0 B10R1.15 CC(C#N)c1ccccc1 A2Z00070459 [0,0,0,0,0,0|2,0,2]=4 1 B10R1.15 CC(CN)c1ccccn1 A2Z00062148 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.15 CC(c1ccccc1)NO A2Z00047942 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.15 c1cc(cnc1)C(=O)CBr A2Z00094983 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.15 c1ccc(cc1)C(=O)C=O A2Z00094839 [0,0,0,0,0,0|1,0,1]=2 5 B9R1.6 CC(=O)c1ccncc1 A2Z00096088 [1,0,0,0,0,0|1,0,0]=2 6 B9R1.6 CC(c1ccccc1)N A2Z00093463 [1,0,0,0,0,0|1,0,1]=3 7 B9R1.6 c1cc(cnc1)C(=O)Cl A2Z00046508 [1,0,0,0,0,0|2,0,0]=3 8 B9R1.6 c1ccc(cc1)C(=N)N A2Z00096156 [1,0,0,0,0,0|2,0,0]=3 9 B9R1.6 c1cnc(cn1)C(=O)O A2Z00085941 [1,0,0,0,0,0|3,0,0]=4 10 B9R1.6 c1cnccc1C(=S)N A2Z00098301 [1,0,0,0,0,0|2,1,0]=4 11 B9R1.8 CNCc1ccccc1 A2Z00093451 [1,0,0,0,0,0|1,0,1]=3 12 B9R1.8 [C]=NCc1ccccc1 A2Z00049869 [1,0,0,0,0,0|1,0,2]=4 13 B9R1.8 c1ccc(cc1)CC#N A2Z00093470 [1,0,0,0,0,0|1,0,2]=4 14 B9R1.8 c1ccc(cc1)CCBr A2Z00093579 [1,0,0,0,0,0|1,0,1]=3 15 B9R1.8 c1ccc(cc1)CCN A2Z00046190 [1,0,0,0,0,0|1,0,1]=3 16 B9R1.8 c1ccc(cc1)CNN A2Z00062153 [1,0,0,0,0,0|2,0,1]=4 17 B11R1.7 CC(C)(CCl)c1ccccc1 A2Z00094297 [0,1,0,0,0,0|2,0,1]=4 18 B11R1.7 CC(C)(CN)c1ccccc1 A2Z00061567 [0,1,0,0,0,0|2,0,1]=4 19 B11R1.7 CC(C)(CO)c1ccccc1 A2Z00094293 [0,1,0,0,0,0|2,0,1]=4 20 B11R1.7 CC(CN)(c1ccccc1)O A2Z00046564 [0,1,0,0,0,0|1,0,2]=4 21 B11R1.7 CCC(C)(c1ccccc1)N A2Z00050519 [0,1,0,0,0,0|1,0,1]=3 22 B11R1.7 CCC(C)(c1ccccc1)N A2Z00070461 [0,1,0,0,0,0|1,0,1]=3 23 B11R1.16 CC(CCN)c1ccccc1 A2Z00046307 [0,1,0,0,0,0|1,0,1]=3 24 B11R1.16 CNCC(c1ccncc1)O A2Z00048067 [0,1,0,0,0,0|1,0,2]=4 25 B11R1.16 c1ccc(cc1)\C(=N\C#N)\N A2Z00094993 [0,1,0,0,0,0|2,0,1]=4 26 B11R1.22 CC(c1ccc(cc1)F)OC A2Z00094924 [0,1,0,0,0,0|2,0,1]=4 27 B11R1.22 CCC(=O)c1ccc(cc1)Br A2Z00094034 [0,1,0,0,0,0|0,0,0]=1 28 B11R1.22 CCC(=O)c1ccc(cc1)F A2Z00094033 [0,1,0,0,0,0|0,0,0]=1 29 B11R1.22 CNC(=O)c1ccc(cc1)Cl A2Z00053054 [0,1,0,0,0,0|1,0,0]=2 30 B11R1.22 COC(=O)c1ccc(nc1)N A2Z00070242 [0,1,0,0,0,0|2,0,0]=3 31 B11R1.22 COC(=O)c1cnc(cn1)Br A2Z00096452 [0,1,0,0,0,0|3,0,0]=4 32 B11R1.22 COC(=O)c1cnc(cn1)Cl A2Z00096393 [0,1,0,0,0,0|3,0,0]=4 33 B11R1.22 COC(=O)c1cnc(cn1)O A2Z00096407 [0,1,0,0,0,0|3,0,0]=4 34 B11R1.22 Cc1ccc(cc1)C(C)CO A2Z00049179 [0,1,0,0,0,0|2,0,1]=4 35 B11R1.22 Cc1cnc(cn1)C(=O)OC A2Z00096105 [0,1,0,0,0,0|3,0,0]=4 36 B11R1.22 c1cc(ccc1C(=O)CBr)Br A2Z00068657 [0,1,0,0,0,0|1,0,0]=2 37 B11R1.22 c1cc(ccc1C(=O)CCl)Cl A2Z00094275 [0,1,0,0,0,0|1,0,0]=2 38 B11R1.22 c1cc(ccc1C(=O)CCl)F A2Z00094272 [0,1,0,0,0,0|1,0,0]=2 39 B11R1.22 c1cc(ccc1C(=O)CN)F A2Z00094016 [0,1,0,0,0,0|1,0,0]=2 40 B11R1.22 c1cc(ccc1C(=O)NN)Br A2Z00014663 [0,1,0,0,0,0|2,0,0]=3 41 B11R1.22 c1cc(ccc1C(=O)NN)F A2Z00014685 [0,1,0,0,0,0|2,0,0]=3 42 B11R1.22 c1cc(ccc1C(CN)O)Br A2Z00094730 [0,1,0,0,0,0|1,0,2]=4 43 B11R1.22 c1cc(ccc1C(CN)O)Cl A2Z00046547 [0,1,0,0,0,0|1,0,2]=4 44 B11R1.23 COC(=O)c1cccc(c1)N A2Z00095938 [0,1,0,0,0,0|1,0,0]=2 45 B11R1.23 Cc1cccc(c1)C(=O)NN A2Z00014683 [0,1,0,0,0,0|2,0,0]=3 46 B11R1.23 c1cc(cc(c1)Br)C(CO)N A2Z00049261 [0,1,0,0,0,0|2,0,1]=4 47 B11R1.23 c1cc(cc(c1)Cl)C(=O)CBr A2Z00096150 [0,1,0,0,0,0|1,0,0]=2 48 B11R1.23 c1cc(cc(c1)Cl)C(=O)CN A2Z00096028 [0,1,0,0,0,0|1,0,0]=2 49 B11R1.23 c1cc(cc(c1)Cl)C(=O)NN A2Z00014653 [0,1,0,0,0,0|2,0,0]=3 50 B11R1.23 c1cc(cc(c1)Cl)C(CN)O A2Z00094086 [0,1,0,0,0,0|1,0,2]=4 51 B11R1.23 c1cc(cc(c1)O)C(=O)NN A2Z00014681 [0,1,0,0,0,0|2,0,0]=3 52 B11R1.36 CC(=O)C(c1ccccc1)O A2Z00049601 [0,1,0,0,0,0|0,0,3]=4 53 B11R1.222 CCC(=O)c1ccccc1Br A2Z00049411 [0,1,0,0,0,0|0,0,0]=1 54 B11R1.222 CNC(=O)c1ccccc1N A2Z00046099 [0,1,0,0,0,0|1,0,0]=2 55 B11R1.222 COC(=O)c1ccccc1Cl A2Z00095996 [0,1,0,0,0,0|1,0,0]=2 56 B11R1.222 COC(=O)c1ccccc1F A2Z00096107 [0,1,0,0,0,0|1,0,0]=2 57 B11R1.222 COC(=O)c1ccccc1N A2Z00096614 [0,1,0,0,0,0|1,0,0]=2 58 B11R1.222 COC(=O)c1ccccc1O A2Z00069275 [0,1,0,0,0,0|1,0,0]=2 59 B11R1.222 COC(=O)c1ccccc1S A2Z00096071 [0,1,0,0,0,0|1,0,0]=2 60 B11R1.222 Cc1ccccc1C(=O)OC A2Z00095993 [0,1,0,0,0,0|1,0,0]=2 61 B11R1.222 Cc1ccccc1\C(=N\O)\N A2Z00096102 [0,1,0,0,0,0|3,0,0]=4 62 B11R1.222 c1ccc(c(c1)C(=O)NN)Br A2Z00014686 [0,1,0,0,0,0|2,0,0]=3 63 B11R1.222 c1ccc(c(c1)C(=O)NN)F A2Z00014684 [0,1,0,0,0,0|2,0,0]=3 64 B11R1.222 c1ccc(c(c1)C(=O)NN)N A2Z00097814 [0,1,0,0,0,0|2,0,0]=3 65 B11R2.1 c1ccc2c(c1)c(n[nH]2)N A2Z00087099 [0,0,0,1,0,0|3,0,0]=4 66 B11R2.1 c1ccc2c(c1)c(n[nH]2)O A2Z00061517 [0,0,0,1,0,0|2,0,1]=4 67 B11R2.1 c1ccc2c(c1)c(no2)Br A2Z00050269 [0,0,0,1,0,0|3,0,0]=4 68 B11R2.1 c1ccc2c(c1)c(no2)O A2Z00096303 [0,0,0,1,0,0|2,0,1]=4 69 B11R2.40 c1ccc(cc1)C2(CC2)N A2Z00061568 [0,0,0,1,0,0|1,0,1]=3 70 B9R1.11 COC(=O)c1ccc[nH]1 A2Z00096428 [0,0,0,0,1,0|2,0,0]=3 71 B9R1.11 COC(=O)c1ccno1 A2Z00096471 [0,0,0,0,1,0|3,0,0]=4 72 B9R1.11 c1cc(oc1)C(=O)NN A2Z00053062 [0,0,0,0,1,0|3,0,0]=4 73 B9R1.11 c1cc(sc1)C(=O)CCl A2Z00057069 [0,0,0,0,1,0|2,0,0]=3 74 B9R1.11 c1cc(sc1)C(=O)NN A2Z00051543 [0,0,0,0,1,0|3,0,0]=4 75 B11R1.40 CC(CN)Oc1ccccc1 A2Z00038576 [0,0,0,0,0,1|2,0,1]=4 76 B11R1.40 CC(Cc1ccccc1)CN A2Z00046432 [0,0,0,0,0,1|2,0,1]=4 77 B11R1.40 C\C(=C/c1ccccc1)\C=O A2Z00038627 [0,0,0,0,0,1|2,0,1]=4 78 B11R1.40 c1ccc(cc1)CC(CO)N A2Z00045068 [0,0,0,0,0,1|2,0,1]=4 79 B11R1.40 c1ccc(cc1)NC(=O)CN A2Z00044283 [0,0,0,0,0,1|1,0,0]=2 80 B11R1.40 c1ccc(cc1)NC(=O)CO A2Z00068359 [0,0,0,0,0,1|1,0,0]=2 