0 B9R1.35 Cc1cc([nH]n1)C(=O)O LS20817 [0,0,0,0,0,0|0,0,2]=2 1 B9R1.35 Cc1cc(n[nH]1)C(=O)O LS20295 [0,0,0,0,0,0|0,0,0]=0 2 B9R1.35 Cc1ccc(s1)C(=O)O LS20662 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.35 Cc1ncc(s1)C(=O)O LS21069 [0,0,0,0,0,0|2,0,1]=3 4 B9R1.35 Cc1nnc(o1)C(=O)[O-] LS40165 [0,0,0,0,0,0|1,0,2]=3 5 B9R1.35 c1c(csc1C(=O)O)Br LS20661 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.35 c1c(sc(n1)Br)C(=O)O LS21091 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.35 c1cc(sc1C(=O)O)Br LS20297 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.35 c1cc(sc1C(=O)O)Cl LS20472 [0,0,0,0,0,0|4,0,0]=4 9 B8R1.1 Cc1ccc(s1)C=O LS20392 [1,0,0,0,0,0|3,0,0]=4 10 B8R1.1 c1c(coc1C=O)Br LS20868 [1,0,0,0,0,0|3,0,0]=4 11 B8R1.1 c1c(csc1C=O)Br LS20660 [1,0,0,0,0,0|3,0,0]=4 12 B8R1.7 CC(=O)c1c[nH]cn1 LS20519 [1,0,0,0,0,0|3,0,0]=4 13 B8R1.7 CC(=O)c1cccs1 LS20643 [1,0,0,0,0,0|3,0,0]=4 14 B8R1.7 CC(=O)c1ccsc1 LS20391 [1,0,0,0,0,0|3,0,0]=4 15 B8R1.7 c1c(cn[nH]1)C(=O)O LS21130 [1,0,0,0,0,0|2,0,0]=3 16 B8R1.7 c1c(con1)C(=O)O LS20144 [1,0,0,0,0,0|2,0,1]=4 17 B8R1.7 c1c(nc[nH]1)C(=O)O LS20993 [1,0,0,0,0,0|2,0,0]=3 18 B8R1.7 c1c(nco1)C(=O)O LS41294 [1,0,0,0,0,0|2,0,0]=3 19 B8R1.7 c1c(ncs1)C(=O)N LS21083 [1,0,0,0,0,0|3,0,0]=4 20 B8R1.7 c1c(ncs1)C(=O)O LS21061 [1,0,0,0,0,0|2,0,0]=3 21 B8R1.7 c1c[nH]nc1[N+](=O)[O-] LS20161 [1,0,0,0,0,0|1,0,1]=3 22 B8R1.7 c1cc([nH]c1)C(=O)O LS20064 [1,0,0,0,0,0|1,0,1]=3 23 B8R1.7 c1cc(sc1)C(=O)Cl LS20650 [1,0,0,0,0,0|3,0,0]=4 24 B8R1.7 c1cc(sc1)C(=O)O LS20648 [1,0,0,0,0,0|2,0,0]=3 25 B8R1.7 c1cc(sc1)C(=O)[O-] LS21106 [1,0,0,0,0,0|2,0,1]=4 26 B8R1.7 c1cnc([nH]1)C(=O)O LS20563 [1,0,0,0,0,0|2,0,0]=3 27 B8R1.7 c1cnoc1C(=O)O LS20280 [1,0,0,0,0,0|1,0,1]=3 28 B8R1.7 c1conc1C(=O)O LS20146 [1,0,0,0,0,0|1,0,0]=2 29 B8R1.7 c1cscc1C(=O)Cl LS20651 [1,0,0,0,0,0|3,0,0]=4 30 B8R1.7 c1cscc1C(=O)O LS20647 [1,0,0,0,0,0|2,0,0]=3 31 B10R1.14 COC(=O)c1cc(c[nH]1)Br LS20815 [0,1,0,0,0,0|2,0,1]=4 32 B10R1.14 Cc1cnc(s1)C(=O)OC LS20100 [0,1,0,0,0,0|2,0,0]=3 33 B10R1.14 Cc1csc(n1)C(=O)OC LS40336 [0,1,0,0,0,0|3,0,0]=4 34 B10R1.14 Cn1cnc(n1)C(=O)OC LS20102 [0,1,0,0,0,0|3,0,0]=4 35 B10R1.55 Cc1cc(n[nH]1)C(F)(F)F LS20811 [0,1,0,0,0,0|2,0,1]=4 36 B10R1.58 Cc1cc(nn1C)C(=O)O LS20809 [0,1,0,0,0,0|0,0,0]=1 37 