0 B13R2.369 c1ccc2cc(c(cc2c1)O)O BC213423 [0,0,0,0,0,0|1,0,1]=2 1 B12R2.24 Cc1cc2ccccc2cn1 BC225244 [1,0,0,0,0,0|3,0,0]=4 2 B12R2.24 Cc1ccc2ccccc2c1 BC208431 [1,0,0,0,0,0|2,0,0]=3 3 B12R2.24 Cc1ccc2cccnc2n1 BC250423 [1,0,0,0,0,0|3,0,0]=4 4 B12R2.24 Cc1ccc2ccncc2c1 BC679500 [1,0,0,0,0,0|3,0,0]=4 5 B12R2.24 Cc1ccc2cnccc2c1 BC679499 [1,0,0,0,0,0|3,0,0]=4 6 B12R2.24 c1cc(cc2c1ccnc2)Br BC679497 [1,0,0,0,0,0|3,0,0]=4 7 B12R2.24 c1cc(cc2c1ccnc2)Cl BC653667 [1,0,0,0,0,0|3,0,0]=4 8 B12R2.24 c1cc(cc2c1ccnc2)N BC653642 [1,0,0,0,0,0|3,0,0]=4 9 B12R2.24 c1cc(cc2c1ccnc2)O BC652998 [1,0,0,0,0,0|2,0,0]=3 10 B12R2.24 c1cc(nc2c1ccnc2)Br BC681966 [1,0,0,0,0,0|3,0,0]=4 11 B12R2.24 c1cc2c(ccc(n2)N)nc1 BC223637 [1,0,0,0,0,0|3,0,0]=4 12 B12R2.24 c1cc2cc(ccc2nc1)Br BC228637 [1,0,0,0,0,0|3,0,0]=4 13 B12R2.24 c1cc2cc(ccc2nc1)Cl BC667556 [1,0,0,0,0,0|3,0,0]=4 14 B12R2.24 c1cc2ccc(cc2nc1)Br BC228636 [1,0,0,0,0,0|3,0,0]=4 15 B12R2.24 c1cc2ccc(cc2nc1)N BC228639 [1,0,0,0,0,0|3,0,0]=4 16 B12R2.24 c1cc2ccc(cc2nc1)O BC224179 [1,0,0,0,0,0|2,0,0]=3 17 B12R2.24 c1cc2cnccc2cc1N BC677940 [1,0,0,0,0,0|3,0,0]=4 18 B12R2.24 c1ccc2c(c1)[nH]c(=O)cn2 BC681993 [1,0,0,0,0,0|2,0,0]=3 19 B12R2.24 c1ccc2c(c1)ccc(=O)[nH]2 BC211913 [1,0,0,0,0,0|1,0,0]=2 20 B12R2.24 c1ccc2c(c1)ccc(n2)N BC205864 [1,0,0,0,0,0|2,0,0]=3 21 B12R2.24 c1ccc2c(c1)ncc(n2)Br BC208014 [1,0,0,0,0,0|3,0,0]=4 22 B12R2.24 c1ccc2c(c1)ncc(n2)N BC682114 [1,0,0,0,0,0|3,0,0]=4 23 B12R2.24 c1ccc2cc(ccc2c1)Br BC228013 [1,0,0,0,0,0|2,0,0]=3 24 B12R2.24 c1ccc2cc(ccc2c1)Cl BC205581 [1,0,0,0,0,0|2,0,0]=3 25 B12R2.24 c1ccc2cc(ccc2c1)O BC676809 [1,0,0,0,0,0|1,0,0]=2 26 B12R2.24 c1ccc2cnc(cc2c1)Br BC679495 [1,0,0,0,0,0|3,0,0]=4 27 B12R1.43 C=C(Cc1ccccc1)C(=O)O BC220589 [0,0,1,0,0,0|1,0,1]=3 28 B12R1.43 c1ccc(cc1)CC(C(=O)O)O BC224313 [0,0,1,0,0,0|0,0,2]=3 29 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)O)Cl BC636160 [0,0,1,0,0,0|1,0,2]=4 30 B12R2.18 CN1c2ccccc2CC1=O