0 B9R1.6 CC(=O)c1ccncc1 A2Z00096088 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.6 CC(c1ccccc1)N A2Z00093463 [0,0,0,0,0,0|2,0,1]=3 2 B9R1.6 c1cc(cnc1)C(=O)Cl A2Z00046508 [0,0,0,0,0,0|1,0,0]=1 3 B9R1.6 c1ccc(cc1)C(=N)N A2Z00096156 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.6 c1cnc(cn1)C(=O)O A2Z00085941 [0,0,0,0,0,0|2,0,0]=2 5 B9R1.6 c1cnccc1C(=S)N A2Z00098301 [0,0,0,0,0,0|2,1,0]=3 6 B8R1.2 COc1cnccn1 A2Z00085431 [1,0,0,0,0,0|3,0,0]=4 7 B8R1.2 CSc1ccccc1 A2Z00096090 [1,0,0,0,0,0|3,0,0]=4 8 B8R1.2 c1cc(cnc1)CN A2Z00093433 [1,0,0,0,0,0|0,0,1]=2 9 B8R1.2 c1ccc(cc1)CN A2Z00095042 [1,0,0,0,0,0|1,0,1]=3 10 B8R1.2 c1ccnc(c1)NN A2Z00097841 [1,0,0,0,0,0|3,0,0]=4 11 B10R1.13 CC(=O)c1ccc(cc1)Cl A2Z00038583 [0,1,0,0,0,0|2,0,0]=3 12 B10R1.13 CN(c1ccc(cc1)F)N A2Z00049175 [0,1,0,0,0,0|3,0,0]=4 13 B10R1.13 Cc1ccc(cc1)C(=O)O A2Z00030670 [0,1,0,0,0,0|2,0,0]=3 14 B10R1.13 Cc1ccc(cc1)C(=S)N A2Z00038400 [0,1,0,0,0,0|1,1,0]=3 15 B10R1.13 Cc1ccc(cn1)[N+](=O)[O-] A2Z00096401 [0,1,0,0,0,0|2,0,0]=3 16 B10R1.13 Cc1cnc(cn1)C(=O)N A2Z00096092 [0,1,0,0,0,0|1,0,0]=2 17 B10R1.13 Cc1cnc(cn1)C(=O)O A2Z00096093 [0,1,0,0,0,0|2,0,0]=3 18 B10R1.13 c1c(ncc(n1)Br)C(=O)O A2Z00050258 [0,1,0,0,0,0|2,0,0]=3 19 B10R1.13 c1c(ncc(n1)O)C(=O)O A2Z00096301 [0,1,0,0,0,0|2,0,0]=3 20 B10R1.13 c1cc(=O)[nH]cc1C(=O)O A2Z00094278 [0,1,0,0,0,0|1,0,1]=3 21 B10R1.13 c1cc(=O)[nH]cc1[N+](=O)[O-] A2Z00069279 [0,1,0,0,0,0|2,0,1]=4 22 B10R1.13 c1cc(=O)[nH]nc1C(=O)O A2Z00083465 [0,1,0,0,0,0|2,0,1]=4 23 B10R1.13 c1cc(ccc1C(=N)N)Cl A2Z00098490 [0,1,0,0,0,0|2,0,0]=3 24 B10R1.13 c1cc(ccc1C(=N)N)N A2Z00050462 [0,1,0,0,0,0|2,0,0]=3 25 B10R1.13 c1cc(ccc1C(=N)N)O A2Z00070221 [0,1,0,0,0,0|2,0,0]=3 26 B10R1.13 c1cc(ccc1C(=O)N)Br A2Z00038699 [0,1,0,0,0,0|1,0,0]=2 27 B10R1.13 c1cc(ccc1C(=O)N)O A2Z00093462 [0,1,0,0,0,0|1,0,0]=2 28 B10R1.13 c1cc(ccc1C(=O)O)Br A2Z00093455 [0,1,0,0,0,0|2,0,0]=3 29 B10R1.13 c1cc(ccc1C(=O)O)F A2Z00038620 [0,1,0,0,0,0|2,0,0]=3 30 B10R1.13 c1cc(ccc1C(=O)O)N A2Z00093468 [0,1,0,0,0,0|2,0,0]=3 31 B10R1.13 c1cc(ccc1C(=S)N)Br A2Z00085460 [0,1,0,0,0,0|1,1,0]=3 32 B10R1.13 c1cc(ccc1C(=S)N)Cl A2Z00038403 [0,1,0,0,0,0|1,1,0]=3 33 B10R1.13 c1cc(ccc1C(=S)N)F A2Z00093909 [0,1,0,0,0,0|1,1,0]=3 34 B10R1.13 c1cc(ccc1S(=O)Cl)Cl A2Z00049702 [0,1,0,0,0,0|3,0,0]=4 35 B10R1.13 