0 B12R1.6 COc1ccc(cn1)S(=O)(=O)Cl AB28612 [0,0,0,0,0,0|4,0,0]=4 1 B12R1.6 COc1ccc(nc1)S(=O)(=O)Cl AB67571 [0,0,0,0,0,0|4,0,0]=4 2 B12R1.6 COc1cnc(cn1)S(=O)(=O)N AB76942 [0,0,0,0,0,0|4,0,0]=4 3 B12R1.6 CS(=O)(=O)c1ccc(cc1)C#C AB48499 [0,0,0,0,0,0|2,0,1]=3 4 B12R1.6 CS(=O)(=O)c1ccc(cc1)C=O AB04882 [0,0,0,0,0,0|2,0,1]=3 5 B12R1.6 CS(=O)(=O)c1ccc(cc1)CN AB23397 [0,0,0,0,0,0|1,0,0]=1 6 B12R1.6 CS(=O)(=O)c1ccc(nc1)CCl AB70206 [0,0,0,0,0,0|3,0,0]=3 7 B12R1.6 CS(=O)(=O)c1ccc(nc1)CN AB70205 [0,0,0,0,0,0|2,0,0]=2 8 B12R1.6 c1cc(ncc1C#N)S(=O)(=O)Cl AB60353 [0,0,0,0,0,0|2,0,2]=4 9 B12R1.6 c1cc(ncc1S(=O)(=O)Cl)C#N AB67428 [0,0,0,0,0,0|2,0,2]=4 10 B11R1.3 B(c1ccc(cc1)CN)(O)O AB09461 [1,0,0,0,0,0|1,0,2]=4 11 B11R1.3 CCc1ccc(cc1)C(=S)N AB23762 [1,0,0,0,0,0|2,1,0]=4 12 B11R1.3 COc1ccc(cc1)C(=O)N AB00908 [1,0,0,0,0,0|3,0,0]=4 13 B11R1.3 c1cc(ncc1C(=O)O)CN AB23462 [1,0,0,0,0,0|2,0,1]=4 14 B11R1.3 c1cc(ncc1[N+](=O)[O-])CN AB31865 [1,0,0,0,0,0|2,0,1]=4 15 B11R1.19 CS(=O)(=O)c1ccc(cc1)Br AB01453 [1,0,0,0,0,0|2,0,0]=3 16 B11R1.19 CS(=O)(=O)c1ccc(cc1)I AB07768 [1,0,0,0,0,0|2,0,0]=3 17 B11R1.19 CS(=O)(=O)c1ccc(cc1)N AB01467 [1,0,0,0,0,0|1,0,0]=2 18 B11R1.19 CS(=O)(=O)c1ccc(cc1)O AB02067 [1,0,0,0,0,0|2,0,0]=3 19 B11R1.19 CS(=O)(=O)c1ccc(cn1)Br MB03438 [1,0,0,0,0,0|3,0,0]=4 20 B11R1.19 CS(=O)(=O)c1ccc(nc1)Br MB03435 [1,0,0,0,0,0|3,0,0]=4 21 B11R1.19 Cc1ccc(cc1)C(C)(C)N AB45930 [1,0,0,0,0,0|3,0,0]=4 22 B11R1.19 Cc1ccc(cn1)S(=O)(=O)Cl AB64923 [1,0,0,0,0,0|2,0,0]=3 23 B11R1.19 Cc1ccc(nc1)S(=O)(=O)Cl AB28629 [1,0,0,0,0,0|2,0,0]=3 24 B11R1.19 c1cc(ccc1S(=O)(=O)N)Br AB02163 [1,0,0,0,0,0|1,0,0]=2 25 B11R1.19 c1cc(ncc1Br)S(=O)(=O)Cl AB28624 [1,0,0,0,0,0|3,0,0]=4 26 B11R1.19 c1cc(ncc1Br)S(=O)(=O)O MB13729 [1,0,0,0,0,0|3,0,0]=4 27 B11R1.19 c1cc(ncc1Cl)S(=O)(=O)Cl AB28625 [1,0,0,0,0,0|3,0,0]=4 28 B11R1.19 c1cc(ncc1F)S(=O)(=O)Cl AB67683 [1,0,0,0,0,0|3,0,0]=4 29 B11R1.19 c1cc(ncc1O)S(=O)(=O)N MB30380 [1,0,0,0,0,0|2,0,0]=3 30 B11R1.19 c1cc(ncc1S(=O)(=O)Cl)Br AB39249 [1,0,0,0,0,0|3,0,0]=4 31 B11R1.19 c1cc(ncc1S(=O)(=O)Cl)Cl PB32344 [1,0,0,0,0,0|3,0,0]=4 32 B11R1.19 c1cc(ncc1S(=O)(=O)O)Br MB03760 [1,0,0,0,0,0|3,0,0]=4 33 