0 B10R1.113 CC(=O)c1cccc(c1)Cl A2Z00095936 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.113 CC(C)c1cccc(c1)O A2Z00093539 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.113 CN(C)c1cccc(c1)Br A2Z00097362 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.113 CN(C)c1cccc(c1)N A2Z00061693 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.113 Cc1cc(ccn1)C(=O)O A2Z00096178 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.113 Cc1cc(cnc1)C(=O)O A2Z00096067 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.113 c1c(cncc1N)C(=O)O A2Z00009581 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.113 c1c(nc[nH]c1=O)C(=O)O A2Z00094899 [0,0,0,0,0,0|2,0,1]=3 8 B10R1.113 c1c(ncnc1Cl)C(=O)Cl A2Z00095427 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.113 c1c(ncnc1Cl)C(=O)O A2Z00094900 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.113 c1cc(c[n+](c1)[O-])C(=O)N A2Z00098097 [0,0,0,0,0,0|2,0,1]=3 11 B10R1.113 c1cc(cc(c1)Br)[N+](=O)[O-] A2Z00097373 [0,0,0,0,0,0|2,0,1]=3 12 B10R1.113 c1cc(cc(c1)Cl)C(=O)Cl A2Z00095909 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.113 c1cc(cc(c1)Cl)C(=O)N A2Z00095951 [0,0,0,0,0,0|2,0,0]=2 14 B10R1.113 c1cc(cc(c1)F)C(=O)O A2Z00085462 [0,0,0,0,0,0|1,0,0]=1 15 B10R1.113 c1cc(cc(c1)N)C(=O)O A2Z00083929 [0,0,0,0,0,0|1,0,0]=1 16 B10R1.113 c1cc(nc(c1)Cl)C(=O)O A2Z00050531 [0,0,0,0,0,0|2,0,0]=2 17 B10R1.113 c1cnc(cc1Br)C(=O)O A2Z00009551 [0,0,0,0,0,0|2,0,0]=2 18 B10R1.113 c1cnc(cc1C(=O)O)Cl A2Z00096019 [0,0,0,0,0,0|2,0,0]=2 19 B10R1.113 c1cnc(cc1C(=O)O)O A2Z00096024 [0,0,0,0,0,0|1,0,0]=1 20 B10R1.113 c1cnc(cc1O)C(=O)O A2Z00009579 [0,0,0,0,0,0|1,0,0]=1 21 B10R1.113 c1cnc(cc1[N+](=O)[O-])Cl A2Z00029855 [0,0,0,0,0,0|3,0,1]=4 22 B9R1.2 CCc1cccc(c1)O A2Z00038644 [1,0,0,0,0,0|1,0,1]=3 23 B9R1.2 CNc1cccc(c1)O A2Z00057021 [1,0,0,0,0,0|2,0,0]=3 24 B9R1.2 COc1cccc(c1)O A2Z00093458 [1,0,0,0,0,0|2,0,0]=3 25 B9R1.2 c1cc(cc(c1)Br)ON A2Z00096321 [1,0,0,0,0,0|3,0,0]=4 26 B9R1.2 c1cc(cc(c1)Cl)C#N A2Z00095978 [1,0,0,0,0,0|2,0,1]=4 27 B9R1.2 c1cc(cc(c1)N)CN A2Z00095152 [1,0,0,0,0,0|2,0,1]=4 28 B9R1.2 c1cc(cc(c1)O)C=O A2Z00093516 [1,0,0,0,0,0|0,0,0]=1 29 B9R1.6 CC(=O)c1ccncc1 A2Z00096088 [1,0,0,0,0,0|2,0,0]=3 30 B9R1.6 CC(c1ccccc1)N A2Z00093463 [1,0,0,0,0,0|2,0,1]=4 31 B9R1.6 c1cc(cnc1)C(=O)Cl A2Z00046508 [1,0,0,0,0,0|2,0,0]=3 32 B9R1.6 c1ccc(cc1)C(=N)N A2Z00096156 [1,0,0,0,0,0|2,0,0]=3 33 B9R1.6 c1cnc(cn1)C(=O)O A2Z00085941 [1,0,0,0,0,0|2,0,0]=3 34 B9R1.6 c1cnccc1C(=S)N