c1cc(ccc1[N+](=O)[O-])Cl A2Z00093555 [0,1,0,0,0,0|3,0,0]=4 36 B10R1.13 c1cc(ncc1C(=O)O)Cl A2Z00096110 [0,1,0,0,0,0|1,0,0]=2 37 B10R1.13 c1cc(ncc1[N+](=O)[O-])Br A2Z00096138 [0,1,0,0,0,0|2,0,0]=3 38 B10R1.13 c1cc(ncc1[N+](=O)[O-])Cl A2Z00066910 [0,1,0,0,0,0|2,0,0]=3 39 B10R1.13 c1cc(ncc1[N+](=O)[O-])N A2Z00098290 [0,1,0,0,0,0|2,0,0]=3 40 B10R1.13 c1cc(ncc1[N+](=O)[O-])O A2Z00066911 [0,1,0,0,0,0|2,0,0]=3 41 B10R1.13 c1cc(nnc1C(=O)O)Cl A2Z00049654 [0,1,0,0,0,0|2,0,0]=3 42 B10R1.15 CC(c1ccccc1)NO A2Z00047942 [0,1,0,0,0,0|2,0,1]=4 43 B10R1.15 c1cc(cnc1)C(=O)CBr A2Z00094983 [0,1,0,0,0,0|1,0,0]=2 44 B10R1.15 c1ccc(cc1)C(=O)C=O A2Z00094839 [0,1,0,0,0,0|2,0,0]=3 45 B10R1.61 CC(=O)c1ccncc1F A2Z00096478 [0,1,0,0,0,0|3,0,0]=4 46 B10R1.61 Cc1ccccc1C(=O)N A2Z00085447 [0,1,0,0,0,0|1,0,0]=2 47 B10R1.61 c1cc(c(=O)[nH]c1)C(=O)O A2Z00085542 [0,1,0,0,0,0|1,0,1]=3 48 B10R1.61 c1cc(c(nc1)Cl)C(=O)O A2Z00050195 [0,1,0,0,0,0|1,0,0]=2 49 B10R1.61 c1cc(c(nc1)Cl)[N+](=O)[O-] A2Z00070223 [0,1,0,0,0,0|2,0,0]=3 50 B10R1.61 c1cc(c(nc1)N)[N+](=O)[O-] A2Z00069021 [0,1,0,0,0,0|2,0,0]=3 51 B10R1.61 c1ccc(c(c1)C(=N)N)F A2Z00074261 [0,1,0,0,0,0|2,0,0]=3 52 B10R1.61 c1ccc(c(c1)C(=O)N)O A2Z00062157 [0,1,0,0,0,0|1,0,0]=2 53 B10R1.61 c1ccc(c(c1)C(=O)O)Br A2Z00093939 [0,1,0,0,0,0|2,0,0]=3 54 B10R1.61 c1ccc(c(c1)C(=O)O)F A2Z00093478 [0,1,0,0,0,0|2,0,0]=3 55 B10R1.61 c1ccc(c(c1)C(=O)O)I A2Z00093586 [0,1,0,0,0,0|2,0,0]=3 56 B10R1.61 c1ccc(c(c1)C(=O)O)N A2Z00070269 [0,1,0,0,0,0|2,0,0]=3 57 B10R1.61 c1ccc(c(c1)C(=O)O)O A2Z00038631 [0,1,0,0,0,0|2,0,0]=3 58 B10R1.61 c1ccc(c(c1)C(=S)N)Cl A2Z00098305 [0,1,0,0,0,0|1,1,0]=3 59 B10R1.61 c1ccc(c(c1)C(=S)N)F A2Z00038401 [0,1,0,0,0,0|1,1,0]=3 60 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])Cl A2Z00093554 [0,1,0,0,0,0|3,0,0]=4 61 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])O A2Z00034985 [0,1,0,0,0,0|3,0,0]=4 62 B10R1.61 c1cncc(c1N)[N+](=O)[O-] A2Z00097430 [0,1,0,0,0,0|2,0,0]=3 63 B10R1.113 CC(=O)c1cccc(c1)Cl A2Z00095936 [0,1,0,0,0,0|2,0,0]=3 64 B10R1.113 Cc1cc(ccn1)C(=O)O A2Z00096178 [0,1,0,0,0,0|3,0,0]=4 65 B10R1.113 Cc1cc(cnc1)C(=O)O A2Z00096067 [0,1,0,0,0,0|1,0,0]=2 66 B10R1.113 c1c(cncc1N)C(=O)O A2Z00009581 [0,1,0,0,0,0|1,0,0]=2 67 B10R1.113 c1cc(c[n+](c1)[O-])C(=O)N A2Z00098097 [0,1,0,0,0,0|0,0,1]=2 68 B10R1.113 