BC207649 [0,0,0,0,1,0|3,0,0]=4 31 B12R2.18 c1ccc2c(c1)C(=O)C(=O)N2 BC679623 [0,0,0,0,1,0|1,0,1]=3 32 B12R2.18 c1ccc2c(c1)CC(C2=O)Br BC218981 [0,0,0,0,1,0|1,0,2]=4 33 B11R1.40 c1ccc(cc1)OC(=O)CBr BC200214 [1,0,1,0,0,0|1,0,1]=4 34 B11R1.91 c1cc(cnc1)\C=C\C(=O)O BC204442 [1,0,1,0,0,0|1,0,0]=3 35 B11R1.91 c1cc(cnc1)\C=C\C(=O)O BC630675 [1,0,1,0,0,0|1,0,0]=3 36 B11R1.91 c1ccc(cc1)\C=C\C(=O)Cl BC651782 [1,0,1,0,0,0|1,0,0]=3 37 B11R1.91 c1cnccc1\C=C\C(=O)O BC204449 [1,0,1,0,0,0|1,0,0]=3 38 B11R1.17 c1ccc(c(c1)\C=C\C=O)F BC245599 [1,0,1,0,0,0|1,0,0]=3 39 B11R1.86 c1ccc(c(c1)CC(=O)O)Br BC210254 [1,0,1,0,0,0|1,0,1]=4 40 B11R1.86 c1ccc(c(c1)CC(=O)O)Cl BC675213 [1,0,1,0,0,0|1,0,1]=4 41 B13R1.133 c1cc(ccc1C[C@@H](C(=O)O)O)O BC678252 [0,1,1,0,0,0|0,0,2]=4 42 B13R1.135 COC(=O)C(=C)Cc1ccccc1 BC214990 [0,1,1,0,0,0|1,0,1]=4 43 B13R2.32 c1ccc2c(c1)ccc(c2Br)O BC675519 [1,1,0,0,0,0|1,0,0]=3 44 B13R2.32 c1ccc2c(c1)ccc(c2F)Br BC678239 [1,1,0,0,0,0|2,0,0]=4 45 B13R2.57 C=Cc1ccc2ccccc2c1 BC221101 [1,1,0,0,0,0|2,0,0]=4 46 B13R2.57 COc1ccc2ccccc2n1 BC262285 [1,1,0,0,0,0|1,0,1]=4 47 B13R2.57 COc1ccc2ccncc2c1 BC213978 [1,1,0,0,0,0|2,0,0]=4 48 B13R2.57 c1cc2cc(ccc2nc1)C=O BC223299 [1,1,0,0,0,0|2,0,0]=4 49 B13R2.57 c1cc2cc(ccc2nc1)CO BC222337 [1,1,0,0,0,0|2,0,0]=4 50 B13R2.57 c1cc2ccc(cc2nc1)C=O BC228633 [1,1,0,0,0,0|2,0,0]=4 51 B13R2.57 c1ccc2c(c1)cc(cn2)C=O BC228631 [1,1,0,0,0,0|1,0,1]=4 52 B13R2.57 c1ccc2c(c1)ccc(n2)C=O BC228630 [1,1,0,0,0,0|1,0,0]=3 53 B13R2.57 c1ccc2cc(ccc2c1)C=O BC201281 [1,1,0,0,0,0|1,0,0]=3 54 B13R2.57 c1ccc2cc(ccc2c1)CN BC216805 [1,1,0,0,0,0|2,0,0]=4 55 B13R2.57 c1ccc2cc(ccc2c1)NN BC216595 [1,1,0,0,0,0|2,0,0]=4 56 B13R2.155 c1cc(cc2c1ccc(=O)[nH]2)O BC210094 [1,1,0,0,0,0|1,0,0]=3 57 B13R2.155 c1cc2c(cc1Br)[nH]c(=O)cn2 BC682141 [1,1,0,0,0,0|2,0,0]=4 58 B13R2.162 c1cc2ccc(cc2c(c1)N)O BC204478 [1,1,0,0,0,0|1,0,0]=3 59 B13R2.162 c1cc2ccc(nc2c(c1)O)O BC215774 [1,1,0,0,0,0|1,0,1]=4 