81 B8R1.2 CCc1ccncc1 A2Z00096081 [2,0,0,0,0,0|1,0,0]=3 82 B8R1.2 CSc1ccccc1 A2Z00096090 [2,0,0,0,0,0|1,0,0]=3 83 B8R1.2 c1cc(cnc1)CN A2Z00093433 [2,0,0,0,0,0|2,0,0]=4 84 B8R1.2 c1ccc(cc1)CN A2Z00095042 [2,0,0,0,0,0|1,0,0]=3 85 B10R1.13 CC(=O)c1ccc(cc1)Cl A2Z00038583 [1,1,0,0,0,0|0,0,0]=2 86 B10R1.13 CC(C)c1ccc(cc1)N A2Z00038646 [1,1,0,0,0,0|1,0,1]=4 87 B10R1.13 CC(C)c1ccc(cc1)O A2Z00093536 [1,1,0,0,0,0|1,0,1]=4 88 B10R1.13 CC(c1ccc(cc1)F)Cl A2Z00094295 [1,1,0,0,0,0|1,0,1]=4 89 B10R1.13 CN(C)c1ccc(cc1)Br A2Z00097376 [1,1,0,0,0,0|2,0,0]=4 90 B10R1.13 CN(c1ccc(cc1)F)N A2Z00049175 [1,1,0,0,0,0|2,0,0]=4 91 B10R1.13 Cc1ccc(cc1)C(=O)O A2Z00030670 [1,1,0,0,0,0|1,0,0]=3 92 B10R1.13 Cc1ccc(cc1)C(=S)N A2Z00038400 [1,1,0,0,0,0|1,1,0]=4 93 B10R1.13 c1cc(=O)[nH]cc1C(=O)O A2Z00094278 [1,1,0,0,0,0|2,0,0]=4 94 B10R1.13 c1cc(ccc1C(=N)N)Cl A2Z00098490 [1,1,0,0,0,0|2,0,0]=4 95 B10R1.13 c1cc(ccc1C(=N)N)N A2Z00050462 [1,1,0,0,0,0|2,0,0]=4 96 B10R1.13 c1cc(ccc1C(=N)N)O A2Z00070221 [1,1,0,0,0,0|2,0,0]=4 97 B10R1.13 c1cc(ccc1C(=O)N)Br A2Z00038699 [1,1,0,0,0,0|1,0,0]=3 98 B10R1.13 c1cc(ccc1C(=O)N)O A2Z00093462 [1,1,0,0,0,0|1,0,0]=3 99 B10R1.13 c1cc(ccc1C(=O)O)Br A2Z00093455 [1,1,0,0,0,0|1,0,0]=3 100 B10R1.13 c1cc(ccc1C(=O)O)F A2Z00038620 [1,1,0,0,0,0|1,0,0]=3 101 B10R1.13 c1cc(ccc1C(=O)O)N A2Z00093468 [1,1,0,0,0,0|1,0,0]=3 102 B10R1.13 c1cc(ccc1C(=S)N)Br A2Z00085460 [1,1,0,0,0,0|1,1,0]=4 103 B10R1.13 c1cc(ccc1C(=S)N)Cl A2Z00038403 [1,1,0,0,0,0|1,1,0]=4 104 B10R1.13 c1cc(ccc1C(=S)N)F A2Z00093909 [1,1,0,0,0,0|1,1,0]=4 105 B10R1.13 c1cc(ccc1S(=O)Cl)Cl A2Z00049702 [1,1,0,0,0,0|2,0,0]=4 106 B10R1.13 c1cc(ccc1[N+](=O)[O-])Cl A2Z00093555 [1,1,0,0,0,0|2,0,0]=4 107 B10R1.13 c1cc(ncc1C(=O)O)Cl A2Z00096110 [1,1,0,0,0,0|2,0,0]=4 108 B10R1.61 CC(=O)c1ccncc1F A2Z00096478 [1,1,0,0,0,0|1,0,0]=3 109 B10R1.61 CC(C)c1ccccc1N A2Z00038647 [1,1,0,0,0,0|1,0,1]=4 110 B10R1.61 CC(C)c1ccccc1O A2Z00093538 [1,1,0,0,0,0|1,0,1]=4 111 B10R1.61 CN(C)c1ccccc1Br A2Z00062284 [1,1,0,0,0,0|2,0,0]=4 112 B10R1.61 Cc1ccccc1C(=O)N A2Z00085447 [1,1,0,0,0,0|1,0,0]=3 113 B10R1.61 c1cc(c(=O)[nH]c1)C(=O)O A2Z00085542 [1,1,0,0,0,0|2,0,0]=4 114 B10R1.61 c1cc(c(nc1)Cl)C(=O)O A2Z00050195 [1,1,0,0,0,0|2,0,0]=4 115 B10R1.61 c1ccc(c(c1)C(=N)N)F A2Z00074261 [1,1,0,0,0,0|2,0,0]=4 116 B10R1.61 c1ccc(c(c1)C(=O)N)O A2Z00062157 [1,1,0,0,0,0|1,0,0]=3 117 B10R1.61 c1ccc(c(c1)C(=O)O)Br A2Z00093939 [1,1,0,0,0,0|1,0,0]=3 118 B10R1.61 c1ccc(c(c1)C(=O)O)F A2Z00093478 [1,1,0,0,0,0|1,0,0]=3 119 B10R1.61 c1ccc(c(c1)C(=O)O)I A2Z00093586 [1,1,0,0,0,0|1,0,0]=3 120 B10R1.61 c1ccc(c(c1)C(=O)O)N A2Z00070269 [1,1,0,0,0,0|1,0,0]=3 121 B10R1.61 c1ccc(c(c1)C(=O)O)O