c1cc(cc(c1)Br)[N+](=O)[O-] A2Z00097373 [0,1,0,0,0,0|3,0,0]=4 69 B10R1.113 c1cc(cc(c1)Cl)C(=O)Cl A2Z00095909 [0,1,0,0,0,0|2,0,0]=3 70 B10R1.113 c1cc(cc(c1)Cl)C(=O)N A2Z00095951 [0,1,0,0,0,0|1,0,0]=2 71 B10R1.113 c1cc(cc(c1)F)C(=O)O A2Z00085462 [0,1,0,0,0,0|2,0,0]=3 72 B10R1.113 c1cc(cc(c1)N)C(=O)O A2Z00083929 [0,1,0,0,0,0|2,0,0]=3 73 B10R1.113 c1cc(nc(c1)Cl)C(=O)O A2Z00050531 [0,1,0,0,0,0|3,0,0]=4 74 B10R1.113 c1cnc(cc1Br)C(=O)O A2Z00009551 [0,1,0,0,0,0|3,0,0]=4 75 B10R1.113 c1cnc(cc1C(=O)O)Cl A2Z00096019 [0,1,0,0,0,0|3,0,0]=4 76 B10R1.113 c1cnc(cc1C(=O)O)O A2Z00096024 [0,1,0,0,0,0|3,0,0]=4 77 B10R1.113 c1cnc(cc1O)C(=O)O A2Z00009579 [0,1,0,0,0,0|3,0,0]=4 78 B10R2.6 c1ccc(cc1)C2CN2 A2Z00049782 [0,0,0,1,0,0|2,0,1]=4 79 B8R1.7 CC(=O)c1cccs1 A2Z00050162 [0,0,0,0,1,0|2,0,0]=3 80 B8R1.7 CC(=O)c1cncs1 A2Z00085476 [0,0,0,0,1,0|2,0,0]=3 81 B8R1.7 C[C@@H](c1nccs1)N A2Z00062222 [0,0,0,0,1,0|2,0,1]=4 82 B8R1.7 c1c(ncs1)C(=O)N A2Z00050185 [0,0,0,0,1,0|1,0,0]=2 83 B8R1.7 c1c(ncs1)C(=O)O A2Z00061631 [0,0,0,0,1,0|2,0,0]=3 84 B8R1.7 c1c(non1)C(=O)O A2Z00050422 [0,0,0,0,1,0|3,0,0]=4 85 B8R1.7 c1cc([nH]c1)C(=O)O A2Z00070219 [0,0,0,0,1,0|1,0,1]=3 86 B8R1.7 c1cc(oc1)C(=O)O A2Z00093505 [0,0,0,0,1,0|2,0,0]=3 87 B8R1.7 c1cc(sc1)C(=S)N A2Z00038399 [0,0,0,0,1,0|1,1,0]=3 88 B8R1.7 c1cnoc1C(=O)O A2Z00096002 [0,0,0,0,1,0|2,0,0]=3 89 B10R1.18 c1ccc(cc1)CC(=O)Cl A2Z00093442 [0,0,0,0,0,1|2,0,0]=3 90 B10R1.18 c1ccc(cc1)CC(=S)N A2Z00083382 [0,0,0,0,0,1|1,1,0]=3 91 B7R1.3 c1c(cncn1)Br A2Z00095940 [2,0,0,0,0,0|2,0,0]=4 92 B7R1.3 c1cc(cnc1)O A2Z00096077 [2,0,0,0,0,0|0,0,1]=3 93 B7R1.3 c1cc[nH]c(=O)c1 A2Z00070061 [2,0,0,0,0,0|2,0,0]=4 94 B7R1.3 c1ccc(cc1)O A2Z00038639 [2,0,0,0,0,0|1,0,1]=4 95 B7R1.3 c1cnc(cn1)Cl A2Z00096006 [2,0,0,0,0,0|2,0,0]=4 96 B9R1.1 Cc1ccc(cn1)C#N A2Z00096063 [1,1,0,0,0,0|0,0,2]=4 97 B9R1.1 Cc1ccc(cn1)C=O A2Z00096051 [1,1,0,0,0,0|0,0,0]=2 98 B9R1.1 Cc1cnc(cn1)CN A2Z00096239 [1,1,0,0,0,0|1,0,1]=4 99 B9R1.1 c1cc(ccc1C=O)F A2Z00093477 [1,1,0,0,0,0|1,0,0]=3 100 B9R1.1 c1cc(ccc1C=O)O A2Z00093449 [1,1,0,0,0,0|1,0,0]=3 101 B9R1.1 c1cc(ccc1CN)F A2Z00097608 [1,1,0,0,0,0|1,0,1]=4 102 B9R1.1 c1cc(ccc1NN)Br A2Z00097331 [1,1,0,0,0,0|2,0,0]=4 103 B9R1.1 c1cc(ccc1NN)Cl A2Z00093596 [1,1,0,0,0,0|2,0,0]=4 104 B9R1.1 c1cc(nnc1NN)Cl A2Z00096097 [1,1,0,0,0,0|2,0,0]=4 105 B9R1.2 