0 B10R1.18 c1ccc(cc1)CC(=O)Cl A2Z00093442 [0,0,0,0,0,0|1,0,0]=1 1 B10R1.18 c1ccc(cc1)CC(=S)N A2Z00083382 [0,0,0,0,0,0|1,1,0]=2 2 B10R1.18 c1ccc(cc1)SC(F)F A2Z00049186 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.8 CNCc1ccccc1 A2Z00093451 [1,0,0,0,0,0|2,0,0]=3 4 B9R1.8 [C]=NCc1ccccc1 A2Z00049869 [1,0,0,0,0,0|2,0,0]=3 5 B9R1.8 c1ccc(cc1)CC#N A2Z00093470 [1,0,0,0,0,0|1,0,1]=3 6 B9R1.8 c1ccc(cc1)CCBr A2Z00093579 [1,0,0,0,0,0|1,0,1]=3 7 B9R1.8 c1ccc(cc1)CCN A2Z00046190 [1,0,0,0,0,0|1,0,1]=3 8 B9R1.8 c1ccc(cc1)CNN A2Z00062153 [1,0,0,0,0,0|2,0,0]=3 9 B9R1.8 c1ccnc(c1)CC#N A2Z00097354 [1,0,0,0,0,0|2,0,1]=4 10 B11R1.20 CC(=O)Cc1ccc(cc1)Br A2Z00095994 [0,1,0,0,0,0|1,0,0]=2 11 B11R1.20 Cc1ccc(cc1)NC(=S)N A2Z00075032 [0,1,0,0,0,0|2,1,0]=4 12 B11R1.20 c1cc(ccc1CC(=O)O)O A2Z00062185 [0,1,0,0,0,0|0,0,0]=1 13 B11R1.36 CC(=O)C(c1ccccc1)O A2Z00049601 [0,1,0,0,0,0|1,0,0]=2 14 B11R1.36 c1ccc(cc1)C(C(=O)Cl)Cl A2Z00094848 [0,1,0,0,0,0|1,0,0]=2 15 B11R1.36 c1ccc(cc1)C(C(=O)O)Cl A2Z00094634 [0,1,0,0,0,0|0,0,0]=1 16 B11R1.40 CC(Cc1ccccc1)CN A2Z00046432 [0,1,0,0,0,0|2,0,1]=4 17 B11R1.40 C\C(=C/c1ccccc1)\C=O A2Z00038627 [0,1,0,0,0,0|1,0,1]=3 18 B11R1.40 c1ccc(cc1)CC(CO)N A2Z00045068 [0,1,0,0,0,0|1,0,1]=3 19 B11R1.40 c1ccc(cc1)NC(=O)CN A2Z00044283 [0,1,0,0,0,0|2,0,0]=3 20 B11R1.40 c1ccc(cc1)NC(=O)CO A2Z00068359 [0,1,0,0,0,0|1,0,0]=2 21 B11R1.86 Cc1cccc[n+]1CC(=O)C A2Z00058852 [0,1,0,0,0,0|2,0,0]=3 22 B11R1.86 Cc1ccccc1NC(=N)N A2Z00074248 [0,1,0,0,0,0|3,0,0]=4 23 B11R1.86 c1ccc(c(c1)CC(=O)O)F A2Z00061208 [0,1,0,0,0,0|0,0,0]=1 24 B11R1.157 CC(=O)Cc1cccc(c1)Br A2Z00095995 [0,1,0,0,0,0|1,0,0]=2 25 B11R1.157 CC(=O)Nc1ccnc(c1)Cl A2Z00029852 [0,1,0,0,0,0|3,0,0]=4 26 B11R1.157 CC(C)Cc1cccc(c1)N A2Z00048066 [0,1,0,0,0,0|2,0,1]=4 27 B11R1.157 CN(C)Cc1cccc(c1)O A2Z00049745 [0,1,0,0,0,0|3,0,0]=4 28 B11R1.157 Cc1cccc(c1)CC(=O)C A2Z00046562 [0,1,0,0,0,0|1,0,0]=2 29 B11R1.509 c1ccc(cc1)CS(=O)(=O)Cl A2Z00095204 [0,1,0,0,0,0|1,0,1]=3 30 B11R2.10 Cc1cc2ccccc2s1 A2Z00094894 [0,0,0,1,0,0|1,1,1]=4 31 B11R2.10 Cc1nc2ccccc2s1 A2Z00096101 [0,0,0,1,0,0|2,1,0]=4 32 B11R2.10 c1cc2c([nH]c(=O)o2)nc1 A2Z00069818 [0,0,0,1,0,0|2,0,0]=3 33 B11R2.10 c1ccc2c(c1)[nH]c(n2)Cl A2Z00074312 [0,0,0,1,0,0|3,0,0]=4 34 B11R2.10 c1ccc2c(c1)nc(s2)N A2Z00007218 [0,0,0,1,0,0|2,1,0]=4 35 B11R2.10 c1ccc2c(c1)nc(s2)S A2Z00098102 [0,0,0,1,0,0|1,2,0]=4 36 B9R1.6 CC(=O)c1ccncc1 A2Z00096088 [0,0,0,0,1,0|2,0,0]=3 37 B9R1.6 CC(c1ccccc1)N A2Z00093463 [0,0,0,0,1,0|2,0,1]=4 38 B9R1.6 c1cc(cnc1)C(=O)Cl A2Z00046508 [0,0,0,0,1,0|2,0,0]=3 39 B9R1.6 c1ccc(cc1)C(=N)N A2Z00096156 [0,0,0,0,1,0|2,0,0]=3 40 B9R1.6 c1cnc(cn1)C(=O)O A2Z00085941 [0,0,0,0,1,0|2,0,0]=3 41 B9R1.6 c1cnccc1C(=S)N A2Z00098301 [0,0,0,0,1,0|2,1,0]=4 42 B9R1.13 c1c(ncs1)CC(=O)O A2Z00061633 [0,0,0,0,1,0|2,0,0]=3 43 B9R1.13 c1c[nH]nc1CC(=O)O A2Z00050347 [0,0,0,0,1,0|2,0,0]=3 44 B9R1.13 c1cc(oc1)CC(=O)O A2Z00061737 [0,0,0,0,1,0|1,0,0]=2 45 B9R1.13 c1cc(sc1)CC(=O)Cl A2Z00094074 [0,0,0,0,1,0|2,0,0]=3 46 B9R1.13 c1cc(sc1)CC(=O)N A2Z00095950 [0,0,0,0,1,0|2,0,0]=3 47 B9R1.13 c1cc(sc1)CC(=O)O A2Z00095935 [0,0,0,0,1,0|1,0,0]=2 48 B9R1.13 c1cn[nH]c1CC(=O)O A2Z00096237 [0,0,0,0,1,0|2,0,0]=3 49 B11R1.91 CC(=O)NCc1ccccn1 A2Z00094956 [0,0,0,0,0,1|2,0,0]=3 50 B11R1.91 CC(C)NCc1ccccc1 A2Z00093460 [0,0,0,0,0,1|2,0,1]=4 51 B11R1.91 c1c(cncn1)CCC(=O)O A2Z00050326 [0,0,0,0,0,1|2,0,0]=3 52 B11R1.91 c1cc(cnc1)NCC(=O)O A2Z00049604 [0,0,0,0,0,1|1,0,0]=2 53 B11R1.91 c1ccc(cc1)NCC(=O)O A2Z00087068 [0,0,0,0,0,1|0,0,0]=1 54 B11R1.91 c1ccc(cc1)OCC(=S)N A2Z00038412 [0,0,0,0,0,1|1,1,0]=3 55 B11R1.91 c1ccnc(c1)CCC(=O)O A2Z00094491 [0,0,0,0,0,1|1,0,0]=2 56 B11R1.91 c1cnccc1\C=C\C(=O)O A2Z00094281 [0,0,0,0,0,1|1,0,1]=3 57 B8R1.2 CCc1ccncc1 A2Z00096081 [2,0,0,0,0,0|1,0,1]=4 58 B8R1.2 CSc1ccccc1 A2Z00096090 [2,0,0,0,0,0|1,0,1]=4 59 B8R1.2 c1cc(cnc1)CN A2Z00093433 [2,0,0,0,0,0|2,0,0]=4 60 B8R1.2 c1ccc(cc1)CN A2Z00095042 [2,0,0,0,0,0|1,0,0]=3 61 B10R1.1 CCCc1ccc(cc1)O A2Z00038635 [1,1,0,0,0,0|1,0,1]=4 62 B10R1.1 c1cc(ccc1CC#N)Cl A2Z00038621 [1,1,0,0,0,0|1,0,1]=4 63 B10R1.1 c1cc(ccc1CC#N)F A2Z00095964 [1,1,0,0,0,0|1,0,1]=4 64 B10R1.1 c1cc(ccc1CCN)F A2Z00093996 [1,1,0,0,0,0|1,0,1]=4 65 B10R1.1 c1cc(ccc1CCN)O A2Z00038672 [1,1,0,0,0,0|1,0,1]=4 66 B10R1.1 c1cc(ccc1CCO)Br A2Z00098377 [1,1,0,0,0,0|0,0,1]=3 67 B10R1.4 C=CCc1ccccc1O A2Z00093534 [1,1,0,0,0,0|1,0,0]=3 68 B10R1.4 c1ccc(c(c1)CCN)F A2Z00097645 [1,1,0,0,0,0|1,0,1]=4 69 B10R1.4 c1ccc(c(c1)CCN)O A2Z00049546 [1,1,0,0,0,0|1,0,1]=4 70 B10R1.10 CNCc1cccc(c1)O A2Z00038697 [1,1,0,0,0,0|2,0,0]=4 71 B10R1.10 Cc1cccc(c1)CCN A2Z00046191 [1,1,0,0,0,0|1,0,1]=4 72 B10R1.10 c1cc(cc(c1)Cl)CCN A2Z00093997 [1,1,0,0,0,0|1,0,1]=4 73 B10R1.15 CC(C#N)c1ccccc1 A2Z00070459 [1,1,0,0,0,0|1,0,1]=4 74 B10R1.15 CC(c1ccccc1)NO A2Z00047942 [1,1,0,0,0,0|1,0,0]=3 