A2Z00098301 [1,0,0,0,0,0|2,1,0]=4 35 B11R1.21 CC(=O)c1ccc(c(c1)N)Cl A2Z00094298 [0,1,0,0,0,0|2,0,0]=3 36 B11R1.21 CC(=O)c1ccc(c(c1)O)Cl A2Z00049750 [0,1,0,0,0,0|1,0,0]=2 37 B11R1.21 Cc1cc(ccc1O)C(=O)C A2Z00094595 [0,1,0,0,0,0|2,0,0]=3 38 B11R1.21 Cc1ccc(cc1Br)[N+](=O)[O-] A2Z00097375 [0,1,0,0,0,0|2,0,1]=4 39 B11R1.21 Cc1ccc(cc1N)C(=O)C A2Z00048065 [0,1,0,0,0,0|2,0,0]=3 40 B11R1.21 Cc1ccc(cc1N)C(=O)O A2Z00094525 [0,1,0,0,0,0|1,0,0]=2 41 B11R1.21 Cn1c(=O)ccc(n1)C(=O)O A2Z00083657 [0,1,0,0,0,0|3,0,0]=4 42 B11R1.21 c1cc(c(cc1C(=O)O)Br)Cl A2Z00094869 [0,1,0,0,0,0|1,0,0]=2 43 B11R1.21 c1cc(c(cc1C(=O)O)Cl)Cl A2Z00093440 [0,1,0,0,0,0|1,0,0]=2 44 B11R1.21 c1cc(c(cc1C(=O)O)N)N A2Z00095962 [0,1,0,0,0,0|1,0,0]=2 45 B11R1.21 c1cc(c(cc1C(=O)O)N)O A2Z00098397 [0,1,0,0,0,0|1,0,0]=2 46 B11R1.21 c1cc(c(cc1C(=S)N)Cl)Cl A2Z00038406 [0,1,0,0,0,0|2,1,0]=4 47 B11R1.21 c1cc(c(cc1[N+](=O)[O-])I)N A2Z00050398 [0,1,0,0,0,0|2,0,1]=4 48 B11R1.21 c1cc(c(cc1[N+](=O)[O-])N)O A2Z00094098 [0,1,0,0,0,0|2,0,1]=4 49 B11R1.21 c1cc(c(cc1[N+](=O)[O-])O)Br A2Z00095943 [0,1,0,0,0,0|1,0,1]=3 50 B11R1.23 COC(=O)c1cccc(c1)N A2Z00095938 [0,1,0,0,0,0|1,0,0]=2 51 B11R1.23 Cc1cccc(c1)C(=O)NN A2Z00014683 [0,1,0,0,0,0|2,0,0]=3 52 B11R1.23 c1cc(cc(c1)Br)C(CO)N A2Z00049261 [0,1,0,0,0,0|2,0,1]=4 53 B11R1.23 c1cc(cc(c1)Cl)C(=O)CBr A2Z00096150 [0,1,0,0,0,0|2,0,0]=3 54 B11R1.23 c1cc(cc(c1)Cl)C(=O)CN A2Z00096028 [0,1,0,0,0,0|2,0,0]=3 55 B11R1.23 c1cc(cc(c1)Cl)C(=O)NN A2Z00014653 [0,1,0,0,0,0|2,0,0]=3 56 B11R1.23 c1cc(cc(c1)Cl)C(CN)O A2Z00094086 [0,1,0,0,0,0|2,0,1]=4 57 B11R1.23 c1cc(cc(c1)O)C(=O)NN A2Z00014681 [0,1,0,0,0,0|1,0,0]=2 58 B11R1.74 Cc1cc(cc(c1)Br)[N+](=O)[O-] A2Z00095308 [0,1,0,0,0,0|2,0,1]=4 59 B11R1.74 Cc1cc(nc(c1)C(=O)O)C A2Z00009586 [0,1,0,0,0,0|2,0,0]=3 60 B11R1.74 c1c(=O)[nH]c(nc1O)C(=O)O A2Z00049519 [0,1,0,0,0,0|2,0,0]=3 61 B11R1.74 c1c(cc(cc1Cl)Br)C(=O)O A2Z00094868 [0,1,0,0,0,0|1,0,0]=2 62 B11R1.74 c1c(cc(cc1F)Br)C(=O)O A2Z00094875 [0,1,0,0,0,0|1,0,0]=2 63 B11R1.74 c1c(cc(cc1O)O)C(=O)O A2Z00098105 [0,1,0,0,0,0|0,0,0]=1 64 B11R1.74 c1c(cc(nc1O)O)C(=O)O A2Z00096016 [0,1,0,0,0,0|1,0,0]=2 65 B11R1.155 CC(C)(c1cccc(c1)O)N A2Z00062456 [0,1,0,0,0,0|2,0,1]=4 66 B11R1.155 CC(C)(c1cccc(c1)O)O A2Z00049605 [0,1,0,0,0,0|1,0,1]=3 67 B11R1.155 Cc1cccc(c1)S(=O)(=O)Cl A2Z00095287 [0,1,0,0,0,0|2,0,1]=4 68 B11R1.155 c1cc(cc(c1)Cl)S(=O)(=O)Cl A2Z00094177 [0,1,0,0,0,0|2,0,1]=4 69 B11R1.159 Cc1c(cccc1O)[N+](=O)[O-] A2Z00094830 [0,1,0,0,0,0|1,0,1]=3 70 B11R1.159 