c1cc(cc(c1)Br)ON A2Z00096321 [1,1,0,0,0,0|2,0,0]=4 106 B9R1.2 c1cc(cc(c1)N)CN A2Z00095152 [1,1,0,0,0,0|1,0,1]=4 107 B9R1.2 c1cc(cc(c1)O)C=O A2Z00093516 [1,1,0,0,0,0|1,0,0]=3 108 B9R1.8 CNCc1ccccc1 A2Z00093451 [1,1,0,0,0,0|1,0,1]=4 109 B9R1.8 c1ccc(cc1)CCN A2Z00046190 [1,1,0,0,0,0|1,0,1]=4 110 B9R1.8 c1ccc(cc1)CNN A2Z00062153 [1,1,0,0,0,0|1,0,1]=4 111 B9R1.15 COc1cccnc1N A2Z00069850 [1,1,0,0,0,0|2,0,0]=4 112 B9R1.15 Cc1c(nccn1)C=O A2Z00050351 [1,1,0,0,0,0|1,0,0]=3 113 B9R1.15 c1cc(c(nc1)Br)C#N A2Z00097766 [1,1,0,0,0,0|0,0,2]=4 114 B9R1.15 c1cc(c(nc1)O)C#N A2Z00097562 [1,1,0,0,0,0|0,0,2]=4 115 B9R1.15 c1ccc(c(c1)C=O)F A2Z00093476 [1,1,0,0,0,0|1,0,0]=3 116 B9R1.15 c1ccc(c(c1)C=O)O A2Z00038632 [1,1,0,0,0,0|1,0,0]=3 117 B9R1.15 c1ccc(c(c1)CN)Cl A2Z00093435 [1,1,0,0,0,0|1,0,1]=4 118 B9R1.15 c1ccc(c(c1)ON)F A2Z00050391 [1,1,0,0,0,0|2,0,0]=4 119 B9R1.11 COC(=O)c1ccc[nH]1 A2Z00096428 [0,1,0,0,1,0|1,0,1]=4 120 B9R1.11 COC(=O)c1ccno1 A2Z00096471 [0,1,0,0,1,0|2,0,0]=4 121 B9R1.11 c1cc(oc1)C(=O)NN A2Z00053062 [0,1,0,0,1,0|1,0,0]=3 122 B9R1.11 c1cc(sc1)C(=O)CCl A2Z00057069 [0,1,0,0,1,0|2,0,0]=4 123 B9R1.11 c1cc(sc1)C(=O)NN A2Z00051543 [0,1,0,0,1,0|1,0,0]=3 124 B9R1.35 CC(=O)c1ccc(o1)Br A2Z00062313 [0,1,0,0,1,0|2,0,0]=4 125 B9R1.35 Cc1cc(n[nH]1)C(=O)O A2Z00046525 [0,1,0,0,1,0|2,0,0]=4 126 B9R1.35 Cc1cc(ns1)C(=O)O A2Z00050333 [0,1,0,0,1,0|2,0,0]=4 127 B9R1.35 Cc1cnc(o1)C(=O)O A2Z00050346 [0,1,0,0,1,0|2,0,0]=4 128 B9R1.35 Cc1ncc(s1)C(=O)O A2Z00073992 [0,1,0,0,1,0|2,0,0]=4 129 B9R1.35 c1c([nH]nc1O)C(=O)O A2Z00050449 [0,1,0,0,1,0|2,0,0]=4 130 B9R1.35 c1c(n[nH]c1O)C(=O)O A2Z00096273 [0,1,0,0,1,0|2,0,0]=4 131 B9R1.35 c1c(nc(s1)Cl)C(=O)O A2Z00085550 [0,1,0,0,1,0|2,0,0]=4 132 B9R1.35 c1c(nc(s1)N)C(=O)O A2Z00085471 [0,1,0,0,1,0|2,0,0]=4 133 B9R1.35 c1cc(oc1C(=O)O)Br A2Z00033998 [0,1,0,0,1,0|2,0,0]=4 134 B9R1.35 c1cc(sc1C(=O)O)Cl A2Z00095939 [0,1,0,0,1,0|2,0,0]=4 135 B9R1.41 CC(=O)c1c(ncs1)Br A2Z00050247 [0,1,0,0,1,0|2,0,0]=4 136 B9R1.41 Cc1c(cn[nH]1)C(=O)O A2Z00085440 [0,1,0,0,1,0|2,0,0]=4 137 B9R1.41 Cc1c(ocn1)C(=O)O A2Z00049433 [0,1,0,0,1,0|2,0,0]=4 138 B9R1.41 Cc1ccsc1C(=O)O A2Z00095998 [0,1,0,0,1,0|2,0,0]=4 139 B9R1.41 Cn1c(ccn1)C(=O)O A2Z00096177 [0,1,0,0,1,0|2,0,0]=4 140 B9R1.41 c1csc(c1O)C(=O)N A2Z00061416 [0,1,0,0,1,0|1,0,0]=3 141 B11R1.20 