75 B10R1.15 c1ccc(cc1)C(=O)C=O A2Z00094839 [1,1,0,0,0,0|0,0,1]=3 76 B10R1.17 CCNCc1ccccc1 A2Z00093459 [1,1,0,0,0,0|1,0,1]=4 77 B10R1.17 c1ccc(cc1)CCNN A2Z00095988 [1,1,0,0,0,0|1,0,1]=4 78 B10R1.17 c1ccc(cc1)CCNN A2Z00096724 [1,1,0,0,0,0|1,0,1]=4 79 B10R1.17 c1ccc(cc1)CN=C=O A2Z00094082 [1,1,0,0,0,0|0,0,1]=3 80 B10R1.17 c1ccc(cc1)CN=[N+]=[N-] A2Z00096066 [1,1,0,0,0,0|2,0,0]=4 81 B10R1.17 c1ccc(cc1)OCC#N A2Z00093923 [1,1,0,0,0,0|1,0,1]=4 82 B10R1.17 c1ccc(cc1)OCCO A2Z00038602 [1,1,0,0,0,0|0,0,1]=3 83 B10R1.17 c1ccc(cc1)OCCS A2Z00049974 [1,1,0,0,0,0|0,1,1]=4 84 B10R1.17 c1ccc(cc1)\C=C\C=O A2Z00038623 [1,1,0,0,0,0|0,0,1]=3 85 B10R1.13 CC(=O)c1ccc(cc1)Cl A2Z00038583 [0,1,0,0,1,0|1,0,0]=3 86 B10R1.13 Cc1ccc(cc1)C(=O)O A2Z00030670 [0,1,0,0,1,0|0,0,0]=2 87 B10R1.13 Cc1ccc(cc1)C(=S)N A2Z00038400 [0,1,0,0,1,0|1,1,0]=4 88 B10R1.13 Cc1cnc(cn1)C(=O)O A2Z00096093 [0,1,0,0,1,0|2,0,0]=4 89 B10R1.13 c1c(ncc(n1)Br)C(=O)O A2Z00050258 [0,1,0,0,1,0|2,0,0]=4 90 B10R1.13 c1c(ncc(n1)O)C(=O)O A2Z00096301 [0,1,0,0,1,0|2,0,0]=4 91 B10R1.13 c1cc(=O)[nH]cc1C(=O)O A2Z00094278 [0,1,0,0,1,0|1,0,0]=3 92 B10R1.13 c1cc(=O)[nH]nc1C(=O)O A2Z00083465 [0,1,0,0,1,0|2,0,0]=4 93 B10R1.13 c1cc(ccc1C(=N)N)Cl A2Z00098490 [0,1,0,0,1,0|2,0,0]=4 94 B10R1.13 c1cc(ccc1C(=N)N)N A2Z00050462 [0,1,0,0,1,0|2,0,0]=4 95 B10R1.13 c1cc(ccc1C(=N)N)O A2Z00070221 [0,1,0,0,1,0|2,0,0]=4 96 B10R1.13 c1cc(ccc1C(=O)N)Br A2Z00038699 [0,1,0,0,1,0|1,0,0]=3 97 B10R1.13 c1cc(ccc1C(=O)N)O A2Z00093462 [0,1,0,0,1,0|1,0,0]=3 98 B10R1.13 c1cc(ccc1C(=O)O)Br A2Z00093455 [0,1,0,0,1,0|0,0,0]=2 99 B10R1.13 c1cc(ccc1C(=O)O)F A2Z00038620 [0,1,0,0,1,0|0,0,0]=2 100 B10R1.13 c1cc(ccc1C(=O)O)N A2Z00093468 [0,1,0,0,1,0|0,0,0]=2 101 B10R1.13 c1cc(ccc1C(=S)N)Br A2Z00085460 [0,1,0,0,1,0|1,1,0]=4 102 B10R1.13 c1cc(ccc1C(=S)N)Cl A2Z00038403 [0,1,0,0,1,0|1,1,0]=4 103 B10R1.13 c1cc(ccc1C(=S)N)F A2Z00093909 [0,1,0,0,1,0|1,1,0]=4 104 B10R1.13 c1cc(ccc1S(=O)Cl)Cl A2Z00049702 [0,1,0,0,1,0|2,0,0]=4 105 B10R1.13 c1cc(ccc1[N+](=O)[O-])Cl A2Z00093555 [0,1,0,0,1,0|1,0,1]=4 106 B10R1.13 c1cc(ncc1C(=O)O)Cl A2Z00096110 [0,1,0,0,1,0|1,0,0]=3 107 B10R1.13 c1cc(nnc1C(=O)O)Cl A2Z00049654 [0,1,0,0,1,0|2,0,0]=4 108 B10R1.61 CC(=O)c1ccncc1F A2Z00096478 [0,1,0,0,1,0|2,0,0]=4 109 B10R1.61 Cc1ccccc1C(=O)N A2Z00085447 [0,1,0,0,1,0|1,0,0]=3 110 B10R1.61 c1c(c(ncn1)C(=O)O)Br A2Z00068773 [0,1,0,0,1,0|2,0,0]=4 111 B10R1.61 