Cn1cccc(c1=O)C(=O)O A2Z00095980 [0,1,0,0,0,0|2,0,0]=3 71 B11R1.159 c1cc(c(c(c1)Br)Cl)C(=O)O A2Z00097567 [0,1,0,0,0,0|1,0,0]=2 72 B11R1.159 c1cc(c(c(c1)Br)F)C(=O)O A2Z00097585 [0,1,0,0,0,0|1,0,0]=2 73 B11R1.159 c1cc(c(c(c1)Br)N)C(=O)O A2Z00097432 [0,1,0,0,0,0|1,0,0]=2 74 B11R1.159 c1cc(c(c(c1)Cl)N)C(=O)O A2Z00061682 [0,1,0,0,0,0|1,0,0]=2 75 B11R1.159 c1cc(c(c(c1)Cl)O)[N+](=O)[O-] A2Z00049909 [0,1,0,0,0,0|2,0,1]=4 76 B11R1.159 c1cc(c(c(c1)F)Br)C(=O)O A2Z00096365 [0,1,0,0,0,0|1,0,0]=2 77 B11R1.159 c1cc(c(c(c1)F)N)C(=O)O A2Z00097431 [0,1,0,0,0,0|1,0,0]=2 78 B11R1.159 c1cc(c(c(c1)O)N)[N+](=O)[O-] A2Z00098038 [0,1,0,0,0,0|1,0,1]=3 79 B11R1.159 c1cc(c(c(c1)[N+](=O)[O-])O)N A2Z00046655 [0,1,0,0,0,0|2,0,1]=4 80 B11R1.167 CC(=O)c1cc(ccc1Cl)O A2Z00049751 [0,1,0,0,0,0|1,0,0]=2 81 B11R1.167 CC(=O)c1cc(ccc1O)O A2Z00067510 [0,1,0,0,0,0|1,0,0]=2 82 B11R1.167 Cc1cc(c(nn1)O)C(=O)O A2Z00049871 [0,1,0,0,0,0|3,0,0]=4 83 B11R1.167 Cc1ccc(c(c1)C(=O)C)O A2Z00093755 [0,1,0,0,0,0|2,0,0]=3 84 B11R1.167 Cc1ccc(c(c1)C(=O)O)Br A2Z00097370 [0,1,0,0,0,0|1,0,0]=2 85 B11R1.167 Cc1ccc(c(c1)C(=O)O)C A2Z00083135 [0,1,0,0,0,0|1,0,0]=2 86 B11R1.167 Cc1ccc(c(c1)[N+](=O)[O-])Br A2Z00096942 [0,1,0,0,0,0|2,0,1]=4 87 B11R1.167 c1c(c(c[nH]c1=O)Br)C(=O)O A2Z00050240 [0,1,0,0,0,0|1,0,1]=3 88 B11R1.167 c1cc(c(cc1Br)C(=O)O)Cl A2Z00094857 [0,1,0,0,0,0|1,0,0]=2 89 B11R1.167 c1cc(c(cc1Br)C(=O)O)N A2Z00097335 [0,1,0,0,0,0|1,0,0]=2 90 B11R1.167 c1cc(c(cc1Br)C(=S)N)O A2Z00038547 [0,1,0,0,0,0|2,1,0]=4 91 B11R1.167 c1cc(c(cc1Br)[N+](=O)[O-])N A2Z00097427 [0,1,0,0,0,0|2,0,1]=4 92 B11R1.167 c1cc(c(cc1Cl)C(=O)O)O A2Z00096863 [0,1,0,0,0,0|1,0,0]=2 93 B11R1.167 c1cc(c(cc1F)[N+](=O)[O-])N A2Z00068291 [0,1,0,0,0,0|2,0,1]=4 94 B11R1.266 B(c1cccc(c1)C=O)(O)O A2Z00009570 [0,1,0,0,0,0|1,0,2]=4 95 B11R1.266 B(c1cccc(c1)OC)(O)O A2Z00097332 [0,1,0,0,0,0|1,0,1]=3 96 B11R1.266 COc1cccc(c1)C(=O)N A2Z00094313 [0,1,0,0,0,0|1,0,0]=2 97 B11R1.266 COc1cccc(c1)C(=O)O A2Z00078098 [0,1,0,0,0,0|0,0,0]=1 98 B11R1.266 COc1cccc(c1)C(=S)N A2Z00095185 [0,1,0,0,0,0|1,1,0]=3 99 B11R1.266 c1cc(cc(c1)C(=O)O)C#N A2Z00097495 [0,1,0,0,0,0|1,0,0]=2 100 B11R1.266 c1cc(cc(c1)C(=O)O)CBr A2Z00069073 [0,1,0,0,0,0|1,0,0]=2 101 B11R1.266 c1cnc(cc1C(=O)O)CN A2Z00096227 [0,1,0,0,0,0|2,0,0]=3 102 B9R1.35 CC(=O)c1ccc(o1)Br A2Z00062313 [0,0,0,0,1,0|3,0,0]=4 103 B9R1.35 Cc1cc(n[nH]1)C(=O)O A2Z00046525 [0,0,0,0,1,0|3,0,0]=4 104 B9R1.35 Cc1cc(ns1)C(=O)O A2Z00050333 [0,0,0,0,1,0|3,0,0]=4 105 B9R1.35 Cc1cnc(o1)C(=O)O A2Z00050346 [0,0,0,0,1,0|3,0,0]=4 106 B9R1.35 Cc1ncc(s1)C(=O)O A2Z00073992 [0,0,0,0,1,0|3,0,0]=4 107 B9R1.35 c1c([nH][nH]c1=O)C(=O)O A2Z00050177 [0,0,0,0,1,0|2,0,1]=4 108 B9R1.35 c1c([nH]nc1O)C(=O)O A2Z00050449 [0,0,0,0,1,0|2,0,0]=3 109 B9R1.35 c1c(n[nH]c1O)C(=O)O A2Z00096273 [0,0,0,0,1,0|2,0,0]=3 110 B9R1.35 c1c(nc(s1)Cl)C(=O)O A2Z00085550 [0,0,0,0,1,0|3,0,0]=4 111 B9R1.35 c1c(nc(s1)N)C(=O)O A2Z00085471 [0,0,0,0,1,0|3,0,0]=4 112 B9R1.35 c1cc(oc1C(=O)O)Br A2Z00033998 [0,0,0,0,1,0|2,0,0]=3 113 B9R1.35 c1cc(sc1C(=O)O)Cl A2Z00095939 [0,0,0,0,1,0|2,0,0]=3 114 B9R1.41 Cc1c(cn[nH]1)C(=O)O A2Z00085440 [0,0,0,0,1,0|3,0,0]=4 115 B9R1.41 Cc1c(ocn1)C(=O)O A2Z00049433 [0,0,0,0,1,0|3,0,0]=4 116 B9R1.41 Cc1ccsc1C(=O)O A2Z00095998 [0,0,0,0,1,0|2,0,0]=3 117 B9R1.41 Cn1c(ccn1)C(=O)O A2Z00096177 [0,0,0,0,1,0|3,0,0]=4 118 B9R1.41 c1csc(c1O)C(=O)N A2Z00061416 [0,0,0,0,1,0|2,0,0]=3 119 B11R1.157 CC(=O)Cc1cccc(c1)Br A2Z00095995 [0,0,0,0,0,1|2,0,0]=3 120 B11R1.157 CC(=O)Nc1ccnc(c1)Cl A2Z00029852 [0,0,0,0,0,1|3,0,0]=4 121 B11R1.157 CN(C)Cc1cccc(c1)O A2Z00049745 [0,0,0,0,0,1|3,0,0]=4 122 B11R1.157 Cc1cccc(c1)CC(=O)C A2Z00046562 [0,0,0,0,0,1|2,0,0]=3 123 B8R1.2 CSc1ccccc1 A2Z00096090 [2,0,0,0,0,0|2,0,0]=4 124 B8R1.2 c1ccc(cc1)CN A2Z00095042 [2,0,0,0,0,0|1,0,1]=4 125 B8R1.4 Cc1cc[nH]c(=O)c1 A2Z00069805 [2,0,0,0,0,0|2,0,0]=4 126 B8R1.4 Cc1cccc(c1)Cl A2Z00093526 [2,0,0,0,0,0|1,0,1]=4 127 B8R1.4 c1cc(cc(c1)O)N A2Z00068658 [2,0,0,0,0,0|1,0,0]=3 128 B10R1.2 c1cc(c(c(c1)F)Br)CO A2Z00096539 [1,1,0,0,0,0|1,0,1]=4 129 B10R1.8 c1c(cc(cc1Cl)Cl)CO A2Z00097425 [1,1,0,0,0,0|1,0,1]=4 130 B10R1.8 c1c(cc(cc1F)F)C=O A2Z00097424 [1,1,0,0,0,0|1,0,0]=3 131 B10R1.10 CNCc1cccc(c1)O A2Z00038697 [1,1,0,0,0,0|1,0,1]=4 132 B10R1.30 CSc1cc(ccc1N)O A2Z00095086 [1,1,0,0,0,0|2,0,0]=4 133 B10R1.30 c1cc(c(cc1Br)C=O)F A2Z00096146 [1,1,0,0,0,0|1,0,0]=3 134 B10R1.30 c1cc(c(cc1Br)C=O)O A2Z00055341 [1,1,0,0,0,0|1,0,0]=3 135 B10R1.176 Cc1cc(ccc1O)N=O A2Z00061535 [1,1,0,0,0,0|2,0,0]=4 136 B10R1.176 c1cc(c(cc1C=O)Cl)F A2Z00097417 [1,1,0,0,0,0|1,0,0]=3 137 B10R1.176 c1cc(c(cc1C=O)O)O A2Z00036666 [1,1,0,0,0,0|0,0,0]=2 138 B10R1.13 CC(=O)c1ccc(cc1)Cl A2Z00038583 [1,1,0,0,0,0|1,0,0]=3 139 B10R1.13 Cc1ccc(cc1)C(=O)O A2Z00030670 [1,1,0,0,0,0|0,0,0]=2 140 B10R1.13 Cc1ccc(cc1)C(=S)N A2Z00038400 [1,1,0,0,0,0|1,1,0]=4 141 B10R1.13 Cc1cnc(cn1)C(=O)O A2Z00096093 [1,1,0,0,0,0|2,0,0]=4 142 B10R1.13 c1c(ncc(n1)Br)C(=O)O A2Z00050258 [1,1,0,0,0,0|2,0,0]=4 143 B10R1.13 c1c(ncc(n1)O)C(=O)O A2Z00096301 [1,1,0,0,0,0|2,0,0]=4 144 B10R1.13 c1cc(=O)[nH]cc1C(=O)O A2Z00094278 [1,1,0,0,0,0|1,0,0]=3 145 B10R1.13 c1cc(=O)[nH]nc1C(=O)O A2Z00083465 [1,1,0,0,0,0|2,0,0]=4 146 B10R1.13 c1cc(ccc1C(=N)N)Cl A2Z00098490 [1,1,0,0,0,0|2,0,0]=4 147 B10R1.13 c1cc(ccc1C(=N)N)N A2Z00050462 [1,1,0,0,0,0|2,0,0]=4 148 B10R1.13 c1cc(ccc1C(=N)N)O A2Z00070221 [1,1,0,0,0,0|2,0,0]=4 149 B10R1.13 c1cc(ccc1C(=O)N)Br A2Z00038699 [1,1,0,0,0,0|1,0,0]=3 150 B10R1.13 c1cc(ccc1C(=O)N)O A2Z00093462 [1,1,0,0,0,0|1,0,0]=3 151 B10R1.13 c1cc(ccc1C(=O)O)Br A2Z00093455 [1,1,0,0,0,0|0,0,0]=2 152 B10R1.13 c1cc(ccc1C(=O)O)F A2Z00038620 [1,1,0,0,0,0|0,0,0]=2 153 B10R1.13 c1cc(ccc1C(=O)O)N A2Z00093468 [1,1,0,0,0,0|0,0,0]=2 154 B10R1.13 c1cc(ccc1C(=S)N)Br A2Z00085460 [1,1,0,0,0,0|1,1,0]=4 155 B10R1.13 c1cc(ccc1C(=S)N)Cl A2Z00038403 [1,1,0,0,0,0|1,1,0]=4 156 B10R1.13 c1cc(ccc1C(=S)N)F A2Z00093909 [1,1,0,0,0,0|1,1,0]=4 157 B10R1.13 c1cc(ccc1S(=O)Cl)Cl A2Z00049702 [1,1,0,0,0,0|2,0,0]=4 158 B10R1.13 c1cc(ccc1[N+](=O)[O-])Cl A2Z00093555 [1,1,0,0,0,0|1,0,1]=4 159 B10R1.13 c1cc(ncc1C(=O)O)Cl A2Z00096110 [1,1,0,0,0,0|1,0,0]=3 160 B10R1.13 c1cc(nnc1C(=O)O)Cl A2Z00049654 [1,1,0,0,0,0|2,0,0]=4 161 B10R1.15 CC(c1ccccc1)NO A2Z00047942 [1,1,0,0,0,0|1,0,1]=4 162 B10R1.15 c1cc(cnc1)C(=O)CBr A2Z00094983 [1,1,0,0,0,0|2,0,0]=4 163 B10R1.15 c1ccc(cc1)C(=O)C=O A2Z00094839 [1,1,0,0,0,0|0,0,1]=3 164 B10R1.61 CC(=O)c1ccncc1F A2Z00096478 [1,1,0,0,0,0|2,0,0]=4 165 B10R1.61 Cc1ccccc1C(=O)N A2Z00085447 [1,1,0,0,0,0|1,0,0]=3 166 B10R1.61 c1c(c(ncn1)C(=O)O)Br A2Z00068773 [1,1,0,0,0,0|2,0,0]=4 167 B10R1.61 c1cc(c(=O)[nH]c1)C(=O)O A2Z00085542 [1,1,0,0,0,0|1,0,0]=3 168 B10R1.61 c1cc(c(nc1)Cl)C(=O)O A2Z00050195 [1,1,0,0,0,0|1,0,0]=3 169 B10R1.61 c1ccc(c(c1)C(=N)N)F A2Z00074261 [1,1,0,0,0,0|2,0,0]=4 170 B10R1.61 c1ccc(c(c1)C(=O)N)O A2Z00062157 [1,1,0,0,0,0|1,0,0]=3 171 B10R1.61 c1ccc(c(c1)C(=O)O)Br A2Z00093939 [1,1,0,0,0,0|0,0,0]=2 172 B10R1.61 c1ccc(c(c1)C(=O)O)F A2Z00093478 [1,1,0,0,0,0|0,0,0]=2 173 B10R1.61 c1ccc(c(c1)C(=O)O)I A2Z00093586 [1,1,0,0,0,0|0,0,0]=2 174 B10R1.61 c1ccc(c(c1)C(=O)O)N A2Z00070269 [1,1,0,0,0,0|0,0,0]=2 175 B10R1.61 c1ccc(c(c1)C(=O)O)O A2Z00038631 [1,1,0,0,0,0|0,0,0]=2 176 B10R1.61 c1ccc(c(c1)C(=S)N)Cl A2Z00098305 [1,1,0,0,0,0|1,1,0]=4 177 B10R1.61 c1ccc(c(c1)C(=S)N)F A2Z00038401 [1,1,0,0,0,0|1,1,0]=4 178 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])Cl A2Z00093554 [1,1,0,0,0,0|1,0,1]=4 179 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])O A2Z00034985 [1,1,0,0,0,0|1,0,1]=4 180 B10R1.14 COC(=O)c1ccc(o1)Br A2Z00095435 [0,1,0,0,1,0|2,0,0]=4 181 B10R1.31 c1c(c[nH]c1C(=O)O)C=O A2Z00096179 [0,1,0,0,1,0|1,0,1]=4 182 B10R1.31 c1cc([nH]c1C=O)C(=O)O A2Z00096160 [0,1,0,0,1,0|1,0,1]=4 183 B10R1.31 c1cc(oc1C#N)C(=O)O A2Z00048029 [0,1,0,0,1,0|2,0,0]=4 184 B10R1.31 c1cc(oc1C=O)C(=O)O A2Z00094670 [0,1,0,0,1,0|1,0,1]=4 185 B10R1.58 c1c(c(sc1C(=O)O)Br)Br A2Z00080716 [0,1,0,0,1,0|2,0,0]=4 186 B10R1.149 COC(=O)c1c(ccs1)N A2Z00096109 [0,1,0,0,1,0|2,0,0]=4 187 B10R1.149 COC(=O)c1c(ccs1)O A2Z00061415 [0,1,0,0,1,0|1,0,0]=3 188 B10R1.149 Cc1ccsc1C(=O)OC A2Z00095997 [0,1,0,0,1,0|2,0,0]=4 189 B10R1.192 Cc1coc(c1C(=O)O)C A2Z00096172 [0,1,0,0,1,0|2,0,0]=4 190 B12R1.19 Cc1ccc(cc1Br)CC(=O)O A2Z00049493 [0,1,0,0,0,1|1,0,0]=3 191 B12R1.50 Cc1cccc(c1)NC(=O)CN A2Z00044975 [0,1,0,0,0,1|2,0,0]=4 192 B12R1.50 Cc1cccc(c1)NC(=O)CO A2Z00068360 [0,1,0,0,0,1|1,0,0]=3 193 B12R1.50 Cc1cccc(c1)NC(=O)CS A2Z00064158 [0,1,0,0,0,1|1,1,0]=4 194 B12R1.50 Cc1cccc(c1)OC(=O)CN A2Z00049393 [0,1,0,0,0,1|2,0,0]=4 195 B12R1.50 c1cc(cc(c1)Br)NC(=O)CCl A2Z00099282 [0,1,0,0,0,1|2,0,0]=4 196 B12R1.50 c1cc(cc(c1)Cl)NC(=O)CO A2Z00068364 [0,1,0,0,0,1|1,0,0]=3 197 B12R1.127 c1cc(c(cc1Br)CC(=O)O)F A2Z00095959 [0,1,0,0,0,1|1,0,0]=3 198 B12R1.224 Cc1cccn(c1=O)CC(=O)O A2Z00069277 [0,1,0,0,0,1|2,0,0]=4 199 B12R1.48 CC(=O)c1ccc(c(c1)Br)OC A2Z00048841 [0,2,0,0,0,0|2,0,0]=4 200 B12R1.48 CC(=O)c1ccc(c(c1)Br)SC A2Z00096050 [0,2,0,0,0,0|2,0,0]=4 201 B12R1.48 COc1ccc(cc1Br)C(=O)O A2Z00095298 [0,2,0,0,0,0|1,0,0]=3 202 B12R1.48 COc1ccc(cc1Br)S(=O)O A2Z00049796 [0,2,0,0,0,0|2,0,0]=4 203 B12R1.48 COc1ccc(cc1N)C(=O)O A2Z00048893 [0,2,0,0,0,0|1,0,0]=3 204 B12R1.48 Cc1cc(ccc1OC)C(=O)C A2Z00046352 [0,2,0,0,0,0|2,0,0]=4 205 B12R1.56 COc1cc(ccc1Br)[N+](=O)[O-] A2Z00050169 [0,2,0,0,0,0|1,0,1]=4 206 B12R1.56 Cc1ccc(cc1C#N)C(=O)O A2Z00056969 [0,2,0,0,0,0|1,0,0]=3 207 B12R1.56 c1cc(c(cc1[N+](=O)[O-])CO)N A2Z00049554 [0,2,0,0,0,0|1,0,1]=4 208 B12R1.232 Cc1cc(c(cc1C)O)C(=O)C A2Z00071997 [0,2,0,0,0,0|2,0,0]=4 209 B12R1.367 CCC(=O)c1ccc(c(c1)C)C A2Z00068482 [0,2,0,0,0,0|2,0,0]=4 210 B12R1.367 COC(=O)c1ccc(c(c1)N)Cl A2Z00094243 [0,2,0,0,0,0|1,0,0]=3 211 B12R1.367 COC(=O)c1ccc(c(c1)O)N A2Z00069834 [0,2,0,0,0,0|0,0,0]=2 212 B12R1.367 Cc1ccc(cc1C)C(=O)CCl A2Z00094276 [0,2,0,0,0,0|2,0,0]=4 213 B12R1.367 c1cc(c(cc1C(=O)CCl)F)F A2Z00094496 [0,2,0,0,0,0|2,0,0]=4 214 B12R1.893 c1cc(c(c(c1C(=O)O)N)Cl)Cl A2Z00062159 [0,2,0,0,0,0|1,0,0]=3 215 