CC(=O)Cc1ccc(cc1)Br A2Z00095994 [0,1,0,0,0,1|2,0,0]=4 142 B11R1.20 Cc1ccc(cc1)NC(=S)N A2Z00075032 [0,1,0,0,0,1|1,1,0]=4 143 B11R1.20 c1cc(ccc1CC(=O)O)O A2Z00062185 [0,1,0,0,0,1|2,0,0]=4 144 B11R1.36 CC(=O)C(c1ccccc1)O A2Z00049601 [0,1,0,0,0,1|2,0,0]=4 145 B11R1.36 c1ccc(cc1)C(C(=O)Cl)Cl A2Z00094848 [0,1,0,0,0,1|2,0,0]=4 146 B11R1.36 c1ccc(cc1)C(C(=O)O)Cl A2Z00094634 [0,1,0,0,0,1|2,0,0]=4 147 B11R1.40 C\C(=C/c1ccccc1)\C=O A2Z00038627 [0,1,0,0,0,1|2,0,0]=4 148 B11R1.40 c1ccc(cc1)NC(=O)CN A2Z00044283 [0,1,0,0,0,1|1,0,0]=3 149 B11R1.40 c1ccc(cc1)NC(=O)CO A2Z00068359 [0,1,0,0,0,1|2,0,0]=4 150 B11R1.86 Cc1ccccc1NC(=N)N A2Z00074248 [0,1,0,0,0,1|2,0,0]=4 151 B11R1.86 c1ccc(c(c1)CC(=O)O)F A2Z00061208 [0,1,0,0,0,1|2,0,0]=4 152 B11R1.157 CC(=O)Cc1cccc(c1)Br A2Z00095995 [0,1,0,0,0,1|2,0,0]=4 153 B11R1.157 Cc1cccc(c1)CC(=O)C A2Z00046562 [0,1,0,0,0,1|2,0,0]=4 154 B11R1.3 CCc1ccc(cc1)C(=N)N A2Z00038652 [0,2,0,0,0,0|2,0,0]=4 155 B11R1.3 CCc1ccc(cc1)C(=O)O A2Z00083092 [0,2,0,0,0,0|2,0,0]=4 156 B11R1.3 CCc1ccc(cc1)C(=S)N A2Z00038707 [0,2,0,0,0,0|1,1,0]=4 157 B11R1.3 COc1ccc(cc1)C(=O)O A2Z00038625 [0,2,0,0,0,0|2,0,0]=4 158 B11R1.3 COc1ccc(cc1)C(=S)N A2Z00038402 [0,2,0,0,0,0|1,1,0]=4 159 B11R1.3 COc1ccc(cn1)[N+](=O)[O-] A2Z00096485 [0,2,0,0,0,0|2,0,0]=4 160 B11R1.3 c1c(ncc(n1)C(=O)O)C=O A2Z00050327 [0,2,0,0,0,0|2,0,0]=4 161 B11R1.3 c1cc(ccc1C#N)C(=O)O A2Z00097496 [0,2,0,0,0,0|2,0,0]=4 162 B11R1.3 c1cc(ccc1C=O)C(=O)O A2Z00097123 [0,2,0,0,0,0|2,0,0]=4 163 B11R1.3 c1cc(ccc1CN)C(=O)N A2Z00074039 [0,2,0,0,0,0|1,0,0]=3 164 B11R1.3 c1cc(ccc1CN)C(=O)O A2Z00038655 [0,2,0,0,0,0|2,0,0]=4 165 B11R1.3 c1cc(ncc1C(=O)O)C#N A2Z00096360 [0,2,0,0,0,0|1,0,0]=3 166 B11R1.3 c1cc(ncc1[N+](=O)[O-])NN A2Z00069061 [0,2,0,0,0,0|2,0,0]=4 167 B11R1.19 Cc1ccc(cn1)S(=O)(=O)Cl A2Z00050276 [0,2,0,0,0,0|2,0,0]=4 168 B11R1.19 Cc1ccc(cn1)S(=O)(=O)Cl A2Z00050445 [0,2,0,0,0,0|2,0,0]=4 169 B11R1.19 c1cc(ccc1N)S(=O)(=O)N A2Z00093571 [0,2,0,0,0,0|2,0,0]=4 170 B11R1.19 c1cc(ncc1S(=O)(=O)Cl)Br A2Z00048832 [0,2,0,0,0,0|2,0,0]=4 171 B11R1.19 c1cc(ncc1S(=O)(=O)Cl)Cl A2Z00009546 [0,2,0,0,0,0|2,0,0]=4 172 B11R1.19 c1cc(ncc1S(=O)(=O)O)N A2Z00009559 [0,2,0,0,0,0|2,0,0]=4 173 B11R1.21 CC(=O)c1ccc(c(c1)N)Cl A2Z00094298 [0,2,0,0,0,0|2,0,0]=4 174 B11R1.21 CC(=O)c1ccc(c(c1)O)Cl A2Z00049750 [0,2,0,0,0,0|2,0,0]=4 