c1cc(c(=O)[nH]c1)C(=O)O A2Z00085542 [0,1,0,0,1,0|1,0,0]=3 112 B10R1.61 c1cc(c(nc1)Cl)C(=O)O A2Z00050195 [0,1,0,0,1,0|1,0,0]=3 113 B10R1.61 c1ccc(c(c1)C(=N)N)F A2Z00074261 [0,1,0,0,1,0|2,0,0]=4 114 B10R1.61 c1ccc(c(c1)C(=O)N)O A2Z00062157 [0,1,0,0,1,0|1,0,0]=3 115 B10R1.61 c1ccc(c(c1)C(=O)O)Br A2Z00093939 [0,1,0,0,1,0|0,0,0]=2 116 B10R1.61 c1ccc(c(c1)C(=O)O)F A2Z00093478 [0,1,0,0,1,0|0,0,0]=2 117 B10R1.61 c1ccc(c(c1)C(=O)O)I A2Z00093586 [0,1,0,0,1,0|0,0,0]=2 118 B10R1.61 c1ccc(c(c1)C(=O)O)N A2Z00070269 [0,1,0,0,1,0|0,0,0]=2 119 B10R1.61 c1ccc(c(c1)C(=O)O)O A2Z00038631 [0,1,0,0,1,0|0,0,0]=2 120 B10R1.61 c1ccc(c(c1)C(=S)N)Cl A2Z00098305 [0,1,0,0,1,0|1,1,0]=4 121 B10R1.61 c1ccc(c(c1)C(=S)N)F A2Z00038401 [0,1,0,0,1,0|1,1,0]=4 122 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])Cl A2Z00093554 [0,1,0,0,1,0|1,0,1]=4 123 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])O A2Z00034985 [0,1,0,0,1,0|1,0,1]=4 124 B10R1.113 CC(=O)c1cccc(c1)Cl A2Z00095936 [0,1,0,0,1,0|1,0,0]=3 125 B10R1.113 Cc1cc(ccn1)C(=O)O A2Z00096178 [0,1,0,0,1,0|1,0,0]=3 126 B10R1.113 Cc1cc(cnc1)C(=O)O A2Z00096067 [0,1,0,0,1,0|1,0,0]=3 127 B10R1.113 c1c(cncc1N)C(=O)O A2Z00009581 [0,1,0,0,1,0|1,0,0]=3 128 B10R1.113 c1c(nc[nH]c1=O)C(=O)O A2Z00094899 [0,1,0,0,1,0|2,0,0]=4 129 B10R1.113 c1c(ncnc1Cl)C(=O)O A2Z00094900 [0,1,0,0,1,0|2,0,0]=4 130 B10R1.113 c1cc(c[n+](c1)[O-])C(=O)N A2Z00098097 [0,1,0,0,1,0|2,0,0]=4 131 B10R1.113 c1cc(cc(c1)Br)[N+](=O)[O-] A2Z00097373 [0,1,0,0,1,0|1,0,1]=4 132 B10R1.113 c1cc(cc(c1)Cl)C(=O)Cl A2Z00095909 [0,1,0,0,1,0|1,0,0]=3 133 B10R1.113 c1cc(cc(c1)Cl)C(=O)N A2Z00095951 [0,1,0,0,1,0|1,0,0]=3 134 B10R1.113 c1cc(cc(c1)F)C(=O)O A2Z00085462 [0,1,0,0,1,0|0,0,0]=2 135 B10R1.113 c1cc(cc(c1)N)C(=O)O A2Z00083929 [0,1,0,0,1,0|0,0,0]=2 136 B10R1.113 c1cc(nc(c1)Cl)C(=O)O A2Z00050531 [0,1,0,0,1,0|1,0,0]=3 137 B10R1.113 c1cnc(cc1Br)C(=O)O A2Z00009551 [0,1,0,0,1,0|1,0,0]=3 138 B10R1.113 c1cnc(cc1C(=O)O)Cl A2Z00096019 [0,1,0,0,1,0|1,0,0]=3 139 B10R1.113 c1cnc(cc1C(=O)O)O A2Z00096024 [0,1,0,0,1,0|1,0,0]=3 140 B10R1.113 c1cnc(cc1O)C(=O)O A2Z00009579 [0,1,0,0,1,0|1,0,0]=3 141 B10R1.27 COC(=O)Cc1cc[nH]n1 A2Z00050448 [0,1,0,0,1,0|2,0,0]=4 142 B10R1.27 COC(=O)Cc1cccs1 A2Z00095990 [0,1,0,0,1,0|1,0,0]=3 143 B10R1.54 Cc1cc(no1)CC(=O)O A2Z00047214 [0,1,0,0,1,0|2,0,0]=4 144 B10R1.54 Cc1ccc(o1)CC(=O)O A2Z00049556 [0,1,0,0,1,0|1,0,0]=3 145 B10R1.54 Cc1nc(co1)CC(=O)O