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)O)Br A2Z00049588 [0,2,0,0,0,0|2,0,0]=4 216 B12R1.1005 c1c(cc(c(c1Cl)O)Cl)C(=O)N A2Z00038342 [0,2,0,0,0,0|2,0,0]=4 217 B12R1.1005 c1c(cc(c(c1O)O)O)C(=O)O A2Z00038664 [0,2,0,0,0,0|0,0,0]=2 218 B12R1.24 CCC(=O)c1cccc(c1C)C A2Z00050004 [0,2,0,0,0,0|2,0,0]=4 219 B12R1.24 COC(=O)c1cccc(c1Br)F A2Z00096666 [0,2,0,0,0,0|1,0,0]=3 220 B12R1.24 Cn1cccc(c1=O)C(=O)OC A2Z00096625 [0,2,0,0,0,0|2,0,0]=4 221 B12R1.354 CCC(=O)c1cc(ccc1Cl)Cl A2Z00056935 [0,2,0,0,0,0|2,0,0]=4 222 B12R1.354 COC(=O)c1cc(ccc1Cl)N A2Z00045055 [0,2,0,0,0,0|1,0,0]=3 223 B12R1.354 COC(=O)c1cc(ccc1O)Br A2Z00034160 [0,2,0,0,0,0|1,0,0]=3 224 B12R1.354 COC(=O)c1cc(ccc1O)N A2Z00096851 [0,2,0,0,0,0|1,0,0]=3 225 B12R1.354 C\C(=N\O)\c1cc(ccc1O)O A2Z00098336 [0,2,0,0,0,0|1,0,0]=3 226 B12R1.354 Cc1ccc(c(c1)C(=O)CCl)C A2Z00048098 [0,2,0,0,0,0|2,0,0]=4 227 B12R1.358 COC(=O)c1cc(cc(c1)Cl)Cl A2Z00097515 [0,2,0,0,0,0|1,0,0]=3 228 B12R1.358 COC(=O)c1cc(nc(c1)Cl)Cl A2Z00096479 [0,2,0,0,0,0|2,0,0]=4 229 B12R1.435 CCC(=O)c1cccc(c1)C#N A2Z00048071 [0,2,0,0,0,0|2,0,0]=4 230 B12R1.435 COC(=O)c1ccnc(c1)C#N A2Z00096344 [0,2,0,0,0,0|2,0,0]=4 231 B12R1.435 COC(=O)c1ccnc(c1)CN A2Z00096373 [0,2,0,0,0,0|2,0,0]=4 232 B12R1.435 COc1cccc(c1)C(CN)O A2Z00046546 [0,2,0,0,0,0|1,0,1]=4 233 B12R1.436 c1cc(cc(c1)S(=O)(=O)O)C=O A2Z00057052 [0,2,0,0,0,0|1,0,1]=4 234 B12R1.46 CC(=O)c1cc(ccc1OC)F A2Z00094494 [0,2,0,0,0,0|2,0,0]=4 235 B12R1.46 COc1ccc(cc1C(=O)N)Cl A2Z00038604 [0,2,0,0,0,0|2,0,0]=4 236 B12R1.46 COc1ccc(cc1C(=O)O)Br A2Z00095258 [0,2,0,0,0,0|1,0,0]=3 237 B12R1.46 COc1ccc(cc1C(=O)O)Cl A2Z00038414 [0,2,0,0,0,0|1,0,0]=3 238 B12R1.46 Cc1ccc(c(c1)C(=O)C)SC A2Z00096878 [0,2,0,0,0,0|2,0,0]=4 239 B12R1.453 CC(=O)c1cc(ccc1Cl)OC A2Z00056965 [0,2,0,0,0,0|1,0,0]=3 240 B12R1.453 CCc1ccc(c(c1)C(=O)C)O A2Z00095971 [0,2,0,0,0,0|2,0,0]=4 241 B12R1.453 CCc1ccc(c(c1)C(=O)O)N A2Z00057964 [0,2,0,0,0,0|1,0,0]=3 242 B12R1.258 CC(=O)c1cccc(c1)C(=O)O A2Z00094723 [0,2,0,0,0,0|0,0,1]=3 243 B12R1.258 CC(c1cccc(c1)C(=O)O)O A2Z00062361 [0,2,0,0,0,0|0,0,0]=2 244 B12R1.258 c1c(ncnc1C(=O)O)C(=O)O A2Z00095174 [0,2,0,0,0,0|2,0,0]=4 245 B12R1.258 c1cc(cc(c1)[N+](=O)[O-])C(=O)O A2Z00093479 [0,2,0,0,0,0|0,0,1]=3 246 B12R1.258 c1cc(nc(c1)C(=O)O)C(=O)O A2Z00050167 [0,2,0,0,0,0|1,0,0]=3 247 B12R1.279 c1cc(cc(c1)[N+](=O)[O-])\C=N\O A2Z00094843 [0,2,0,0,0,0|1,0,1]=4 248 B10R1.66 c1cc([nH]c1)\C=C\C(=O)O A2Z00094929 [0,0,1,1,0,0|1,0,0]=3 249 B10R1.66 c1cc(oc1)CCC(=O)O A2Z00095303 [0,0,1,1,0,0|0,0,2]=4 