A2Z00038631 [1,1,0,0,0,0|1,0,0]=3 122 B10R1.61 c1ccc(c(c1)C(=S)N)Cl A2Z00098305 [1,1,0,0,0,0|1,1,0]=4 123 B10R1.61 c1ccc(c(c1)C(=S)N)F A2Z00038401 [1,1,0,0,0,0|1,1,0]=4 124 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])Cl A2Z00093554 [1,1,0,0,0,0|2,0,0]=4 125 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])O A2Z00034985 [1,1,0,0,0,0|2,0,0]=4 126 B10R1.113 CC(=O)c1cccc(c1)Cl A2Z00095936 [1,1,0,0,0,0|0,0,0]=2 127 B10R1.113 CC(C)c1cccc(c1)O A2Z00093539 [1,1,0,0,0,0|1,0,1]=4 128 B10R1.113 CN(C)c1cccc(c1)Br A2Z00097362 [1,1,0,0,0,0|2,0,0]=4 129 B10R1.113 CN(C)c1cccc(c1)N A2Z00061693 [1,1,0,0,0,0|2,0,0]=4 130 B10R1.113 Cc1cc(ccn1)C(=O)O A2Z00096178 [1,1,0,0,0,0|2,0,0]=4 131 B10R1.113 Cc1cc(cnc1)C(=O)O A2Z00096067 [1,1,0,0,0,0|2,0,0]=4 132 B10R1.113 c1c(cncc1N)C(=O)O A2Z00009581 [1,1,0,0,0,0|2,0,0]=4 133 B10R1.113 c1cc(c[n+](c1)[O-])C(=O)N A2Z00098097 [1,1,0,0,0,0|2,0,0]=4 134 B10R1.113 c1cc(cc(c1)Br)[N+](=O)[O-] A2Z00097373 [1,1,0,0,0,0|2,0,0]=4 135 B10R1.113 c1cc(cc(c1)Cl)C(=O)Cl A2Z00095909 [1,1,0,0,0,0|1,0,0]=3 136 B10R1.113 c1cc(cc(c1)Cl)C(=O)N A2Z00095951 [1,1,0,0,0,0|1,0,0]=3 137 B10R1.113 c1cc(cc(c1)F)C(=O)O A2Z00085462 [1,1,0,0,0,0|1,0,0]=3 138 B10R1.113 c1cc(cc(c1)N)C(=O)O A2Z00083929 [1,1,0,0,0,0|1,0,0]=3 139 B10R1.113 c1cc(nc(c1)Cl)C(=O)O A2Z00050531 [1,1,0,0,0,0|2,0,0]=4 140 B10R1.113 c1cnc(cc1Br)C(=O)O A2Z00009551 [1,1,0,0,0,0|2,0,0]=4 141 B10R1.113 c1cnc(cc1C(=O)O)Cl A2Z00096019 [1,1,0,0,0,0|2,0,0]=4 142 B10R1.113 c1cnc(cc1C(=O)O)O A2Z00096024 [1,1,0,0,0,0|2,0,0]=4 143 B10R1.113 c1cnc(cc1O)C(=O)O A2Z00009579 [1,1,0,0,0,0|2,0,0]=4 144 B10R1.1 CCCc1ccc(cc1)O A2Z00038635 [1,1,0,0,0,0|0,0,1]=3 145 B10R1.1 CCOc1ccc(cc1)N A2Z00069288 [1,1,0,0,0,0|1,0,0]=3 146 B10R1.1 c1cc(ccc1CCN)F A2Z00093996 [1,1,0,0,0,0|1,0,1]=4 147 B10R1.1 c1cc(ccc1CCN)O A2Z00038672 [1,1,0,0,0,0|1,0,1]=4 148 B10R1.1 c1cc(ccc1CCO)Br A2Z00098377 [1,1,0,0,0,0|1,0,1]=4 149 B10R1.4 CCOc1ccccc1O A2Z00093544 [1,1,0,0,0,0|1,0,0]=3 150 B10R1.4 CCOc1cccnc1N A2Z00069857 [1,1,0,0,0,0|2,0,0]=4 151 B10R1.4 c1ccc(c(c1)CCN)F A2Z00097645 [1,1,0,0,0,0|1,0,1]=4 152 B10R1.4 c1ccc(c(c1)CCN)O A2Z00049546 [1,1,0,0,0,0|1,0,1]=4 153 B10R1.10 CNCc1cccc(c1)O A2Z00038697 [1,1,0,0,0,0|1,0,1]=4 154 B10R1.10 Cc1cccc(c1)CCN A2Z00046191 [1,1,0,0,0,0|1,0,1]=4 155 B10R1.10 c1cc(cc(c1)Cl)CCN A2Z00093997 [1,1,0,0,0,0|1,0,1]=4 156 B10R1.17 CCNCc1ccccc1 A2Z00093459 [1,1,0,0,0,0|0,0,1]=3 157 B10R1.17 CNCCc1ccncc1 A2Z00061328 [1,1,0,0,0,0|1,0,1]=4 158 B10R1.17 c1cc(cnc1)CCCN A2Z00046192 [1,1,0,0,0,0|1,0,1]=4 159 B10R1.17 c1ccc(cc1)CCNN A2Z00095988 [1,1,0,0,0,0|1,0,1]=4 160 B10R1.17 c1ccc(cc1)CCNN A2Z00096724 [1,1,0,0,0,0|1,0,1]=4 