0 B12R2.612 Cc1ccc2c(c1)CCC2=O BC218986 [0,0,0,0,0,0|3,0,1]=4 1 B12R2.612 c1cc2c(cc1Br)CCC2=O BC210245 [0,0,0,0,0,0|2,1,1]=4 2 B12R2.612 c1cc2c(cc1Cl)CCC2=O BC200429 [0,0,0,0,0,0|2,1,1]=4 3 B12R2.612 c1cc2c(cc1F)CCC2=O BC202173 [0,0,0,0,0,0|2,0,1]=3 4 B12R2.612 c1cc2c(cc1F)CC[C@@H]2N BC687899 [0,0,0,0,0,0|3,0,0]=3 5 B12R2.612 c1cc2c(cc1F)CC[C@H]2N BC687900 [0,0,0,0,0,0|3,0,0]=3 6 B12R2.612 c1cc2c(cc1N)CCC2=O BC219807 [0,0,0,0,0,0|3,0,1]=4 7 B12R2.612 c1cc2c(cc1O)CCC2=O BC200684 [0,0,0,0,0,0|3,0,1]=4 8 B11R2.1 CC1=CCc2c1cccc2 BC600789 [1,0,0,0,0,0|3,0,0]=4 9 B11R2.1 c1ccc2c(c1)CCC2=O BC210634 [1,0,0,0,0,0|2,0,1]=4 10 B11R2.1 c1ccc2c(c1)CCC2N BC228055 [1,0,0,0,0,0|3,0,0]=4 11 B11R2.1 c1ccc2c(c1)CCC2N BC653269 [1,0,0,0,0,0|3,0,0]=4 12 B11R2.1 c1ccc2c(c1)CC[C@@H]2N BC679090 [1,0,0,0,0,0|3,0,0]=4 13 B11R2.1 c1ccc2c(c1)c(c[nH]2)O BC676558 [1,0,0,0,0,0|3,0,0]=4 14 B11R2.1 c1ccc2c(c1)nnn2O BC204387 [1,0,0,0,0,0|3,0,0]=4 15 B11R2.1 c1ccc2c(c1)nnn2O BC675286 [1,0,0,0,0,0|3,0,0]=4 16 B11R2.36 c1cc(cc2c1cc[nH]2)F BC214939 [1,0,0,0,0,0|3,0,0]=4 17 B11R2.36 c1cc2c(cc1F)cn[nH]2 BC682098 [1,0,0,0,0,0|2,0,1]=4 18 B11R2.36 c1cc2c(cc1N)COC2 BC677010 [1,0,0,0,0,0|2,0,0]=3 19 B11R2.36 c1cc2c(cc[nH]2)cc1F BC200753 [1,0,0,0,0,0|2,0,1]=4 20 B11R2.36 c1cc2cn[nH]c2cc1F BC682097 [1,0,0,0,0,0|3,0,0]=4 21 B13R2.11634 c1c2c(cc(c1F)F)C(=O)CC2 BC218978 [0,1,0,0,0,0|2,0,1]=4 22 B11R1.22 COC(=O)c1ccc(cc1)Br BC215377 [0,0,1,0,0,0|1,1,1]=4 23 B11R1.22 COC(=O)c1ccc(cc1)I BC213654 [0,0,1,0,0,0|1,1,1]=4 24 B11R1.22 COC(=O)c1ccc(cc1)[O-] BC209217 [0,0,1,0,0,0|2,0,1]=4 25 B11R1.22 COC(=O)c1ccc(nc1)F BC219217 [0,0,1,0,0,0|2,0,1]=4 26 B11R1.37 COc1ccc(cc1CO)F BC679466 [0,0,1,0,0,0|2,0,0]=3 27 B11R1.37 c1cc(c(cc1F)CBr)C#N BC226690 [0,0,1,0,0,0|3,0,0]=4 28 B11R1.166 B(c1ccc(cc1C)O)(O)O BC678791 [0,0,1,0,0,0|1,0,0]=2 29 B11R1.166 B(c1ccc(cc1Cl)O)(O)O BC210282 [0,0,1,0,0,0|2,0,0]=3 30 B11R1.166 B(c1ccc(cc1F)Cl)(O)O BC250589 [0,0,1,0,0,0|1,1,0]=3 31 B11R1.166 B(c1ccc(cc1F)F)(O)O BC208385 [0,0,1,0,0,0|1,0,0]=2 32 B11R1.166 B(c1cnc(cc1C)Cl)(O)O BC645846 [0,0,1,0,0,0|1,1,0]=3 33 B11R1.166 Cc1c(ccc(n1)F)C(=O)O BC219214 [0,0,1,0,0,0|2,0,1]=4 34 B11R1.166 Cc1cc(ccc1C(=O)O)Cl BC227504 [0,0,1,0,0,0|1,1,1]=4 35 B11R1.166 Cc1cc(ccc1[N+](=O)[O-])F BC206757 [0,0,1,0,0,0|1,0,2]=4 36 B11R1.166 c1cc(c(cc1F)Br)C(=O)O BC206177 [0,0,1,0,0,0|2,0,1]=4 37 B11R1.166 c1cc(c(cc1F)N)C(=O)O BC204309 [0,0,1,0,0,0|2,0,1]=4 38 B11R1.166 c1cc(c(cc1F)O)C(=O)O BC201515 [0,0,1,0,0,0|2,0,1]=4 39 B13R2.5179 c1cc2c(cc1F)CCCC2=O BC216115 [0,0,0,0,0,1|2,0,1]=4 40 B10R1.1 COCc1ccc(cc1)O BC674868 [1,0,1,0,0,0|2,0,0]=4 41 B10R1.13 B(c1ccc(cc1)Br)(O)O BC685826 [1,0,1,0,0,0|0,1,0]=3 42 B10R1.13 B(c1ccc(cc1)C)(O)O BC210678 [1,0,1,0,0,0|1,0,0]=3 43 B10R1.13 B(c1ccc(cc1)Cl)(O)O BC677573 [1,0,1,0,0,0|0,1,0]=3 44 B10R1.13 B(c1ccc(cc1)F)(O)O BC227618 [1,0,1,0,0,0|0,0,0]=2 45 B10R1.13 B(c1ccc(cn1)C)(O)O BC210680 [1,0,1,0,0,0|2,0,0]=4 46 B10R1.13 B(c1ccc(nc1)Br)(O)O BC200364 [1,0,1,0,0,0|1,1,0]=4 47 B10R1.13 B(c1ccc(nc1)C)(O)O BC656202 [1,0,1,0,0,0|2,0,0]=4 48 B10R1.13 B(c1ccc(nc1)F)(O)O BC200359 [1,0,1,0,0,0|1,0,0]=3 49 B10R1.13 B(c1ccc(nc1)N)(O)O BC686183 [1,0,1,0,0,0|2,0,0]=4 50 B10R1.13 CC(=O)c1ccc(cc1)F BC204121 [1,0,1,0,0,0|1,0,1]=4 51 B10R1.10 c1cc(cc(c1)Br)CCO BC645716 [1,0,1,0,0,0|1,1,0]=4 52 B10R1.25 Cc1cc(ccc1C#N)F BC220197 [1,0,1,0,0,0|2,0,0]=4 53 B10R1.25 Cc1cc(ccc1C=O)F BC211665 [1,0,1,0,0,0|1,0,1]=4 54 B10R1.25 c1cc(c(cc1F)O)C=O BC215403 [1,0,1,0,0,0|1,0,1]=4 55 B10R1.30 c1cc(c(cc1Br)CO)F BC226996 [1,0,1,0,0,0|1,1,0]=4 56 B10R1.30 c1cc(c(cc1F)C=O)O BC215404 [1,0,1,0,0,0|0,0,2]=4 57 B10R1.30 