250 B10R1.66 c1cc(oc1)\C=C\C(=O)Cl A2Z00095952 [0,0,1,1,0,0|1,0,0]=3 251 B10R1.66 c1cc(oc1)\C=C\C(=O)O A2Z00085545 [0,0,1,1,0,0|0,0,0]=2 252 B10R1.66 c1cc(sc1)\C=C\C(=O)O A2Z00096656 [0,0,1,1,0,0|0,1,0]=3 253 B10R1.66 c1cscc1\C=C\C(=O)O A2Z00096366 [0,0,1,1,0,0|2,0,0]=4 254 B10R1.54 Cc1ccc(o1)CC(=O)O A2Z00049556 [0,0,1,1,0,0|0,0,2]=4 255 B12R2.202 Cc1cc2c([nH]1)cccc2O A2Z00096183 [0,0,0,1,0,1|2,0,0]=4 256 B12R2.202 c1cc(c2c(c1)[nH]c(=O)o2)N A2Z00046404 [0,0,0,1,0,1|1,0,0]=3 257 B12R2.202 c1cc(c2c(c1)oc(=O)[nH]2)N A2Z00070298 [0,0,0,1,0,1|2,0,0]=4 258 B12R2.202 c1cc2c(c(c1)Br)NC(=O)C2 A2Z00074262 [0,0,0,1,0,1|2,0,0]=4 259 B12R2.202 c1cc2c(c(c1)Cl)CC(=O)N2 A2Z00095173 [0,0,0,1,0,1|2,0,0]=4 260 B12R2.202 c1cc2c(c(c1)Cl)NC(=O)C2 A2Z00098390 [0,0,0,1,0,1|2,0,0]=4 261 B12R2.606 Cc1nc2cc(ccc2o1)O A2Z00070118 [0,0,0,1,0,1|1,0,0]=3 262 B12R2.606 Cc1nc2cc(ccc2s1)O A2Z00097538 [0,0,0,1,0,1|1,1,0]=4 263 B12R2.606 Cc1nc2ccc(cc2o1)O A2Z00070115 [0,0,0,1,0,1|2,0,0]=4 264 B12R2.606 c1cc2c(cc1Br)CC(=O)N2 A2Z00094309 [0,0,0,1,0,1|2,0,0]=4 265 B12R2.606 c1cc2c(cc1N)CC(=O)N2 A2Z00095275 [0,0,0,1,0,1|2,0,0]=4 266 B12R2.606 c1cc2c(cc1N)[nH]c(=O)o2 A2Z00046405 [0,0,0,1,0,1|1,0,0]=3 267 B12R2.606 c1cc2c(cc1N)oc(=O)[nH]2 A2Z00094049 [0,0,0,1,0,1|2,0,0]=4 268 B12R2.606 c1cc2c(cc1O)sc(=O)o2 A2Z00017241 [0,0,0,1,0,1|0,0,0]=2 269 B12R2.132 c1cc2c(cc1Br)C(=O)CS2 A2Z00050233 [0,1,0,1,0,0|1,1,0]=4 270 B12R2.132 c1cc2c(cc1Cl)C(=O)CC2 A2Z00094227 [0,1,0,1,0,0|2,0,0]=4 271 B8R1.1 c1cc(oc1C=O)I A2Z00064077 [1,0,0,0,1,0|2,0,0]=4 272 B8R1.7 CC(=O)c1cccs1 A2Z00050162 [1,0,0,0,1,0|2,0,0]=4 273 B8R1.7 c1c(ncs1)C(=O)O A2Z00061631 [1,0,0,0,1,0|2,0,0]=4 274 B8R1.7 c1cc([nH]c1)C(=O)O A2Z00070219 [1,0,0,0,1,0|1,0,0]=3 275 B8R1.7 c1cc(oc1)C(=O)O A2Z00093505 [1,0,0,0,1,0|1,0,0]=3 276 B8R1.7 c1cnoc1C(=O)O A2Z00096002 [1,0,0,0,1,0|2,0,0]=4 277 B10R1.18 c1ccc(cc1)CC(=O)Cl A2Z00093442 [1,0,0,0,0,1|1,0,0]=3 278 B10R1.18 c1ccc(cc1)CC(=S)N A2Z00083382 [1,0,0,0,0,1|1,1,0]=4 279 B12R1.226 CC(=O)CCc1cccc(c1)Cl A2Z00094749 [0,0,0,0,0,2|2,0,0]=4 280 B12R1.226 CC(=O)COc1cccc(c1)Br A2Z00094586 [0,0,0,0,0,2|2,0,0]=4 281 B12R1.226 c1cc(cc(c1)Br)OCC(=O)O A2Z00078437 [0,0,0,0,0,2|1,0,0]=3 282 B12R1.226 c1cc(cc(c1)Cl)CCC(=O)O A2Z00095187 [0,0,0,0,0,2|1,0,0]=3 283 B12R1.226 c1cc(cc(c1)Cl)\C=C\C(=O)O A2Z00038051 [0,0,0,0,0,2|1,0,0]=3 284 B12R1.226 c1cc(cc(c1)F)CCC(=O)O A2Z00094264 [0,0,0,0,0,2|1,0,0]=3 285 B12R1.226 c1cc(cc(c1)F)\C=C\C(=O)O A2Z00097969 [0,0,0,0,0,2|1,0,0]=3