60 B13R2.328 Cc1cc2ccccc2c(c1)N BC628686 [1,1,0,0,0,0|2,0,0]=4 61 B13R2.328 c1ccc2c(c1)c(cc(n2)Cl)Cl BC646084 [1,1,0,0,0,0|2,0,0]=4 62 B13R2.3683 Cc1ccc2c(c1)ccc(=O)o2 BC213745 [1,1,0,0,0,0|0,0,0]=2 63 B13R2.3683 c1cc(=O)[nH]c2c1cc(cc2)Br BC211915 [1,1,0,0,0,0|1,0,0]=3 64 B13R2.3683 c1cc(=O)[nH]c2c1cc(cc2)O BC205016 [1,1,0,0,0,0|1,0,0]=3 65 B13R2.3683 c1cc(cc2c1cc(cc2)Br)N BC652334 [1,1,0,0,0,0|2,0,0]=4 66 B13R2.3683 c1cc(cc2c1cc(cc2)O)O BC205136 [1,1,0,0,0,0|1,0,0]=3 67 B13R2.3683 c1cc(nc2c1cc(cc2)Br)Cl BC221744 [1,1,0,0,0,0|2,0,0]=4 68 B13R2.3683 c1cc(nc2c1cc(cc2)Cl)Br BC682149 [1,1,0,0,0,0|2,0,0]=4 69 B13R2.3683 c1cc(nc2c1cc(cc2)Cl)Cl BC202862 [1,1,0,0,0,0|2,0,0]=4 70 B13R2.3683 c1cc2c(cc1Cl)ncc(n2)O BC202271 [1,1,0,0,0,0|2,0,0]=4 71 B13R2.5179 Cc1ccc2c(cccc2n1)N BC215778 [1,1,0,0,0,0|2,0,0]=4 72 B13R2.5179 c1cc2c(ccc(n2)O)c(c1)O BC256294 [1,1,0,0,0,0|1,0,1]=4 73 B13R2.5179 c1cc2cc(ccc2c(c1)O)O BC204477 [1,1,0,0,0,0|1,0,0]=3 74 B13R2.135 c1ccc2c(c1)c(c([nH]2)Cl)C=O BC214094 [0,1,0,0,1,0|2,0,0]=4 75 B13R2.3028 c1cc2c(cc1I)C(=O)C(=O)N2 BC684696 [0,1,0,0,1,0|1,0,1]=4 76 B13R2.4825 Cc1cccc2c1NC(=O)C2=O BC645584 [0,1,0,0,1,0|1,0,1]=4 77 B13R2.4825 c1cc2c(c(c1)Br)NC(=O)C2=O BC645073 [0,1,0,0,1,0|1,0,1]=4 78 B13R2.4825 c1cc2c(c(c1)Cl)NC(=O)C2=O BC207010 [0,1,0,0,1,0|1,0,1]=4 79 B13R2.4825 c1cc2c(c(c1)F)NC(=O)C2=O BC206753 [0,1,0,0,1,0|1,0,1]=4 80 B13R2.4856 c1cc2c(c(c1)Br)C(=O)C(=O)N2 BC205626 [0,1,0,0,1,0|1,0,1]=4 81 B13R2.4856 c1cc2c(c(c1)Cl)C(=O)C(=O)N2 BC207639 [0,1,0,0,1,0|1,0,1]=4 82 B13R2.4856 c1cc2c(c(c1)F)C(=O)C(=O)N2 BC227879 [0,1,0,0,1,0|1,0,1]=4 83 B13R2.5190 c1cc2c(cc1Br)NC(=O)C2=O BC205625 [0,1,0,0,1,0|1,0,1]=4 84 B13R2.5190 c1cc2c(cc1Cl)NC(=O)C2=O BC210769 [0,1,0,0,1,0|1,0,1]=4 85 B13R2.5190 c1cc2c(cc1F)NC(=O)C2=O BC206704 [0,1,0,0,1,0|1,0,1]=4 86 B15R2.984 c1ccc2c(c1)cc(c(=O)[nH]2)C(=O)O BC204675 [0,2,0,0,0,0|1,0,0]=3 87 B15R2.984 c1ccc2cc(c(cc2c1)C(=O)O)O