A2Z00049434 [0,1,0,0,1,0|2,0,0]=4 146 B10R1.54 c1cc(sc1CC(=O)O)Br A2Z00050168 [0,1,0,0,1,0|1,0,0]=3 147 B10R1.64 c1csc(=N)n1CC(=O)O A2Z00062728 [0,1,0,0,1,0|2,0,0]=4 148 B12R1.21 CC(=O)CCc1ccc(cc1)Br A2Z00049942 [0,1,0,0,0,1|1,0,0]=3 149 B12R1.21 Cc1cc[n+](cc1)CCC(=O)O A2Z00069168 [0,1,0,0,0,1|1,0,0]=3 150 B12R1.21 Cc1ccc(cc1)CCC(=O)O A2Z00082764 [0,1,0,0,0,1|0,0,0]=2 151 B12R1.21 Cc1ccc(cc1)OCC(=O)Cl A2Z00038613 [0,1,0,0,0,1|1,0,0]=3 152 B12R1.21 Cc1ccc(cc1)OCC(=O)O A2Z00097825 [0,1,0,0,0,1|0,0,0]=2 153 B12R1.21 Cc1ccc(cc1)\C=C\C(=O)O A2Z00036119 [0,1,0,0,0,1|0,0,1]=3 154 B12R1.21 c1cc(ccc1CCC(=O)O)Cl A2Z00038303 [0,1,0,0,0,1|0,0,0]=2 155 B12R1.21 c1cc(ccc1CCC(=O)O)F A2Z00039157 [0,1,0,0,0,1|0,0,0]=2 156 B12R1.21 c1cc(ccc1CCC(=O)O)O A2Z00096742 [0,1,0,0,0,1|0,0,0]=2 157 B12R1.21 c1cc(ccc1NCC(=O)O)Cl A2Z00056215 [0,1,0,0,0,1|0,0,0]=2 158 B12R1.21 c1cc(ccc1SCC(=O)O)Br A2Z00096549 [0,1,0,0,0,1|0,0,0]=2 159 B12R1.21 c1cc(ccc1\C=C\C(=O)O)Br A2Z00094527 [0,1,0,0,0,1|0,0,1]=3 160 B12R1.21 c1cc(ccc1\C=C\C(=O)O)Cl A2Z00034000 [0,1,0,0,0,1|0,0,1]=3 161 B12R1.21 c1cc(ccc1\C=C\C(=O)O)F A2Z00093401 [0,1,0,0,0,1|0,0,1]=3 162 B12R1.21 c1cc(ncc1CCC(=O)O)N A2Z00097668 [0,1,0,0,0,1|1,0,0]=3 163 B12R1.27 COC(=O)CCc1cncnc1 A2Z00096619 [0,1,0,0,0,1|2,0,0]=4 164 B12R1.27 c1ccc(cc1)CCC(=O)CBr A2Z00094984 [0,1,0,0,0,1|1,0,0]=3 165 B12R1.27 c1ccc(cc1)CNC(=O)CCl A2Z00097817 [0,1,0,0,0,1|1,0,0]=3 166 B12R1.27 c1ccc(cc1)CNC(=O)CO A2Z00068365 [0,1,0,0,0,1|0,0,0]=2 167 B12R1.27 c1ccc(cc1)OCC(=O)NN A2Z00039102 [0,1,0,0,0,1|1,0,0]=3 168 B12R1.43 CC(Cc1ccccc1)C(=O)O A2Z00046441 [0,1,0,0,0,1|0,0,0]=2 169 B12R1.43 C\C(=C/c1ccccc1)\C(=O)O A2Z00046434 [0,1,0,0,0,1|0,0,1]=3 170 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)N)N A2Z00087537 [0,1,0,0,0,1|1,0,0]=3 171 B12R1.43 c1ccnc(c1)NC(=O)C(=O)O A2Z00047055 [0,1,0,0,0,1|1,0,1]=4 172 B12R1.107 CC(=O)CC(=O)c1ccccc1 A2Z00094722 [0,1,0,0,0,1|1,0,0]=3 173 B12R1.107 CC(CC(=O)O)c1ccccc1 A2Z00094013 [0,1,0,0,0,1|0,0,0]=2 174 B12R1.107 C\C(=C/C(=O)O)\c1ccccc1 A2Z00046260 [0,1,0,0,0,1|0,0,1]=3 175 B12R1.125 CC(=O)COc1ccccc1Br A2Z00094587 [0,1,0,0,0,1|1,0,0]=3 176 B12R1.125 Cc1ccccc1NCC(=O)O A2Z00083483 [0,1,0,0,0,1|0,0,0]=2 177 B12R1.125 Cc1ccccc1OCC(=S)N A2Z00038413 [0,1,0,0,0,1|1,1,0]=4 178 B12R1.125 c1ccc(c(c1)CCC(=O)O)Cl A2Z00095189 [0,1,0,0,0,1|0,0,0]=2 179 B12R1.125 c1ccc(c(c1)CCC(=O)O)F