,0]=4 38 B9R1.1 c1cc(ccc1CBr)Br LS11427 [2,0,0,0,0,0|2,0,0]=4 39 B9R1.1 c1cc(ccc1CBr)F LS10228 [2,0,0,0,0,0|2,0,0]=4 40 B9R1.1 c1cc(ccc1CBr)I LS11269 [2,0,0,0,0,0|2,0,0]=4 41 B9R1.1 c1cc(ccc1CCl)Cl LS11418 [2,0,0,0,0,0|2,0,0]=4 42 B9R1.1 c1cc(ccc1CO)I LS11275 [2,0,0,0,0,0|1,0,0]=3 43 B9R1.1 c1cc(ccc1CO)N LS10779 [2,0,0,0,0,0|1,0,0]=3 44 B9R1.1 c1cc(ncc1Br)CO LS20572 [2,0,0,0,0,0|2,0,0]=4 45 B9R1.1 c1cc(ncc1CO)N LS40930 [2,0,0,0,0,0|2,0,0]=4 46 B9R1.6 C[C@@H](c1ccccc1)N LS30171 [2,0,0,0,0,0|1,0,0]=3 47 B9R1.6 C[C@H](c1ccccc1)N LS30099 [2,0,0,0,0,0|1,0,0]=3 48 B11R1.279 COc1ccc(cc1Cl)CN LS10670 [1,1,0,0,0,0|2,0,0]=4 49 B11R1.19 CC(C)(C)c1ccc(cc1)Br LS11196 [1,1,0,0,0,0|1,0,0]=3 50 B11R1.19 CC(C)(c1ccc(cc1)Br)O LS11332 [1,1,0,0,0,0|1,0,0]=3 51 B11R1.19 c1cc(ccc1C(F)(F)F)O LS10322 [1,1,0,0,0,0|2,0,0]=4 52 B11R1.22 c1cc(ccc1C(CN)O)O LS41256 [1,1,0,0,0,0|1,0,0]=3 53 B11R1.166 CN(C)c1ccc(cc1Cl)Br LS10231 [1,1,0,0,0,0|2,0,0]=4 54 B11R1.166 Cc1cc(ccc1C(C)C)O LS10720 [1,1,0,0,0,0|0,0,0]=2 55 B13R1.585 B(c1ccc(cc1)OC(C)C)(O)O LS10903 [0,1,0,0,0,1|1,0,0]=3 56 B13R1.585 B(c1ccc(cc1)SC(C)C)(O)O LS10906 [0,1,0,0,0,1|1,0,0]=3 57 B13R1.537 C[C@H](c1ccc(cc1)C(=O)OC)N LS30135 [0,2,0,0,0,0|1,0,1]=4 58 B13R1.338 B(c1ccc(cc1)C(C)(C)C)(O)O LS10876 [0,2,0,0,0,0|1,0,0]=3 59 B13R1.338 B(c1ccc(cc1)C(C)(C)O)(O)O LS11333 [0,2,0,0,0,0|1,0,0]=3 60 B13R1.338 B(c1ccc(cc1)[Si](C)(C)C)(O)O LS10910 [0,2,0,0,0,0|1,1,0]=4 61 B11R1.20 Cc1ccc(cc1)CC(=O)C LS11261 [1,0,0,0,0,1|1,0,1]=4 62 B11R1.20 Cc1ccc(cc1)NC(=O)C LS11875 [1,0,0,0,0,1|1,0,1]=4