B10R1.59 Cc1cc(n(n1)C)C(=O)O LS20296 [0,1,0,0,0,0|0,0,2]=3 38 B10R1.13 CC(=O)c1ccc(cn1)Br LS20859 [0,0,0,0,0,1|3,0,0]=4 39 B10R1.13 Cc1ccc(cn1)C(=O)O LS20541 [0,0,0,0,0,1|1,0,1]=3 40 B10R1.13 Cc1ncc(cn1)C(=O)C LS20101 [0,0,0,0,0,1|2,0,1]=4 41 B10R1.13 Cc1ncc(cn1)C(=O)O LS20220 [0,0,0,0,0,1|1,0,1]=3 42 B10R1.13 c1c(cnc(n1)Cl)C(=O)O LS21033 [0,0,0,0,0,1|2,0,1]=4 43 B10R1.13 c1c(cnc(n1)N)C(=O)O LS20168 [0,0,0,0,0,1|2,0,1]=4 44 B10R1.13 c1c(ncc(n1)Cl)C(=O)O LS20205 [0,0,0,0,0,1|2,0,0]=3 45 B10R1.13 c1c(ncc(n1)O)C(=O)O LS20206 [0,0,0,0,0,1|2,0,0]=3 46 B10R1.13 c1cc(ccc1C(=O)O)Cl LS10674 [0,0,0,0,0,1|3,0,0]=4 47 B10R1.13 c1cc(ncc1Br)C(=O)O LS20244 [0,0,0,0,0,1|2,0,0]=3 48 B10R1.13 c1cc(ncc1C(=O)O)Cl LS20664 [0,0,0,0,0,1|2,0,1]=4 49 B10R1.13 c1cc(ncc1C(=O)O)N LS20730 [0,0,0,0,0,1|2,0,1]=4 50 B10R1.13 c1cc(ncc1F)C(=O)O LS20092 [0,0,0,0,0,1|2,0,0]=3 51 B10R1.113 Cc1ccnc(c1)C(=O)C LS21177 [0,0,0,0,0,1|2,0,0]=3 52 B10R1.113 c1c(cncc1Br)C(=O)O LS20729 [0,0,0,0,0,1|2,0,0]=3 53 B10R1.113 c1c(cncc1Cl)C(=O)O LS20728 [0,0,0,0,0,1|2,0,0]=3 54 B10R1.113 c1c(cncc1N)C(=O)O LS20110 [0,0,0,0,0,1|2,0,0]=3 55 B10R1.113 c1c(cncc1O)C(=O)O LS20727 [0,0,0,0,0,1|2,0,0]=3 56 B10R1.113 c1c(nc(cn1)Cl)C(=O)O LS20459 [0,0,0,0,0,1|3,0,0]=4 57 B10R1.113 c1c(ncnc1O)C(=O)O LS20104 [0,0,0,0,0,1|1,0,1]=3 58 B10R1.113 c1cnc(cc1C(=O)O)Br LS20245 [0,0,0,0,0,1|2,0,1]=4 59 B10R1.113 c1cnc(cc1C(=O)O)Cl LS20583 [0,0,0,0,0,1|2,0,1]=4 60 B10R1.113 c1cnc(cc1C(=O)O)F LS20410 [0,0,0,0,0,1|2,0,1]=4 61 B10R1.113 c1cnc(cc1C(=O)O)N LS20627 [0,0,0,0,0,1|2,0,1]=4 62 B10R1.113 c1cnc(cc1C(=O)O)O LS20483 [0,0,0,0,0,1|2,0,1]=4 63 B10R1.113 c1cnc(cc1Cl)C(=O)N LS20263 [0,0,0,0,0,1|3,0,0]=4 64 B7R1.1 c1c(nc[nH]1)C=O LS20992 [2,0,0,0,0,0|2,0,0]=4 65 B7R1.1 c1c(ncs1)C=O LS21128 [2,0,0,0,0,0|2,0,0]=4 66 B7R1.1 c1cc([nH]c1)C=O LS00119 [2,0,0,0,0,0|1,0,1]=4 67 B7R1.1 c1cc(sc1)C=O LS40350 [2,0,0,0,0,0|2,0,0]=4 68 B7R1.1 c1cnc([nH]1)C=O LS20564 [2,0,0,0,0,0|2,0,0]=4 69 B7R1.1 c1csc(n1)C=O LS20580 [2,0,0,0,0,0|2,0,0]=4 70 B7R1.1 c1cscc1C=O LS20646 [2,0,0,0,0,0|2,0,0]=4 71 B7R1.2 Cc1cc(no1)N LS21146 [2,0,0,0,0,0|2,0,0]=4 72 B7R1.2 c1c(n[nH]c1O)N LS20240 [2,0,0,0,0,0|2,0,0]=4 73 B9R1.11 COC(=O)c1c[nH]cn1 LS20049 [1,1,0,0,0,0|2,0,0]=4 74 B9R1.11 COC(=O)c1ccc[nH]1 LS20248 [1,1,0,0,0,0|1,0,1]=4 75 B9R1.41 Cc1ccsc1C(=O)O LS20659 [1,1,0,0,0,0|2,0,0]=4 76 B9R1.41 Cn1c(ccn1)C(=O)O LS20083 [1,1,0,0,0,0|0,0,2]=4 77 B9R1.41 c1(c(non1)N)C(=O)O LS20198 [1,1,0,0,0,0|2,0,0]=4 78 B9R1.41 c1csc(c1Br)C(=O)O LS20750 [1,1,0,0,0,0|2,0,0]=4 79 B9R1.41 c1csc(c1C(=O)O)Br LS20833 [1,1,0,0,0,0|2,0,0]=4 80 B9R1.41 c1csc(c1Cl)C(=O)O LS20749 [1,1,0,0,0,0|2,0,0]=4 81 B9R1.41 c1nc(c(s1)Br)C(=O)O LS21078 [1,1,0,0,0,0|2,0,0]=4 82 B11R1.3 COc1ccc(cc1)C(=O)O LS11457 [0,1,0,0,0,1|2,0,0]=4 83 B11R1.3 c1cc(ccc1CCl)C(=O)O LS11536 [0,1,0,0,0,1|2,0,0]=4 84 B11R1.21 Cc1ccc(cc1Br)C(=O)O LS10330 [0,1,0,0,0,1|2,0,0]=4 85 B11R1.21 Cc1ccc(cc1Cl)C(=O)O LS10663 [0,1,0,0,0,1|2,0,0]=4 86 B11R1.21 Cc1ccc(cc1F)C(=O)O LS10532 [0,1,0,0,0,1|2,0,0]=4 87 B11R1.22 Cc1ccc(cn1)C(=O)OC LS20731 [0,1,0,0,0,1|1,0,1]=4 88 B11R1.166 Cc1ccc(c(c1)F)C(=O)O LS10521 [0,1,0,0,0,1|2,0,0]=4 89 B11R1.166 Cc1ccc(c(n1)Cl)C(=O)O LS20787 [0,1,0,0,0,1|1,0,1]=4 90 B11R1.166 c1c(c(=O)[nH]c(=O)[nH]1)C(=O)O LS20799 [0,1,0,0,0,1|2,0,0]=4 91 B11R1.166 c1c(cnc(c1Br)C(=O)O)Br LS20021 [0,1,0,0,0,1|2,0,0]=4 92 B11R1.23 COC(=O)c1cc(ccn1)Cl LS20268 [0,1,0,0,0,1|2,0,0]=4 93 B11R1.23 COC(=O)c1cc(cnc1)Br LS20201 [0,1,0,0,0,1|2,0,0]=4 94 B11R1.74 Cc1cc(cc(c1)N)C(=O)O LS10247 [0,1,0,0,0,1|2,0,0]=4 95 B11R1.159 Cc1cccc(c1C)C(=O)O LS11825 [0,1,0,0,0,1|2,0,0]=4 96 B11R1.159 Cc1cccc(c1I)C(=O)O LS10145 [0,1,0,0,0,1|2,0,0]=4 97 B11R1.159 Cc1cccc(c1N)C(=O)O LS11462 [0,1,0,0,0,1|2,0,0]=4 98 B11R1.167 Cc1ccc(c(c1)C(=O)O)I LS10696 [0,1,0,0,0,1|2,0,0]=4 99 B11R1.167 c1c(cnc(c1C(=O)O)Cl)Br LS20228 [0,1,0,0,0,1|2,0,0]=4 100 B11R1.167 c1c(cnc(c1C(=O)O)Cl)Cl LS20422 [0,1,0,0,0,1|2,0,0]=4 101 B11R1.167 c1c(cnc(c1C(=O)O)O)Br LS20421 [0,1,0,0,0,1|2,0,0]=4 102 B11R1.266 COc1cccc(c1)C(=O)O LS11528 [0,1,0,0,0,1|2,0,0]=4 103 B11R1.15 CCOC(=O)c1cc(c[nH]1)C LS40876 [0,2,0,0,0,0|1,0,1]=4 104 B11R1.15 CCOC(=O)c1cc(n[nH]1)C LS20808 [0,2,0,0,0,0|0,0,2]=4 105 B9R1.6 c1cnc(cn1)C(=O)O LS20078 [0,0,1,1,0,0|2,0,0]=4 106 B9R1.2 Cc1cccc(c1)C=O LS11853 [1,0,0,0,0,1|2,0,0]=4 107 B9R1.2 c1c(cncc1Br)C=O LS20038 [1,0,0,0,0,1|2,0,0]=4 108 B9R1.13 c1c(nc[nH]1)CC(=O)O LS20933 [1,0,0,0,0,1|2,0,0]=4 109 B9R1.13 c1cc(oc1)CC(=O)O LS40055 [1,0,0,0,0,1|2,0,0]=4 110 B9R1.13 c1cc(sc1)CC(=O)O LS20649 [1,0,0,0,0,1|2,0,0]=4