A2Z00039158 [0,1,0,0,0,1|0,0,0]=2 180 B12R1.125 c1ccc(c(c1)OCC(=O)Cl)Cl A2Z00069792 [0,1,0,0,0,1|1,0,0]=3 181 B12R1.125 c1ccc(c(c1)OCC(=O)O)Cl A2Z00062552 [0,1,0,0,0,1|0,0,0]=2 182 B12R1.125 c1ccc(c(c1)\C=C\C(=O)O)Cl A2Z00033999 [0,1,0,0,0,1|0,0,1]=3 183 B12R1.125 c1ccc(c(c1)\C=C\C(=O)O)F A2Z00095186 [0,1,0,0,0,1|0,0,1]=3 184 B12R1.226 CC(=O)CCc1cccc(c1)Cl A2Z00094749 [0,1,0,0,0,1|1,0,0]=3 185 B12R1.226 CC(=O)COc1cccc(c1)Br A2Z00094586 [0,1,0,0,0,1|1,0,0]=3 186 B12R1.226 c1cc(cc(c1)Br)OCC(=O)O A2Z00078437 [0,1,0,0,0,1|0,0,0]=2 187 B12R1.226 c1cc(cc(c1)Cl)CCC(=O)O A2Z00095187 [0,1,0,0,0,1|0,0,0]=2 188 B12R1.226 c1cc(cc(c1)Cl)\C=C\C(=O)O A2Z00038051 [0,1,0,0,0,1|0,0,1]=3 189 B12R1.226 c1cc(cc(c1)F)CCC(=O)O A2Z00094264 [0,1,0,0,0,1|0,0,0]=2 190 B12R1.226 c1cc(cc(c1)F)\C=C\C(=O)O A2Z00097969 [0,1,0,0,0,1|0,0,1]=3 191 B12R1.891 c1ccc(cc1)CCS(=O)(=O)Cl A2Z00041387 [0,1,0,0,0,1|1,0,1]=4 192 B12R1.891 c1ccc(cc1)CCS(=O)(=O)O A2Z00009461 [0,1,0,0,0,1|1,0,0]=3 193 B12R1.4 CC(=O)Nc1ccc(cc1)C#N A2Z00050196 [0,2,0,0,0,0|2,0,0]=4 194 B12R1.4 CNc1ccc(cc1)CC(=O)O A2Z00049371 [0,2,0,0,0,0|0,0,0]=2 195 B12R1.4 COc1ccc(cc1)CC(=O)Cl A2Z00094314 [0,2,0,0,0,0|1,0,0]=3 196 B12R1.4 COc1ccc(cc1)CC(=O)O A2Z00093941 [0,2,0,0,0,0|0,0,0]=2 197 B12R1.4 COc1ccc(cc1)CC(=S)N A2Z00097997 [0,2,0,0,0,0|1,1,0]=4 198 B12R1.19 Cc1ccc(cc1Br)CC(=O)O A2Z00049493 [0,2,0,0,0,0|0,0,0]=2 199 B12R1.20 C=C(c1ccc(cc1)Cl)C(=O)O A2Z00062149 [0,2,0,0,0,0|0,0,1]=3 200 B12R1.20 CC(=O)C(=O)c1ccc(cc1)Br A2Z00049455 [0,2,0,0,0,0|1,0,1]=4 201 B12R1.20 CC(=O)C(=O)c1ccc(cc1)F A2Z00049436 [0,2,0,0,0,0|1,0,1]=4 202 B12R1.20 CC(=O)N(C)c1ccc(cc1)O A2Z00068350 [0,2,0,0,0,0|2,0,0]=4 203 B12R1.20 CC(c1ccc(cc1)Br)C(=O)O A2Z00047901 [0,2,0,0,0,0|0,0,0]=2 204 B12R1.20 Cc1ccc(cc1)C(C)C(=O)O A2Z00094214 [0,2,0,0,0,0|0,0,0]=2 205 B12R1.20 c1cc(ccc1C(C(=O)O)Cl)Cl A2Z00049239 [0,2,0,0,0,0|0,0,0]=2 206 B12R1.49 COC(=O)Cc1ccc(cc1)N A2Z00094801 [0,2,0,0,0,0|0,0,0]=2 207 B12R1.49 Cc1ccc(cc1)NC(=O)CCl A2Z00075121 [0,2,0,0,0,0|2,0,0]=4 208 B12R1.49 Cc1ccc(cc1)NC(=O)CO A2Z00068361 [0,2,0,0,0,0|1,0,0]=3 209 B12R1.49 Cc1ccc(cc1)NC(=O)CS A2Z00029474 [0,2,0,0,0,0|1,1,0]=4 210 B12R1.49 Cc1ccc(cc1)OC(=O)CN A2Z00049394 [0,2,0,0,0,0|2,0,0]=4 211 B12R1.49 c1cc(ccc1NC(=O)CO)F A2Z00068363 [0,2,0,0,0,0|1,0,0]=3 212 B12R1.49 c1cc(ccc1NC(=O)CS)F A2Z00064160 [0,2,0,0,0,0|1,1,0]=4 213 B12R1.106 Cc1ccc(cc1)CS(=O)(=O)Cl