161 B10R1.17 c1ccc(cc1)OCC#N A2Z00093923 [1,1,0,0,0,0|1,0,1]=4 162 B10R1.17 c1ccc(cc1)OCCO A2Z00038602 [1,1,0,0,0,0|1,0,0]=3 163 B10R1.17 c1ccc(cc1)OCCS A2Z00049974 [1,1,0,0,0,0|1,0,0]=3 164 B10R1.17 c1ccc(cc1)\C=C\C=O A2Z00038623 [1,1,0,0,0,0|0,0,2]=4 165 B10R1.18 c1ccc(cc1)SC(F)F A2Z00049186 [1,1,0,0,0,0|2,0,0]=4 166 B10R1.11 CCOC(=O)c1cscn1 A2Z00098039 [0,1,0,0,1,0|2,0,0]=4 167 B10R1.11 c1cc([nH]c1)C(=O)CC#N A2Z00095502 [0,1,0,0,1,0|1,0,1]=4 168 B10R1.11 c1cc(sc1)C(=O)CC#N A2Z00073789 [0,1,0,0,1,0|1,0,1]=4 169 B10R1.14 COC(=O)c1ccc(o1)Br A2Z00095435 [0,1,0,0,1,0|2,0,0]=4 170 B10R1.14 c1cc(sc1C(=O)CCl)Cl A2Z00094277 [0,1,0,0,1,0|2,0,0]=4 171 B10R1.149 COC(=O)c1c(ccs1)N A2Z00096109 [0,1,0,0,1,0|2,0,0]=4 172 B10R1.149 COC(=O)c1c(ccs1)O A2Z00061415 [0,1,0,0,1,0|2,0,0]=4 173 B10R1.149 Cc1ccsc1C(=O)OC A2Z00095997 [0,1,0,0,1,0|2,0,0]=4 174 B12R1.32 COCC(=O)Nc1ccccc1 A2Z00070375 [0,1,0,0,0,1|0,0,0]=2 175 B12R1.32 c1ccc(cc1)NC(=O)CC#N A2Z00097866 [0,1,0,0,0,1|0,0,1]=3 176 B12R1.32 c1ccc(cc1)NC(=O)CCS A2Z00069989 [0,1,0,0,0,1|0,0,0]=2 177 B12R1.34 CCC(=O)N(C)c1ccccc1 A2Z00095184 [0,1,0,0,0,1|0,0,0]=2 178 B12R1.34 CCC(C(=O)c1ccccc1)N A2Z00048079 [0,1,0,0,0,1|1,0,1]=4 179 B12R1.34 COC(=O)C(c1ccccc1)N A2Z00096034 [0,1,0,0,0,1|1,0,0]=3 180 B12R1.43 CC(C)C(Cc1ccccc1)O A2Z00048082 [0,1,0,0,0,1|0,0,2]=4 181 B12R1.49 COC(=O)Cc1ccc(cc1)N A2Z00094801 [0,1,0,0,0,1|1,0,0]=3 182 B12R1.49 Cc1ccc(cc1)NC(=O)CCl A2Z00075121 [0,1,0,0,0,1|1,0,0]=3 183 B12R1.49 Cc1ccc(cc1)NC(=O)CO A2Z00068361 [0,1,0,0,0,1|1,0,0]=3 184 B12R1.49 Cc1ccc(cc1)NC(=O)CS A2Z00029474 [0,1,0,0,0,1|1,0,0]=3 185 B12R1.49 Cc1ccc(cc1)OC(=O)CN A2Z00049394 [0,1,0,0,0,1|1,0,0]=3 186 B12R1.49 c1cc(ccc1NC(=O)CO)F A2Z00068363 [0,1,0,0,0,1|1,0,0]=3 187 B12R1.49 c1cc(ccc1NC(=O)CS)F A2Z00064160 [0,1,0,0,0,1|1,0,0]=3 188 B12R1.50 Cc1cccc(c1)NC(=O)CN A2Z00044975 [0,1,0,0,0,1|1,0,0]=3 189 B12R1.50 Cc1cccc(c1)NC(=O)CO A2Z00068360 [0,1,0,0,0,1|1,0,0]=3 190 B12R1.50 Cc1cccc(c1)NC(=O)CS A2Z00064158 [0,1,0,0,0,1|1,0,0]=3 191 B12R1.50 Cc1cccc(c1)OC(=O)CN A2Z00049393 [0,1,0,0,0,1|1,0,0]=3 192 B12R1.50 c1cc(cc(c1)Br)NC(=O)CCl A2Z00099282 [0,1,0,0,0,1|1,0,0]=3 193 B12R1.50 c1cc(cc(c1)Cl)NC(=O)CO A2Z00068364 [0,1,0,0,0,1|1,0,0]=3 194 B12R1.371 COC(=O)Cc1ccccc1F A2Z00095983 [0,1,0,0,0,1|1,0,0]=3 195 B12R1.371 Cc1ccccc1CC(=O)OC A2Z00095982 [0,1,0,0,0,1|1,0,0]=3 196 B12R1.371 Cc1ccccc1OC(=O)CN A2Z00049392 [0,1,0,0,0,1|1,0,0]=3 197 B12R1.9 CCC(C)(C)c1ccc(cc1)O A2Z00093560 [0,2,0,0,0,0|1,0,1]=4 198 B12R1.39 CC(C)(CNC)c1ccccc1 A2Z00049189 [0,2,0,0,0,0|1,0,1]=4 199 B12R1.39 c1ccc(cc1)S(=O)(=O)CCN A2Z00046080 [0,2,0,0,0,0|1,0,0]=3 200 B12R1.253 