175 B11R1.21 Cc1cc(ccc1O)C(=O)C A2Z00094595 [0,2,0,0,0,0|2,0,0]=4 176 B11R1.21 Cc1cc(cnc1Cl)[N+](=O)[O-] A2Z00070328 [0,2,0,0,0,0|2,0,0]=4 177 B11R1.21 Cc1cc(cnc1N)[N+](=O)[O-] A2Z00070213 [0,2,0,0,0,0|2,0,0]=4 178 B11R1.21 Cc1ccc(cc1N)C(=O)C A2Z00048065 [0,2,0,0,0,0|2,0,0]=4 179 B11R1.21 Cc1ccc(cc1N)C(=O)O A2Z00094525 [0,2,0,0,0,0|2,0,0]=4 180 B11R1.21 c1cc(c(cc1C(=O)O)Br)Cl A2Z00094869 [0,2,0,0,0,0|2,0,0]=4 181 B11R1.21 c1cc(c(cc1C(=O)O)Cl)Cl A2Z00093440 [0,2,0,0,0,0|2,0,0]=4 182 B11R1.21 c1cc(c(cc1C(=O)O)N)N A2Z00095962 [0,2,0,0,0,0|2,0,0]=4 183 B11R1.21 c1cc(c(cc1C(=O)O)N)O A2Z00098397 [0,2,0,0,0,0|2,0,0]=4 184 B11R1.21 c1cc(c(cc1C(=S)N)Cl)Cl A2Z00038406 [0,2,0,0,0,0|1,1,0]=4 185 B11R1.22 CCC(=O)c1ccc(cc1)Br A2Z00094034 [0,2,0,0,0,0|2,0,0]=4 186 B11R1.22 CCC(=O)c1ccc(cc1)F A2Z00094033 [0,2,0,0,0,0|2,0,0]=4 187 B11R1.22 CNC(=O)c1ccc(cc1)Cl A2Z00053054 [0,2,0,0,0,0|1,0,0]=3 188 B11R1.22 COC(=O)c1ccc(nc1)N A2Z00070242 [0,2,0,0,0,0|1,0,0]=3 189 B11R1.22 COC(=O)c1cnc(cn1)Br A2Z00096452 [0,2,0,0,0,0|2,0,0]=4 190 B11R1.22 COC(=O)c1cnc(cn1)Cl A2Z00096393 [0,2,0,0,0,0|2,0,0]=4 191 B11R1.22 COC(=O)c1cnc(cn1)O A2Z00096407 [0,2,0,0,0,0|2,0,0]=4 192 B11R1.22 Cc1cnc(cn1)C(=O)OC A2Z00096105 [0,2,0,0,0,0|2,0,0]=4 193 B11R1.22 c1cc(ccc1C(=O)CBr)Br A2Z00068657 [0,2,0,0,0,0|2,0,0]=4 194 B11R1.22 c1cc(ccc1C(=O)CCl)Cl A2Z00094275 [0,2,0,0,0,0|2,0,0]=4 195 B11R1.22 c1cc(ccc1C(=O)CCl)F A2Z00094272 [0,2,0,0,0,0|2,0,0]=4 196 B11R1.22 c1cc(ccc1C(=O)CN)F A2Z00094016 [0,2,0,0,0,0|1,0,0]=3 197 B11R1.22 c1cc(ccc1C(=O)NN)Br A2Z00014663 [0,2,0,0,0,0|1,0,0]=3 198 B11R1.22 c1cc(ccc1C(=O)NN)F A2Z00014685 [0,2,0,0,0,0|1,0,0]=3 199 B11R1.166 CC(=O)c1ccc(cc1O)F A2Z00096274 [0,2,0,0,0,0|2,0,0]=4 200 B11R1.166 Cc1c(ccc(n1)Cl)[N+](=O)[O-] A2Z00098092 [0,2,0,0,0,0|2,0,0]=4 201 B11R1.166 Cc1cc(ncc1[N+](=O)[O-])C A2Z00096572 [0,2,0,0,0,0|2,0,0]=4 202 B11R1.166 Cc1cc(ncc1[N+](=O)[O-])N A2Z00098037 [0,2,0,0,0,0|2,0,0]=4 203 B11R1.166 c1cc(c(cc1F)F)C(=O)O A2Z00097416 [0,2,0,0,0,0|2,0,0]=4 204 B11R1.166 c1cc(c(cc1N)O)C(=O)O A2Z00097498 [0,2,0,0,0,0|2,0,0]=4 205 B11R1.166 c1cc(c(cc1N)O)C(=O)[O-] A2Z00062425 [0,2,0,0,0,0|2,0,0]=4 206 B11R1.166 c1cc(c(cc1O)O)C(=O)O A2Z00038656 [0,2,0,0,0,0|2,0,0]=4 207 B11R1.166 c1cc(nc(c1[N+](=O)[O-])Cl)Cl A2Z00097507 [0,2,0,0,0,0|2,0,0]=4 208 