A2Z00095209 [0,2,0,0,0,0|1,0,1]=4 214 B12R1.106 c1cc(ccc1CS(=O)(=O)Cl)Cl A2Z00095211 [0,2,0,0,0,0|1,0,1]=4 215 B12R1.106 c1cc(ccc1CS(=O)(=O)Cl)F A2Z00095210 [0,2,0,0,0,0|1,0,1]=4 216 B12R1.34 CCC(=O)N(C)c1ccccc1 A2Z00095184 [0,2,0,0,0,0|2,0,0]=4 217 B12R1.34 COC(=O)C(c1ccccc1)N A2Z00096034 [0,2,0,0,0,0|0,0,0]=2 218 B12R1.253 CC(C)(c1ccccc1)C(=O)O A2Z00095299 [0,2,0,0,0,0|0,0,0]=2 219 B12R1.32 COCC(=O)Nc1ccccc1 A2Z00070375 [0,2,0,0,0,0|1,0,0]=3 220 B12R1.32 c1ccc(cc1)NC(=O)CC#N A2Z00097866 [0,2,0,0,0,0|2,0,0]=4 221 B12R1.32 c1ccc(cc1)NC(=O)CCS A2Z00069989 [0,2,0,0,0,0|1,1,0]=4 222 B12R1.50 Cc1cccc(c1)NC(=O)CN A2Z00044975 [0,2,0,0,0,0|2,0,0]=4 223 B12R1.50 Cc1cccc(c1)NC(=O)CO A2Z00068360 [0,2,0,0,0,0|1,0,0]=3 224 B12R1.50 Cc1cccc(c1)NC(=O)CS A2Z00064158 [0,2,0,0,0,0|1,1,0]=4 225 B12R1.50 Cc1cccc(c1)OC(=O)CN A2Z00049393 [0,2,0,0,0,0|2,0,0]=4 226 B12R1.50 c1cc(cc(c1)Br)NC(=O)CCl A2Z00099282 [0,2,0,0,0,0|2,0,0]=4 227 B12R1.50 c1cc(cc(c1)Cl)NC(=O)CO A2Z00068364 [0,2,0,0,0,0|1,0,0]=3 228 B12R1.371 COC(=O)Cc1ccccc1F A2Z00095983 [0,2,0,0,0,0|0,0,0]=2 229 B12R1.371 Cc1ccccc1CC(=O)OC A2Z00095982 [0,2,0,0,0,0|0,0,0]=2 230 B12R1.371 Cc1ccccc1OC(=O)CN A2Z00049392 [0,2,0,0,0,0|2,0,0]=4 231 B12R1.75 COc1ccccc1CC(=O)O A2Z00095972 [0,2,0,0,0,0|0,0,0]=2 232 B12R1.75 CSc1ccccc1CC(=O)O A2Z00061735 [0,2,0,0,0,0|0,0,0]=2 233 B12R1.127 c1cc(=O)n([nH]c1=O)CC(=O)O A2Z00083406 [0,2,0,0,0,0|2,0,0]=4 234 B12R1.127 c1cc(c(cc1Br)CC(=O)O)F A2Z00095959 [0,2,0,0,0,0|0,0,0]=2 235 B12R1.151 Cc1ccccc1CS(=O)(=O)Cl A2Z00041381 [0,2,0,0,0,0|1,0,1]=4 236 B12R1.151 c1ccc(c(c1)CS(=O)(=O)Cl)Cl A2Z00041383 [0,2,0,0,0,0|1,0,1]=4 237 B12R1.224 Cc1cccn(c1=O)CC(=O)O A2Z00069277 [0,2,0,0,0,0|1,0,0]=3 238 B12R1.224 Cc1cccn(c1=O)CC(=O)[O-] A2Z00069969 [0,2,0,0,0,0|1,0,1]=4 239 B12R1.119 Cc1cccc(c1)CS(=O)(=O)Cl A2Z00041382 [0,2,0,0,0,0|1,0,1]=4 240 B10R1.66 c1cc([nH]c1)CCC(=O)O A2Z00094982 [0,0,1,1,0,0|1,0,1]=4 241 B10R1.66 c1cc([nH]c1)\C=C\C(=O)O A2Z00094929 [0,0,1,1,0,0|1,0,1]=4 242 B10R1.66 c1cc(oc1)CCC(=O)O A2Z00095303 [0,0,1,1,0,0|1,0,1]=4 243 B10R1.66 c1cc(oc1)\C=C\C(=O)O A2Z00085545 [0,0,1,1,0,0|1,0,1]=4 244 B10R1.66 c1cc(sc1)CCC(=O)O A2Z00095188 [0,0,1,1,0,0|1,0,1]=4 245 B10R1.66 c1cc(sc1)\C=C\C(=O)O A2Z00096656 [0,0,1,1,0,0|1,0,1]=4 246 B10R1.66 c1cscc1\C=C\C(=O)O A2Z00096366 [0,0,1,1,0,0|1,0,1]=4 247 B10R2.6 c1ccc(cc1)C2CN2 A2Z00049782 [1,0,0,1,0,0|1,0,1]=4 