CC(C)S(=O)(=O)c1ccccc1 A2Z00095127 [0,2,0,0,0,0|1,0,0]=3 201 B12R1.3 c1ccc(cc1)C(CCO)CN A2Z00049191 [0,2,0,0,0,0|1,0,1]=4 202 B12R1.12 CCC(CC)c1ccc(cc1)O A2Z00049609 [0,2,0,0,0,0|1,0,1]=4 203 B12R1.478 CC(C)C(C=O)c1ccccc1 A2Z00048076 [0,2,0,0,0,0|0,0,1]=3 204 B12R1.16 CC(CCBr)c1ccc(cc1)F A2Z00049276 [0,2,0,0,0,0|1,0,1]=4 205 B12R1.16 CC(CCN)c1ccc(cc1)Cl A2Z00046308 [0,2,0,0,0,0|1,0,1]=4 206 B12R1.16 CC(CCO)c1ccc(cc1)Br A2Z00049275 [0,2,0,0,0,0|1,0,1]=4 207 B12R1.16 CC(CCO)c1ccc(cc1)F A2Z00094633 [0,2,0,0,0,0|1,0,1]=4 208 B12R1.16 CCCC(=O)c1ccc(cc1)Cl A2Z00097921 [0,2,0,0,0,0|0,0,0]=2 209 B12R1.16 CCCC(=O)c1ccc(cc1)F A2Z00094271 [0,2,0,0,0,0|0,0,0]=2 210 B12R1.16 CCCC(C)c1ccc(cc1)O A2Z00049608 [0,2,0,0,0,0|1,0,1]=4 211 B12R1.16 CCOC(=O)c1ccc(=O)[nH]n1 A2Z00073873 [0,2,0,0,0,0|2,0,0]=4 212 B12R1.16 CCOC(=O)c1ccc(cc1)F A2Z00094784 [0,2,0,0,0,0|0,0,0]=2 213 B12R1.16 CCOC(=O)c1ccc(cc1)N A2Z00030702 [0,2,0,0,0,0|0,0,0]=2 214 B12R1.16 CCOC(=O)c1cnc(cn1)C A2Z00096117 [0,2,0,0,0,0|2,0,0]=4 215 B12R1.16 CN(CCN)c1ccc(cc1)Cl A2Z00047110 [0,2,0,0,0,0|2,0,0]=4 216 B12R1.16 CNCC(c1ccc(cc1)Cl)O A2Z00046553 [0,2,0,0,0,0|0,0,2]=4 217 B12R1.16 c1cc(ccc1C(=O)CCBr)Br A2Z00070059 [0,2,0,0,0,0|0,0,0]=2 218 B12R1.16 c1cc(ccc1C(CCN)O)Br A2Z00068902 [0,2,0,0,0,0|0,0,2]=4 219 B12R1.16 c1cc(ccc1C(CCN)O)F A2Z00047847 [0,2,0,0,0,0|0,0,2]=4 220 B12R1.17 CNCC(c1cccc(c1)Cl)O A2Z00046552 [0,2,0,0,0,0|0,0,2]=4 221 B12R1.30 c1cc(cnc1)C(=O)CCC#N A2Z00094287 [0,2,0,0,0,0|1,0,0]=3 222 B12R1.30 c1ccc(cc1)C(=O)CCCCl A2Z00094306 [0,2,0,0,0,0|0,0,0]=2 223 B12R1.30 c1ccc(cc1)C(=O)NCCN A2Z00047087 [0,2,0,0,0,0|0,0,0]=2 224 B12R1.107 CC(=O)CC(=O)c1ccccc1 A2Z00094722 [0,2,0,0,0,0|0,0,0]=2 225 B12R1.107 CC(C)CC(c1ccccc1)O A2Z00048081 [0,2,0,0,0,0|0,0,2]=4 226 B12R1.107 CN(C)CC(=O)c1ccccc1 A2Z00074274 [0,2,0,0,0,0|0,0,0]=2 227 B12R1.308 CCCC(=O)c1ccccc1F A2Z00048886 [0,2,0,0,0,0|0,0,0]=2 228 B12R1.308 CCOC(=O)c1ccccc1C A2Z00098049 [0,2,0,0,0,0|0,0,0]=2 229 B12R1.308 CCOC(=O)c1ccccc1N A2Z00093475 [0,2,0,0,0,0|0,0,0]=2 230 B12R1.308 CCOC(=O)c1cccnc1N A2Z00061520 [0,2,0,0,0,0|1,0,0]=3 231 B12R1.308 CNCC(c1ccccc1Cl)O A2Z00046551 [0,2,0,0,0,0|0,0,2]=4 232 B12R1.5 CCC(=O)c1ccc(cc1)OC A2Z00094035 [0,2,0,0,0,0|0,0,0]=2 233 B12R1.5 CCC(C)c1ccc(cc1)C#N A2Z00049185 [0,2,0,0,0,0|1,0,1]=4 234 B12R1.5 CCc1ccc(cc1)C(=O)CCl A2Z00094268 [0,2,0,0,0,0|1,0,0]=3 235 B12R1.5 COC(=O)c1ccc(cc1)CN A2Z00069064 [0,2,0,0,0,0|1,0,0]=3 236 B12R1.5 COC(=O)c1ccc(cc1)CN A2Z00096145 [0,2,0,0,0,0|1,0,0]=3 237 B12R1.5 COC(=O)c1ccc(nc1)C#N A2Z00096192 [0,2,0,0,0,0|2,0,0]=4 238 B12R1.5 COC(=O)c1ccc(nc1)CN A2Z00096464 [0,2,0,0,0,0|2,0,0]=4 239 B12R1.5 COc1ccc(cc1)C(=O)CCl