B13R1.38 CCc1ccc(cc1O)S(=O)(=O)N MB23832 [0,1,0,0,0,0|1,0,0]=2 34 B13R1.38 CNc1ccc(cc1O)S(=O)(=O)N MB34023 [0,1,0,0,0,0|2,0,0]=3 35 B13R1.38 CS(=O)(=O)c1ccc(c(c1)Cl)C=O PB27627 [0,1,0,0,0,0|2,0,1]=4 36 B13R1.38 CS(=O)(=O)c1ccc(c(c1)Cl)CO PB26171 [0,1,0,0,0,0|2,0,0]=3 37 B13R1.38 CSc1ccc(cc1O)S(=O)(=O)N MB27664 [0,1,0,0,0,0|2,0,0]=3 38 B13R1.38 c1cc(c(cc1S(=O)(=O)Cl)Cl)C#N AB52646 [0,1,0,0,0,0|1,0,2]=4 39 B13R1.38 c1cc(c(cc1S(=O)(=O)N)O)C#N MB35841 [0,1,0,0,0,0|0,0,2]=3 40 B13R1.38 c1cc(c(cc1S(=O)(=O)N)O)C=O MB37296 [0,1,0,0,0,0|1,0,1]=3 41 B13R1.96 CCc1ccc(c(c1)O)S(=O)(=O)N MB23807 [0,1,0,0,0,0|1,0,0]=2 42 B13R1.96 CNc1ccc(c(c1)O)S(=O)(=O)N MB33068 [0,1,0,0,0,0|2,0,0]=3 43 B13R1.96 COc1ccc(c(c1)O)S(=O)(=O)N MB29668 [0,1,0,0,0,0|2,0,0]=3 44 B13R1.96 CSc1ccc(c(c1)O)S(=O)(=O)N MB36096 [0,1,0,0,0,0|2,0,0]=3 45 B13R1.96 c1cc(c(cc1C#N)O)S(=O)(=O)N MB34741 [0,1,0,0,0,0|0,0,2]=3 46 B13R1.96 c1cc(c(cc1CN)O)S(=O)(=O)N MB26942 [0,1,0,0,0,0|0,0,0]=1 47 B13R1.140 CS(=O)(=O)c1ccc(cc1)CCBr AB65251 [0,1,0,0,0,0|2,0,0]=3 48 B13R1.140 CS(=O)(=O)c1ccc(cc1)CCN AB45420 [0,1,0,0,0,0|1,0,0]=2 49 B13R1.140 CS(=O)(=O)c1ccc(cc1)N=C=O AB74257 [0,1,0,0,0,0|2,0,1]=4 50 B13R1.338 B(c1ccc(cc1)S(=O)(=O)C)(O)O AB09317 [0,1,0,0,0,0|3,0,0]=4 51 B13R1.338 B(c1ccc(cc1)S(=O)(=O)N)(O)O AB26447 [0,1,0,0,0,0|2,0,0]=3 52 B13R1.338 CC(=O)c1ccc(cc1)S(=O)(=O)C AB01457 [0,1,0,0,0,0|2,0,1]=4 53 B13R1.338 CS(=O)(=O)c1ccc(cc1)C(=N)N AB09708 [0,1,0,0,0,0|1,0,1]=3 54 B13R1.4 c1cc(ccc1CS(=O)(=O)Cl)C=O AB69836 [0,0,0,0,0,1|2,0,1]=4 55 B10R1.3 CCc1ccc(cc1)NN AB10141 [2,0,0,0,0,0|2,0,0]=4 56 B10R1.3 c1cc(ccc1CN)CO AB23442 [2,0,0,0,0,0|1,0,1]=4 57 B10R1.13 Cc1ccc(cc1)C(=N)N AB01792 [2,0,0,0,0,0|2,0,0]=4 58 B10R1.13 Cc1ccc(cc1)C(=S)N AB04365 [2,0,0,0,0,0|1,1,0]=4 59 B10R1.13 c1cc(ccc1C(=N)N)N AB01119 [2,0,0,0,0,0|2,0,0]=4 60 B10R1.13 c1cc(ccc1C(=S)N)N AB01833 [2,0,0,0,0,0|1,1,0]=4 61 B10R1.28 c1cc(cnc1)S(=O)(=O)Cl AB15457 [2,0,0,0,0,0|2,0,0]=4 62 B10R1.28 c1cc(cnc1)S(=O)(=O)Cl PB34068 [2,0,0,0,0,0|2,0,0]=4 63 B10R1.28 c1ccnc(c1)S(=O)(=O)Cl AB09523 [2,0,0,0,0,0|2,0,0]=4 64 B10R1.28 c1ccnc(c1)S(=O)(=O)Cl AB14073 [2,0,0,0,0,0|2,0,0]=4 65 B10R1.28 