248 B12R2.24 CC1CNc2ccccc2O1 A2Z00070209 [0,0,0,1,0,1|1,0,1]=4 249 B12R2.24 c1cc2c(nc1)NC(=O)CO2 A2Z00068733 [0,0,0,1,0,1|2,0,0]=4 250 B12R2.24 c1ccc2c(c1)CCC(=O)N2 A2Z00074166 [0,0,0,1,0,1|1,0,0]=3 251 B12R2.24 c1ccc2c(c1)NC(=O)CO2 A2Z00083158 [0,0,0,1,0,1|1,0,0]=3 252 B12R2.24 c1ccc2c(c1)NCC(=O)N2 A2Z00039095 [0,0,0,1,0,1|1,0,0]=3 253 B12R2.606 Cc1nc2cc(ccc2o1)O A2Z00070118 [0,1,0,1,0,0|2,0,0]=4 254 B12R2.606 Cc1nc2ccc(cc2o1)O A2Z00070115 [0,1,0,1,0,0|2,0,0]=4 255 B12R2.606 c1cc2c(cc1Br)CC(=O)N2 A2Z00094309 [0,1,0,1,0,0|1,0,0]=3 256 B12R2.606 c1cc2c(cc1N)CC(=O)N2 A2Z00095275 [0,1,0,1,0,0|1,0,0]=3 257 B12R2.606 c1cc2c(cc1N)[nH]c(=O)o2 A2Z00046405 [0,1,0,1,0,0|1,0,0]=3 258 B12R2.606 c1cc2c(cc1N)oc(=O)[nH]2 A2Z00094049 [0,1,0,1,0,0|1,0,0]=3 259 B12R2.606 c1cc2c(cc1O)sc(=O)o2 A2Z00017241 [0,1,0,1,0,0|1,0,0]=3 260 B12R2.18 CC1c2ccccc2NC1=O A2Z00049804 [0,1,0,1,0,0|1,0,0]=3 261 B12R2.18 Cn1c2ccccc2[nH]c1=O A2Z00085448 [0,1,0,1,0,0|2,0,0]=4 262 B12R2.32 c1ccc2c(c1)cc(o2)C=O A2Z00095921 [0,1,0,1,0,0|0,0,1]=3 263 B12R2.32 c1ccc2c(c1)cc(o2)CCl A2Z00096052 [0,1,0,1,0,0|1,0,1]=4 264 B12R2.32 c1ccc2c(c1)cc(o2)CN A2Z00096017 [0,1,0,1,0,0|1,0,1]=4 265 B12R2.32 c1ccc2c(c1)cc(o2)CO A2Z00096099 [0,1,0,1,0,0|0,0,2]=4 266 B12R2.32 c1ccc2c(c1)nc(o2)NN A2Z00017243 [0,1,0,1,0,0|2,0,0]=4 267 B12R2.202 c1cc(c2c(c1)[nH]c(=O)o2)N A2Z00046404 [0,1,0,1,0,0|1,0,0]=3 268 B12R2.202 c1cc(c2c(c1)oc(=O)[nH]2)N A2Z00070298 [0,1,0,1,0,0|1,0,0]=3 269 B12R2.202 c1cc2c(c(c1)Br)NC(=O)C2 A2Z00074262 [0,1,0,1,0,0|1,0,0]=3 270 B12R2.202 c1cc2c(c(c1)Cl)CC(=O)N2 A2Z00095173 [0,1,0,1,0,0|1,0,0]=3 271 B12R2.202 c1cc2c(c(c1)Cl)NC(=O)C2 A2Z00098390 [0,1,0,1,0,0|1,0,0]=3 272 B8R1.8 c1cc(sc1)CCO A2Z00095929 [1,0,0,0,1,0|1,0,1]=4 273 B8R1.7 CC(=O)c1cccs1 A2Z00050162 [0,0,0,0,2,0|2,0,0]=4 274 B8R1.7 c1c(ncs1)C(=O)O A2Z00061631 [0,0,0,0,2,0|2,0,0]=4 275 B8R1.7 c1cc([nH]c1)C(=O)O A2Z00070219 [0,0,0,0,2,0|1,0,0]=3 276 B8R1.7 c1cc(oc1)C(=O)O A2Z00093505 [0,0,0,0,2,0|1,0,0]=3 277 B8R1.7 c1cnoc1C(=O)O A2Z00096002 [0,0,0,0,2,0|2,0,0]=4 278 B12R1.252 c1cc(cnc1)CCCC(=O)O A2Z00049190 [0,0,0,0,0,2|1,0,0]=3 279 B12R1.252 c1ccc(cc1)CNCC(=O)O A2Z00095934 [0,0,0,0,0,2|0,0,0]=2 280 B12R1.252 c1ccc(cc1)NCCC(=O)O A2Z00094158 [0,0,0,0,0,2|0,0,0]=2 281 B12R1.252 c1ccc(cc1)OCCC(=O)O A2Z00077109 [0,0,0,0,0,2|0,0,0]=2 282 B12R1.252 c1ccc(cc1)SCCC(=O)O A2Z00085612 [0,0,0,0,0,2|0,0,0]=2