BC676778 [0,2,0,0,0,0|1,0,0]=3 88 B13R2.435 CC(=O)c1nc2ccccc2o1 BC210036 [0,0,1,1,0,0|2,0,0]=4 89 B13R2.435 c1ccc2c(c1)[nH]c(n2)C(=O)O BC677979 [0,0,1,1,0,0|2,0,0]=4 90 B13R2.435 c1ccc2c(c1)cc(s2)C(=O)O BC226986 [0,0,1,1,0,0|0,1,0]=3 91 B11R1.36 C=C(c1ccccc1)C(=O)O BC653116 [0,0,1,0,1,0|1,0,0]=3 92 B11R1.36 c1ccc(cc1)C(=O)C(=O)O BC215722 [0,0,1,0,1,0|0,0,1]=3 93 B11R1.36 c1ccc(cc1)C(C(=O)O)O BC204233 [0,0,1,0,1,0|0,0,1]=3 94 B11R1.36 c1ccc(cc1)C(C(=O)O)O BC250758 [0,0,1,0,1,0|0,0,1]=3 95 B11R1.36 c1ccc(cc1)[C@@H](C(=O)O)N BC675296 [0,0,1,0,1,0|1,0,1]=4 96 B11R1.36 c1ccc(cc1)[C@@H](C(=O)O)O BC677633 [0,0,1,0,1,0|0,0,1]=3 97 B11R2.1 CC1=CCc2c1cccc2 BC600789 [1,0,0,0,1,0|1,0,1]=4 98 B11R2.1 CC1C=Cc2c1cccc2 BC600788 [1,0,0,0,1,0|1,0,1]=4 99 B11R2.1 c1ccc2c(c1)C=CC2=O BC264695 [1,0,0,0,1,0|0,0,0]=2 100 B11R2.1 c1ccc2c(c1)CCC2=O BC210634 [1,0,0,0,1,0|0,0,2]=4 101 B11R2.1 c1ccc2c(c1)c(=O)[nH]s2 BC210059 [1,0,0,0,1,0|2,0,0]=4 102 B11R2.1 c1ccc2c(c1)c(c[nH]2)Br BC220142 [1,0,0,0,1,0|2,0,0]=4 103 B11R2.1 c1ccc2c(c1)c(c[nH]2)Cl BC678897 [1,0,0,0,1,0|2,0,0]=4 104 B11R2.1 c1ccc2c(c1)c(c[nH]2)O BC676558 [1,0,0,0,1,0|1,0,0]=3 105 B11R2.10 Cc1cc2ccccc2[nH]1 BC200996 [1,0,0,0,1,0|2,0,0]=4 106 B11R2.10 Cc1cc2ccccc2o1 BC600174 [1,0,0,0,1,0|1,0,0]=3 107 B11R2.10 Cc1cc2ccccc2o1 BC600186 [1,0,0,0,1,0|1,0,0]=3 108 B11R2.10 c1cc2c([nH]c(=O)o2)nc1 BC214905 [1,0,0,0,1,0|2,0,0]=4 109 B11R2.10 c1ccc2=NC(=O)N=c2c1 BC219990 [1,0,0,0,1,0|2,0,0]=4 110 B11R2.10 c1ccc2c(c1)CC(=O)C2 BC214987 [1,0,0,0,1,0|1,0,1]=4 111 B11R2.10 c1ccc2c(c1)[nH]c(=O)o2 BC200827 [1,0,0,0,1,0|1,0,0]=3 112 B11R2.10 c1ccn2c(c1)cc(n2)O BC638899 [1,0,0,0,1,0|2,0,0]=4 113 B11R2.36 c1cc(cc2c1cc[nH]2)O BC213327 [1,0,0,0,1,0|2,0,0]=4 114 B11R2.36 c1cc2c(cc[nH]2)cc1O BC201869 [1,0,0,0,1,0|2,0,0]=4 115 B13R1.348 c1ccc(cc1)NC(=O)CC(=O)O BC216422 [0,0,1,0,0,1|1,0,1]=4 116 B13R1.351 c1ccc(cc1)CCC(=O)C(=O)O BC216574 [0,0,1,0,0,1|0,0,2]=4