c1cc(c(cc1F)CBr)F BC210966 [1,0,1,0,0,0|2,0,0]=4 58 B10R1.30 c1cc(c(cc1I)CO)Cl BC600271 [1,0,1,0,0,0|1,1,0]=4 59 B10R1.61 B(c1c(cccn1)C)(O)O BC225233 [1,0,1,0,0,0|1,0,0]=3 60 B10R1.61 B(c1c(cccn1)F)(O)O BC638939 [1,0,1,0,0,0|2,0,0]=4 61 B10R1.61 B(c1ccc[nH]c1=O)(O)O BC600160 [1,0,1,0,0,0|2,0,0]=4 62 B10R1.61 B(c1ccccc1C)(O)O BC210677 [1,0,1,0,0,0|0,0,0]=2 63 B10R1.61 B(c1cccnc1Cl)(O)O BC221865 [1,0,1,0,0,0|2,0,0]=4 64 B10R1.61 B(c1cccnc1F)(O)O BC200360 [1,0,1,0,0,0|2,0,0]=4 65 B10R1.61 B(c1ccncc1F)(O)O BC221864 [1,0,1,0,0,0|2,0,0]=4 66 B10R1.61 B(c1cnccc1C)(O)O BC684701 [1,0,1,0,0,0|1,0,0]=3 67 B10R1.61 Cc1ccccc1C(=O)O BC675262 [1,0,1,0,0,0|1,0,1]=4 68 B10R2.7 c1ccc2c(c1)CC=C2 BC218987 [2,0,0,0,0,0|2,0,0]=4 69 B10R2.7 c1ccc2c(c1)CCN2 BC219733 [2,0,0,0,0,0|2,0,0]=4 70 B10R2.7 c1ccc2c(c1)CCO2 BC207982 [2,0,0,0,0,0|2,0,0]=4 71 B10R2.7 c1ccc2c(c1)CNC2 BC217544 [2,0,0,0,0,0|2,0,0]=4 72 B10R2.7 c1ccc2c(c1)CNC2 BC682033 [2,0,0,0,0,0|2,0,0]=4 73 B12R1.452 B(c1ccc(cc1C)OC)(O)O BC210653 [0,1,1,0,0,0|1,0,0]=3 74 B12R1.452 B(c1ccc(cc1F)OC)(O)O BC222052 [0,1,1,0,0,0|2,0,0]=4 75 B12R1.1000 B(c1c(cc(cc1O)Cl)C)(O)O BC620158 [0,1,1,0,0,0|0,1,0]=3 76 B12R1.1000 Cc1cc(cc(c1C(=O)O)C)F BC658797 [0,1,1,0,0,0|1,0,1]=4 77 B12R2.18 c1ccc2c(c1)CC(C2O)Br BC676562 [1,1,0,0,0,0|2,0,0]=4 78 B12R2.2028 c1ccc2c(c1)C(OC2=O)Br BC220361 [1,1,0,0,0,0|1,0,1]=4 79 B12R2.2028 c1ccc2c(c1)C(OC2=O)Cl BC222347 [1,1,0,0,0,0|1,0,1]=4 80 B12R2.606 c1cc2c(cc1F)CC(=O)N2 BC220692 [1,1,0,0,0,0|2,0,0]=4 81 B12R3.12 c1ccc2c(c1)CC3C2O3 BC200720 [1,0,0,1,0,0|2,0,0]=4 82 B10R2.320 c1ccc2c(c1)CC2=O BC225121 [1,0,0,0,1,0|1,0,1]=4 83 B10R2.31 c1cc2c(cc1Br)CC2 BC201494 [1,0,0,0,1,0|1,1,0]=4 84 B10R2.31 c1cc2c(cc1N)CC2 BC225112 [1,0,0,0,1,0|2,0,0]=4 85 B12R1.233 Cc1cc(ccc1CC(=O)O)F BC676492 [0,0,1,0,0,1|1,0,1]=4