B11R1.12 CNC(C#N)c1cccnc1 A2Z00095154 [0,2,0,0,0,0|1,0,1]=4 209 B11R1.16 c1ccc(cc1)\C(=N\C#N)\N A2Z00094993 [0,2,0,0,0,0|2,0,0]=4 210 B11R1.23 COC(=O)c1cccc(c1)N A2Z00095938 [0,2,0,0,0,0|2,0,0]=4 211 B11R1.23 Cc1cccc(c1)C(=O)NN A2Z00014683 [0,2,0,0,0,0|1,0,0]=3 212 B11R1.23 c1cc(cc(c1)Cl)C(=O)CBr A2Z00096150 [0,2,0,0,0,0|2,0,0]=4 213 B11R1.23 c1cc(cc(c1)Cl)C(=O)CN A2Z00096028 [0,2,0,0,0,0|1,0,0]=3 214 B11R1.23 c1cc(cc(c1)Cl)C(=O)NN A2Z00014653 [0,2,0,0,0,0|1,0,0]=3 215 B11R1.23 c1cc(cc(c1)O)C(=O)NN A2Z00014681 [0,2,0,0,0,0|1,0,0]=3 216 B11R1.222 CCC(=O)c1ccccc1Br A2Z00049411 [0,2,0,0,0,0|2,0,0]=4 217 B11R1.222 CNC(=O)c1ccccc1N A2Z00046099 [0,2,0,0,0,0|1,0,0]=3 218 B11R1.222 COC(=O)c1ccccc1Cl A2Z00095996 [0,2,0,0,0,0|2,0,0]=4 219 B11R1.222 COC(=O)c1ccccc1F A2Z00096107 [0,2,0,0,0,0|2,0,0]=4 220 B11R1.222 COC(=O)c1ccccc1N A2Z00096614 [0,2,0,0,0,0|2,0,0]=4 221 B11R1.222 COC(=O)c1ccccc1O A2Z00069275 [0,2,0,0,0,0|2,0,0]=4 222 B11R1.222 COC(=O)c1ccccc1S A2Z00096071 [0,2,0,0,0,0|2,0,0]=4 223 B11R1.222 Cc1ccccc1C(=O)OC A2Z00095993 [0,2,0,0,0,0|2,0,0]=4 224 B11R1.222 Cc1ccccc1\C(=N\O)\N A2Z00096102 [0,2,0,0,0,0|1,0,1]=4 225 B11R1.222 c1ccc(c(c1)C(=O)NN)Br A2Z00014686 [0,2,0,0,0,0|1,0,0]=3 226 B11R1.222 c1ccc(c(c1)C(=O)NN)F A2Z00014684 [0,2,0,0,0,0|1,0,0]=3 227 B11R1.222 c1ccc(c(c1)C(=O)NN)N A2Z00097814 [0,2,0,0,0,0|1,0,0]=3 228 B11R1.53 CC(=O)c1ccccc1OC A2Z00094520 [0,2,0,0,0,0|2,0,0]=4 229 B11R1.53 COc1ccccc1C(=O)O A2Z00093473 [0,2,0,0,0,0|2,0,0]=4 230 B11R1.53 c1ccc(c(c1)C(=O)O)NN A2Z00097754 [0,2,0,0,0,0|2,0,0]=4 231 B11R1.53 c1ccc(c(c1)C=O)C(=O)O A2Z00055347 [0,2,0,0,0,0|2,0,0]=4 232 B11R1.156 c1cc(c(c(c1)Cl)C(=S)N)F A2Z00038405 [0,2,0,0,0,0|1,1,0]=4 233 B11R1.156 c1cc(c(c(c1)F)C(=S)N)F A2Z00069795 [0,2,0,0,0,0|1,1,0]=4 234 B11R1.156 c1cnc(c(c1Cl)[N+](=O)[O-])Cl A2Z00096486 [0,2,0,0,0,0|2,0,0]=4 235 B11R1.159 Cn1cccc(c1=O)C(=O)O A2Z00095980 [0,2,0,0,0,0|1,0,1]=4 236 B11R1.159 c1cc(c(c(c1)Br)Cl)C(=O)O A2Z00097567 [0,2,0,0,0,0|2,0,0]=4 237 B11R1.159 c1cc(c(c(c1)Br)F)C(=O)O A2Z00097585 [0,2,0,0,0,0|2,0,0]=4 238 B11R1.159 c1cc(c(c(c1)Br)N)C(=O)O A2Z00097432 [0,2,0,0,0,0|2,0,0]=4 239 B11R1.159 c1cc(c(c(c1)Cl)N)C(=O)O A2Z00061682 [0,2,0,0,0,0|2,0,0]=4 240 B11R1.159 c1cc(c(c(c1)F)Br)C(=O)O A2Z00096365 [0,2,0,0,0,0|2,0,0]=4 241 B11R1.159 