A2Z00094274 [0,2,0,0,0,0|1,0,0]=3 240 B12R1.20 CC(=O)C(=O)c1ccc(cc1)Br A2Z00049455 [0,2,0,0,0,0|0,0,1]=3 241 B12R1.20 CC(=O)C(=O)c1ccc(cc1)F A2Z00049436 [0,2,0,0,0,0|0,0,1]=3 242 B12R1.20 CC(C)C(=O)c1ccc(cc1)Cl A2Z00046355 [0,2,0,0,0,0|0,0,0]=2 243 B12R1.20 CC(C)C(=O)c1ccc(cc1)F A2Z00046354 [0,2,0,0,0,0|0,0,0]=2 244 B12R1.20 CN(C)C(=O)c1ccc(cc1)O A2Z00034159 [0,2,0,0,0,0|1,0,0]=3 245 B12R1.20 Cc1ccc(cc1)C(=O)C(C)Br A2Z00070053 [0,2,0,0,0,0|0,0,0]=2 246 B12R1.20 c1cc(ccc1C(=O)C(Br)Br)Cl A2Z00049894 [0,2,0,0,0,0|1,0,0]=3 247 B12R1.367 CCC(=O)c1ccc(c(c1)C)C A2Z00068482 [0,2,0,0,0,0|0,0,0]=2 248 B12R1.367 COC(=O)c1ccc(c(c1)N)Cl A2Z00094243 [0,2,0,0,0,0|1,0,0]=3 249 B12R1.367 COC(=O)c1ccc(c(c1)O)N A2Z00069834 [0,2,0,0,0,0|1,0,0]=3 250 B12R1.367 Cc1ccc(cc1C)C(=O)CCl A2Z00094276 [0,2,0,0,0,0|1,0,0]=3 251 B12R1.367 c1cc(c(cc1C(=O)CCl)F)F A2Z00094496 [0,2,0,0,0,0|1,0,0]=3 252 B12R1.1703 CCC(=O)c1ccc(cc1F)F A2Z00050173 [0,2,0,0,0,0|0,0,0]=2 253 B12R1.1703 COC(=O)c1ccc(cc1O)O A2Z00077106 [0,2,0,0,0,0|1,0,0]=3 254 B12R1.1703 COC(=O)c1cnc(cc1N)Cl A2Z00096459 [0,2,0,0,0,0|2,0,0]=4 255 B12R1.1703 Cc1ccc(c(c1)C)C(=O)CCl A2Z00048050 [0,2,0,0,0,0|1,0,0]=3 256 B12R1.1703 c1cc(c(cc1Cl)Cl)C(=O)NN A2Z00014665 [0,2,0,0,0,0|2,0,0]=4 257 B12R1.24 CCC(=O)c1cccc(c1C)C A2Z00050004 [0,2,0,0,0,0|0,0,0]=2 258 B12R1.24 COC(=O)c1cccc(c1Br)F A2Z00096666 [0,2,0,0,0,0|1,0,0]=3 259 B12R1.24 Cn1cccc(c1=O)C(=O)OC A2Z00096625 [0,2,0,0,0,0|2,0,0]=4 260 B12R1.225 CN(C)C(=O)c1cccc(c1)N A2Z00062536 [0,2,0,0,0,0|1,0,0]=3 261 B12R1.354 CCC(=O)c1cc(ccc1Cl)Cl A2Z00056935 [0,2,0,0,0,0|0,0,0]=2 262 B12R1.354 COC(=O)c1cc(ccc1Cl)N A2Z00045055 [0,2,0,0,0,0|1,0,0]=3 263 B12R1.354 COC(=O)c1cc(ccc1O)Br A2Z00034160 [0,2,0,0,0,0|1,0,0]=3 264 B12R1.354 COC(=O)c1cc(ccc1O)N A2Z00096851 [0,2,0,0,0,0|1,0,0]=3 265 B12R1.354 Cc1ccc(c(c1)C(=O)CCl)C A2Z00048098 [0,2,0,0,0,0|1,0,0]=3 266 B12R1.358 COC(=O)c1cc(cc(c1)Cl)Cl A2Z00097515 [0,2,0,0,0,0|1,0,0]=3 267 B12R1.358 COC(=O)c1cc(nc(c1)Cl)Cl A2Z00096479 [0,2,0,0,0,0|2,0,0]=4 268 B12R1.435 CCC(=O)c1cccc(c1)C#N A2Z00048071 [0,2,0,0,0,0|0,0,0]=2 269 B12R1.435 COC(=O)c1ccnc(c1)C#N A2Z00096344 [0,2,0,0,0,0|2,0,0]=4 270 B12R1.435 COC(=O)c1ccnc(c1)CN A2Z00096373 [0,2,0,0,0,0|2,0,0]=4 271 B12R1.124 CN(C)C(=O)c1ccccc1N A2Z00077213 [0,2,0,0,0,0|1,0,0]=3 272 B12R1.124 CN(C)C(=O)c1ccccc1O A2Z00034158 [0,2,0,0,0,0|1,0,0]=3 273 B12R1.77 COC(=O)c1ccccc1C=O A2Z00094841 [0,2,0,0,0,0|1,0,0]=3 274 B12R1.77 COC(=O)c1cccnc1C#N A2Z00096191 [0,2,0,0,0,0|2,0,0]=4 275 B12R1.77 COc1ccccc1C(=O)NN A2Z00014664 [0,2,0,0,0,0|2,0,0]=4 276 B10R2.6 c1ccc(cc1)C2CN2 A2Z00049782 [1,0,0,1,0,0|1,0,1]=4 277 B12R2.18 