c1ccnc(c1)S(=O)(=O)N PB16122 [2,0,0,0,0,0|1,0,0]=3 66 B10R1.28 c1cnccc1S(=O)(=O)N PB26859 [2,0,0,0,0,0|1,0,0]=3 67 B12R1.5 CCc1ccc(cc1)C(=O)C=O AB48659 [1,1,0,0,0,0|2,0,0]=4 68 B12R1.5 c1cc(ccc1CN)C(=O)C=O AB23361 [1,1,0,0,0,0|1,0,0]=3 69 B12R1.48 CCc1ccc(cc1O)C(=O)N MB23796 [1,1,0,0,0,0|2,0,0]=4 70 B12R1.48 c1cc(c(cc1C(=O)N)O)CN MB34020 [1,1,0,0,0,0|1,0,0]=3 71 B12R1.48 c1cc(c(cc1C(=O)O)O)CN MB25917 [1,1,0,0,0,0|1,0,1]=4 72 B12R1.48 c1cc(c(cc1[N+](=O)[O-])F)CN AB70444 [1,1,0,0,0,0|1,0,1]=4 73 B12R1.452 CCc1ccc(c(c1)O)C(=O)N MB23792 [1,1,0,0,0,0|2,0,0]=4 74 B12R1.452 c1cc(c(cc1CN)F)[N+](=O)[O-] AB70447 [1,1,0,0,0,0|1,0,1]=4 75 B12R1.452 c1cc(c(cc1CN)O)C(=O)N MB36467 [1,1,0,0,0,0|1,0,0]=3 76 B12R1.452 c1cc(c(cc1NN)Br)C(=O)N MB19783 [1,1,0,0,0,0|2,0,0]=4 77 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Br AB07914 [1,1,0,0,0,0|1,0,0]=3 78 B12R1.23 Cc1cc(ccc1Cl)S(=O)(=O)Cl PB20117 [1,1,0,0,0,0|2,0,0]=4 79 B12R1.23 Cc1cc(ccc1O)S(=O)(=O)N MB23364 [1,1,0,0,0,0|1,0,0]=3 80 B12R1.23 Cc1ccc(cc1Cl)S(=O)(=O)C PB26102 [1,1,0,0,0,0|1,0,0]=3 81 B12R1.23 Cc1ccc(cc1O)S(=O)(=O)N MB23422 [1,1,0,0,0,0|0,0,0]=2 82 B12R1.23 c1cc(c(cc1S(=O)(=O)N)Br)O MB37637 [1,1,0,0,0,0|1,0,0]=3 83 B12R1.23 c1cc(c(cc1S(=O)(=O)N)Cl)O MB26219 [1,1,0,0,0,0|1,0,0]=3 84 B12R1.23 c1cc(c(cc1S(=O)(=O)N)I)O MB36746 [1,1,0,0,0,0|1,0,0]=3 85 B12R1.23 c1cc(c(cc1S(=O)(=O)N)O)Cl MB33347 [1,1,0,0,0,0|1,0,0]=3 86 B12R1.23 c1cc(c(cc1S(=O)(=O)N)O)F MB28617 [1,1,0,0,0,0|1,0,0]=3 87 B12R1.23 c1cc(c(cc1S(=O)(=O)N)O)N MB01259 [1,1,0,0,0,0|0,0,0]=2 88 B12R1.126 Cc1cc(ccc1S(=O)(=O)N)Br MB05726 [1,1,0,0,0,0|1,0,0]=3 89 B12R1.126 Cc1cc(ccc1S(=O)(=O)N)O MB23403 [1,1,0,0,0,0|1,0,0]=3 90 B12R1.126 Cc1ccc(c(c1)O)S(=O)(=O)N MB23408 [1,1,0,0,0,0|0,0,0]=2 91 B12R1.126 c1cc(c(cc1Br)O)S(=O)(=O)N MB32192 [1,1,0,0,0,0|1,0,0]=3 92 B12R1.126 c1cc(c(cc1F)O)S(=O)(=O)N MB37180 [1,1,0,0,0,0|1,0,0]=3 93 B12R1.126 c1cc(c(cc1I)O)S(=O)(=O)N MB32990 [1,1,0,0,0,0|1,0,0]=3 94 B12R1.126 c1cc(c(cc1N)O)S(=O)(=O)N MB36626 [1,1,0,0,0,0|0,0,0]=2 95 B12R1.126 c1cc(c(cc1O)F)S(=O)(=O)N MB29075 [1,1,0,0,0,0|1,0,0]=3 96 B12R1.126 c1cc(c(cc1O)I)S(=O)(=O)N MB38609 [1,1,0,0,0,0|1,0,0]=3 97 B12R1.126 c1cc(c(cc1O)N)S(=O)(=O)N MB09968 [1,1,0,0,0,0|1,0,0]=3 98 B14R1.2311 CCc1ccc(c(c1)O)NS(=O)(=O)C MB23856 [0,1,0,0,0,1|2,0,0]=4 99 B14R1.2311 CS(=O)(=O)Nc1ccc(cc1O)CN MB34909 [0,1,0,0,0,1|1,0,0]=3 100 B14R1.3275 CCc1ccc(cc1O)NS(=O)(=O)C MB23828 [0,1,0,0,0,1|2,0,0]=4 101 B14R1.3275 CS(=O)(=O)Nc1ccc(c(c1)O)CN MB38745 [0,1,0,0,0,1|1,0,0]=3 102 B14R1.4227 CC(C)c1ccc(cc1O)S(=O)(=O)N MB22507 [0,2,0,0,0,0|1,0,0]=3 103 B14R1.4227 CN(C)c1ccc(cc1O)S(=O)(=O)N MB24811 [0,2,0,0,0,0|2,0,0]=4 104 B14R1.4227 c1cc(c(cc1S(=O)(=O)N)O)C(=O)N MB31381 [0,2,0,0,0,0|0,0,1]=3 105 B14R1.4227 c1cc(c(cc1S(=O)(=O)N)O)C(=O)O MB30690 [0,2,0,0,0,0|1,0,1]=4 106 B14R1.6039 CC(C)c1ccc(c(c1)O)S(=O)(=O)N MB22472 [0,2,0,0,0,0|1,0,0]=3 107 B14R1.6039 CN(C)c1ccc(c(c1)O)S(=O)(=O)N MB24784 [0,2,0,0,0,0|2,0,0]=4 108 B14R1.6039 c1cc(c(cc1C(=O)N)O)S(=O)(=O)N MB32495 [0,2,0,0,0,0|0,0,1]=3 109 B14R1.6039 c1cc(c(cc1C(=O)O)O)S(=O)(=O)N MB34681 [0,2,0,0,0,0|1,0,1]=4 110 B14R1.66 CS(=O)(=O)c1ccc(cc1)CCC=O AB70193 [0,2,0,0,0,0|2,0,0]=4 111 B14R1.66 CS(=O)(=O)c1ccc(cc1)CCCN AB55104 [0,2,0,0,0,0|1,0,0]=3 112 B14R1.719 CS(=O)(=O)c1ccc(cc1)C(=O)NN MB07492 [0,2,0,0,0,0|1,0,1]=4 113 B14R1.806 CS(=O)(=O)c1ccc(cc1)CC(=O)O AB04884 [0,2,0,0,0,0|2,0,0]=4 114 B14R1.307 B(c1ccc(cc1)S(=O)(=O)NC)(O)O AB26501 [0,2,0,0,0,0|2,0,0]=4 115 B12R1.228 c1cc(c(c(c1)S(=O)(=O)N)O)N MB25422 [0,0,1,1,0,0|1,0,1]=4 116 B14R2.3125 CS(=O)(=O)c1ccc2c(c1)N=CC2 AB17034 [0,1,0,1,0,0|1,0,1]=4 117 B14R2.3125 CS(=O)(=O)c1ccc2c(c1)N=NC2 AB65499 [0,1,0,1,0,0|1,0,1]=4 118 B10R1.55 Cc1ccc(s1)S(=O)(=O)Cl AB22770 [1,0,0,0,1,0|2,0,0]=4 119 B10R1.55 Cn1ccc(n1)S(=O)(=O)N CB11654 [1,0,0,0,1,0|2,0,0]=4 120 B12R1.4 c1cc(ccc1CC(=O)O)CN AB17066 [1,0,0,0,0,1|1,0,1]=4 121 B12R1.106 CS(=O)(=O)Nc1ccc(cc1)Br AB01521 [1,0,0,0,0,1|2,0,0]=4 122 B12R1.106 CS(=O)(=O)Nc1ccc(cc1)O MB01417 [1,0,0,0,0,1|2,0,0]=4 123 B12R1.106 c1cc(ccc1CS(=O)(=O)Cl)Br AB21352 [1,0,0,0,0,1|2,0,0]=4 124 B12R1.106 c1cc(ccc1CS(=O)(=O)Cl)Cl AB09400 [1,0,0,0,0,1|2,0,0]=4 125 B12R1.106 c1cc(ccc1CS(=O)(=O)Cl)F AB09405 [1,0,0,0,0,1|2,0,0]=4 126 B12R1.436 CS(=O)(=O)c1cccc(c1)CN AB23434 [0,0,0,0,1,1|1,0,0]=3