c1cc(c(c(c1)F)N)C(=O)O A2Z00097431 [0,2,0,0,0,0|2,0,0]=4 242 B11R1.167 CC(=O)c1cc(ccc1Cl)O A2Z00049751 [0,2,0,0,0,0|2,0,0]=4 243 B11R1.167 CC(=O)c1cc(ccc1O)O A2Z00067510 [0,2,0,0,0,0|2,0,0]=4 244 B11R1.167 Cc1cc(c(nn1)O)C(=O)O A2Z00049871 [0,2,0,0,0,0|2,0,0]=4 245 B11R1.167 Cc1ccc(c(c1)C(=O)C)O A2Z00093755 [0,2,0,0,0,0|2,0,0]=4 246 B11R1.167 Cc1ccc(c(c1)C(=O)O)Br A2Z00097370 [0,2,0,0,0,0|2,0,0]=4 247 B11R1.167 Cc1ccc(c(c1)C(=O)O)C A2Z00083135 [0,2,0,0,0,0|2,0,0]=4 248 B11R1.167 c1cc(c(cc1Br)C(=O)O)Cl A2Z00094857 [0,2,0,0,0,0|2,0,0]=4 249 B11R1.167 c1cc(c(cc1Br)C(=O)O)N A2Z00097335 [0,2,0,0,0,0|2,0,0]=4 250 B11R1.167 c1cc(c(cc1Br)C(=S)N)O A2Z00038547 [0,2,0,0,0,0|1,1,0]=4 251 B11R1.167 c1cc(c(cc1Cl)C(=O)O)O A2Z00096863 [0,2,0,0,0,0|2,0,0]=4 252 B11R1.74 c1c(cc(cc1Cl)Br)C(=O)O A2Z00094868 [0,2,0,0,0,0|2,0,0]=4 253 B11R1.74 c1c(cc(cc1F)Br)C(=O)O A2Z00094875 [0,2,0,0,0,0|2,0,0]=4 254 B11R1.74 c1c(cc(cc1O)O)C(=O)O A2Z00098105 [0,2,0,0,0,0|2,0,0]=4 255 B11R1.266 COc1cccc(c1)C(=O)N A2Z00094313 [0,2,0,0,0,0|1,0,0]=3 256 B11R1.266 COc1cccc(c1)C(=O)O A2Z00078098 [0,2,0,0,0,0|2,0,0]=4 257 B11R1.266 COc1cccc(c1)C(=S)N A2Z00095185 [0,2,0,0,0,0|1,1,0]=4 258 B11R1.266 c1cc(cc(c1)C(=O)O)C#N A2Z00097495 [0,2,0,0,0,0|2,0,0]=4 259 B11R1.266 c1cc(cc(c1)C(=O)O)CBr A2Z00069073 [0,2,0,0,0,0|2,0,0]=4 260 B9R1.13 c1cc(sc1)CC(=O)N A2Z00095950 [0,0,1,1,0,0|1,0,1]=4 261 B11R2.10 c1cc2c([nH]c(=O)o2)nc1 A2Z00069818 [0,0,0,1,0,1|0,0,0]=2 262 B11R2.10 c1ccc2c(c1)[nH]c(n2)Cl A2Z00074312 [0,0,0,1,0,1|2,0,0]=4 263 B11R2.10 c1ccc2c(c1)nc(s2)N A2Z00007218 [0,0,0,1,0,1|1,1,0]=4 264 B11R2.1 c1cc2c(n[nH]c2nc1)N A2Z00009553 [0,1,0,1,0,0|1,0,0]=3 265 B11R2.1 c1ccc2c(c1)c(n[nH]2)N A2Z00087099 [0,1,0,1,0,0|2,0,0]=4 266 B11R2.1 c1ccc2c(c1)c(n[nH]2)O A2Z00061517 [0,1,0,1,0,0|1,0,1]=4 267 B7R1.1 c1cc([nH]c1)CN A2Z00061420 [1,0,0,0,1,0|0,0,2]=4 268 B7R1.1 c1csc(n1)CN A2Z00061547 [1,0,0,0,1,0|1,0,1]=4 269 B7R1.1 c1cscc1C=O A2Z00050189 [1,0,0,0,1,0|1,0,0]=3 270 B11R1.91 c1c(cncn1)CCC(=O)O A2Z00050326 [0,0,0,0,0,2|2,0,0]=4 271 B11R1.91 c1cc(cnc1)NCC(=O)O A2Z00049604 [0,0,0,0,0,2|1,0,0]=3 272 B11R1.91 c1cc(cnc1)\C=C\[N+](=O)[O-] A2Z00049852 [0,0,0,0,0,2|2,0,0]=4 273 B11R1.91 c1ccc(cc1)NCC(=O)O A2Z00087068 [0,0,0,0,0,2|2,0,0]=4 274 B11R1.91 c1ccc(cc1)OCC(=S)N A2Z00038412 [0,0,0,0,0,2|1,1,0]=4