CC1c2ccccc2NC1=O A2Z00049804 [0,0,0,1,0,1|0,0,0]=2 278 B12R2.18 Cc1cc2ccccc2n1C A2Z00049652 [0,0,0,1,0,1|2,0,0]=4 279 B12R2.18 Cn1c2ccccc2[nH]c1=O A2Z00085448 [0,0,0,1,0,1|1,0,0]=3 280 B12R2.24 c1cc2c(nc1)NC(=O)CO2 A2Z00068733 [0,0,0,1,0,1|2,0,0]=4 281 B12R2.24 c1ccc2c(c1)CCC(=O)N2 A2Z00074166 [0,0,0,1,0,1|0,0,0]=2 282 B12R2.24 c1ccc2c(c1)NC(=O)CO2 A2Z00083158 [0,0,0,1,0,1|1,0,0]=3 283 B12R2.24 c1ccc2c(c1)NCC(=O)N2 A2Z00039095 [0,0,0,1,0,1|1,0,0]=3 284 B12R2.32 CNc1[nH]c2ccccc2n1 A2Z00056900 [0,0,0,1,0,1|2,0,0]=4 285 B12R2.32 c1ccc2c(c1)cc(o2)CCl A2Z00096052 [0,0,0,1,0,1|1,0,1]=4 286 B12R2.32 c1ccc2c(c1)cc(o2)CN A2Z00096017 [0,0,0,1,0,1|1,0,1]=4 287 B12R2.32 c1ccc2c(c1)cc(o2)CO A2Z00096099 [0,0,0,1,0,1|1,0,1]=4 288 B12R2.48 c1ccc(cc1)C2(CC2)CN A2Z00061422 [0,1,0,1,0,0|1,0,1]=4 289 B12R2.116 CC1(CNC1)c2ccccc2 A2Z00049697 [0,1,0,1,0,0|1,0,1]=4 290 B12R2.1 c1ccc2c(c1)c(c[nH]2)C=O A2Z00046648 [0,1,0,1,0,0|1,0,1]=4 291 B12R2.1 c1ccc2c(c1)c(c[nH]2)CN A2Z00044917 [0,1,0,1,0,0|2,0,0]=4 292 B12R2.2 c1ccc(cc1)C2CCCN2 A2Z00095924 [0,1,0,1,0,0|1,0,1]=4 293 B12R2.1081 c1ccc2c(c1)C(=O)CCN2 A2Z00094292 [0,1,0,1,0,0|0,0,0]=2 294 B12R2.1081 c1ccc2c(c1)C(CCN2)O A2Z00049675 [0,1,0,1,0,0|0,0,2]=4 295 B12R2.1081 c1ccc2c(c1)C(CCO2)N A2Z00073612 [0,1,0,1,0,0|1,0,1]=4 296 B12R2.1081 c1ccc2c(c1)c(=O)[nH]cn2 A2Z00057219 [0,1,0,1,0,0|1,0,1]=4 297 B12R2.1081 c1ccc2c(c1)c(=O)[nH]nn2 A2Z00060373 [0,1,0,1,0,0|2,0,0]=4 298 B12R2.1081 c1ccc2c(c1)c(=O)cc[nH]2 A2Z00062308 [0,1,0,1,0,0|0,0,2]=4 299 B12R2.1081 c1ccc2c(c1)c(=O)cn[nH]2 A2Z00061512 [0,1,0,1,0,0|1,0,1]=4 300 B12R2.1081 c1ccc2c(c1)cc[nH]c2=O A2Z00069902 [0,1,0,1,0,0|0,0,2]=4 301 B12R2.290 c1cc(ccc1C2(CC2)N)Cl A2Z00061587 [0,1,0,1,0,0|1,0,1]=4 302 B12R2.290 c1cc(ccc1C2(CC2)N)F A2Z00097449 [0,1,0,1,0,0|1,0,1]=4 303 B12R2.132 c1cc2c(cc1Br)C(=O)CS2 A2Z00050233 [0,1,0,1,0,0|1,0,0]=3 304 B12R2.132 c1cc2c(cc1Cl)C(=O)CC2 A2Z00094227 [0,1,0,1,0,0|0,0,0]=2 305 B12R2.132 c1cc2c(cc1Cl)C(CC2)O A2Z00047934 [0,1,0,1,0,0|0,0,2]=4 306 B12R2.1282 c1cc(cc(c1)Cl)C2(CC2)N A2Z00061591 [0,1,0,1,0,0|1,0,1]=4 307 B12R2.88 c1ccc(c(c1)C2(CC2)N)F A2Z00061609 [0,1,0,1,0,0|1,0,1]=4 308 B8R1.7 CC(=O)c1cccs1 A2Z00050162 [1,0,0,0,1,0|1,0,0]=3 309 B8R1.7 CC(=O)c1cncs1 A2Z00085476 [1,0,0,0,1,0|2,0,0]=4 310 B8R1.7 c1cc([nH]c1)C(=O)O A2Z00070219 [1,0,0,0,1,0|2,0,0]=4 311 B8R1.7 c1cc(oc1)C(=O)O A2Z00093505 [1,0,0,0,1,0|2,0,0]=4 312 B12R1.27 c1ccc(cc1)CCC(=O)CBr A2Z00094984 [0,0,0,0,0,2|1,0,0]=3 313 B12R1.27 c1ccc(cc1)CNC(=O)CCl A2Z00097817 [0,0,0,0,0,2|1,0,0]=3 314 B12R1.27 c1ccc(cc1)CNC(=O)CO A2Z00068365 [0,0,0,0,0,2|1,0,0]=3 315 B12R1.27 c1ccc(cc1)OCC(=O)NN A2Z00039102 [0,0,0,0,0,2|2,0,0]=4