0 B10R1.3 COc1ccc(cc1)CN A2Z00093434 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.3 COc1ccc(cc1)CO A2Z00062142 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.3 c1cc(ccc1C=O)C#N A2Z00094838 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.3 c1cc(ccc1CS)C#N A2Z00070137 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.1 COc1ccc(cc1)O A2Z00093524 [1,0,0,0,0,0|0,0,0]=1 5 B9R1.1 CSc1ccc(cn1)N A2Z00068677 [1,0,0,0,0,0|2,1,0]=4 6 B9R1.1 Cc1ccc(cn1)C#N A2Z00096063 [1,0,0,0,0,0|3,0,0]=4 7 B9R1.1 Cc1ccc(cn1)C=O A2Z00096051 [1,0,0,0,0,0|3,0,0]=4 8 B9R1.1 c1cc(ccc1C#N)Br A2Z00085449 [1,0,0,0,0,0|3,0,0]=4 9 B9R1.1 c1cc(ccc1C#N)F A2Z00085450 [1,0,0,0,0,0|3,0,0]=4 10 B9R1.1 c1cc(ccc1C=O)F A2Z00093477 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.1 c1cc(ccc1C=O)O A2Z00093449 [1,0,0,0,0,0|2,0,0]=3 12 B9R1.1 c1cc(ccc1CN)F A2Z00097608 [1,0,0,0,0,0|3,0,0]=4 13 B9R1.1 c1cc(ccc1CO)Cl A2Z00062143 [1,0,0,0,0,0|3,0,0]=4 14 B9R1.1 c1cc(ccc1NN)Br A2Z00097331 [1,0,0,0,0,0|3,0,0]=4 15 B9R1.1 c1cc(ccc1NN)Cl A2Z00093596 [1,0,0,0,0,0|3,0,0]=4 16 B11R1.3 CC(C)c1ccc(cc1)CCl A2Z00049036 [0,1,0,0,0,0|3,0,0]=4 17 B11R1.3 CC(C)c1ccc(cc1)OC A2Z00094996 [0,1,0,0,0,0|1,0,0]=2 18 B11R1.3 CC(c1ccc(cc1)OC)Cl A2Z00048085 [0,1,0,0,0,0|1,0,0]=2 19 B11R1.3 CC(c1ccc(cc1)OC)N A2Z00038484 [0,1,0,0,0,0|1,0,0]=2 20 B11R1.3 CC(c1ccc(cc1)OC)O A2Z00094294 [0,1,0,0,0,0|1,0,0]=2 21 B11R1.3 CCc1ccc(cc1)C(=N)N A2Z00038652 [0,1,0,0,0,0|3,0,0]=4 22 B11R1.3 CCc1ccc(cc1)C(=O)O A2Z00083092 [0,1,0,0,0,0|3,0,0]=4 23 B11R1.3 CCc1ccc(cc1)C(=S)N A2Z00038707 [0,1,0,0,0,0|3,0,0]=4 24 B11R1.3 CCc1ccc(cc1)C(C)N A2Z00038383 [0,1,0,0,0,0|2,0,0]=3 25 B11R1.3 CN(C)c1ccc(cc1)C#N A2Z00097758 [0,1,0,0,0,0|3,0,0]=4 26 B11R1.3 CN(C)c1ccc(cc1)CN A2Z00061496 [0,1,0,0,0,0|3,0,0]=4 27 B11R1.3 COc1ccc(cc1)C(=O)O A2Z00038625 [0,1,0,0,0,0|2,0,0]=3 28 B11R1.3 COc1ccc(cc1)C(=S)N A2Z00038402 [0,1,0,0,0,0|2,0,0]=3 29 B11R1.3 COc1ccc(cn1)[N+](=O)[O-] A2Z00096485 [0,1,0,0,0,0|3,0,0]=4 30 B11R1.83 CCOc1ccc(cc1)C=O A2Z00093914 [0,1,0,0,0,0|2,0,0]=3 31 B11R1.83 COc1ccc(cc1)CC#N A2Z00038624 [0,1,0,0,0,0|1,0,1]=3 32 B11R1.83 COc1ccc(cc1)CCN A2Z00038582 [0,1,0,0,0,0|1,0,0]=2 33 B11R1.279 COc1c[nH]c(cc1=O)CO A2Z00087282 [0,1,0,0,0,0|3,0,0]=4 34 B11R1.279 COc1ccc(cc1Br)C=O A2Z00098810 [0,1,0,0,0,0|2,0,0]=3 35 B11R1.279 COc1ccc(cc1O)C=O A2Z00093931 [0,1,0,0,0,0|2,0,0]=3 36 B8R1.2 CCc1ccncc1 A2Z00096081 [2,0,0,0,0,0|2,0,0]=4 37 B8R1.2 COc1cnccn1 A2Z00085431 [2,0,0,0,0,0|2,0,0]=4 38 B8R1.2 CSc1ccccc1 A2Z00096090 [2,0,0,0,0,0|0,1,0]=3 39 B8R1.2 c1ccc(cc1)CN A2Z00095042 [2,0,0,0,0,0|2,0,0]=4 40 B8R1.3 C1=CC(=O)C=CC1=O A2Z00093502 [2,0,0,0,0,0|0,0,2]=4 41 B8R1.3 Cc1ccc(cc1)N A2Z00038641 [2,0,0,0,0,0|1,0,0]=3 42 B8R1.3 Cc1ccc(cc1)O A2Z00098041 [2,0,0,0,0,0|0,0,0]=2 43 B8R1.3 Cc1ccc(cn1)N A2Z00096166 [2,0,0,0,0,0|2,0,0]=4 44 B8R1.3 Cc1ccc(nc1)Br A2Z00050520 [2,0,0,0,0,0|2,0,0]=4 45 B8R1.3 Cc1ccc(nc1)N A2Z00070217 [2,0,0,0,0,0|2,0,0]=4 46 B8R1.3 c1cc(ccc1N)Br A2Z00061804 [2,0,0,0,0,0|2,0,0]=4 47 B8R1.3 c1cc(ccc1O)F A2Z00093466 [2,0,0,0,0,0|1,0,0]=3 48 B8R1.3 c1cc(ccc1O)O A2Z00097872 [2,0,0,0,0,0|0,0,0]=2 49 B10R0.46 COC(=O)\C=C(/C(=O)OC)\N A2Z00095466 [0,1,1,0,0,0|2,0,0]=4 50 B10R1.1 CCCc1ccc(cc1)O A2Z00038635 [1,1,0,0,0,0|1,0,0]=3 51 B10R1.1 CCOc1ccc(cc1)N A2Z00069288 [1,1,0,0,0,0|1,0,0]=3 52 B10R1.1 c1cc(ccc1CCN)F A2Z00093996 [1,1,0,0,0,0|2,0,0]=4 53 B10R1.1 c1cc(ccc1CCN)O A2Z00038672 [1,1,0,0,0,0|1,0,0]=3 54 B10R1.1 c1cc(ccc1CCO)Br A2Z00098377 [1,1,0,0,0,0|2,0,0]=4 55 B10R1.13 CC(=O)c1ccc(cc1)Cl A2Z00038583 [1,1,0,0,0,0|2,0,0]=4 56 B10R1.13 CC(C)c1ccc(cc1)N A2Z00038646 [1,1,0,0,0,0|2,0,0]=4 57 B10R1.13 CC(C)c1ccc(cc1)O A2Z00093536 [1,1,0,0,0,0|1,0,0]=3 58 B10R1.13 CC(c1ccc(cc1)F)Cl A2Z00094295 [1,1,0,0,0,0|2,0,0]=4 59 B10R1.13 CN(C)c1ccc(cc1)Br A2Z00097376 [1,1,0,0,0,0|2,0,0]=4 60 B10R1.13 CN(c1ccc(cc1)F)N A2Z00049175 [1,1,0,0,0,0|2,0,0]=4 61 B10R1.13 Cc1ccc(cc1)C(=O)O A2Z00030670 [1,1,0,0,0,0|2,0,0]=4 62 B10R1.13 Cc1ccc(cc1)C(=S)N A2Z00038400 [1,1,0,0,0,0|2,0,0]=4 63 B10R1.13 c1cc(ccc1C(=N)N)O A2Z00070221 [1,1,0,0,0,0|2,0,0]=4 64 B10R1.13 c1cc(ccc1C(=O)N)O A2Z00093462 [1,1,0,0,0,0|2,0,0]=4 65 B10R1.25 COc1ccc(cc1Cl)N A2Z00093461 [1,1,0,0,0,0|1,0,0]=3 66 B10R1.25 COc1ccc(cc1N)Cl A2Z00038607 [1,1,0,0,0,0|1,0,0]=3 67 B10R1.25 Cc1cc(ccc1N=O)O A2Z00061533 [1,1,0,0,0,0|2,0,0]=4 68 B10R1.25 Cc1ccc(c(c1)C)CBr A2Z00098030 [1,1,0,0,0,0|2,0,0]=4 69 B10R1.25 c1cc(c(cc1O)O)C=O A2Z00038649 [1,1,0,0,0,0|2,0,0]=4 70 B10R1.176 CCc1ccc(c(c1)N)C A2Z00048060 [1,1,0,0,0,0|1,0,0]=3 71 B10R1.176 COc1ccc(c(c1)Br)O A2Z00050158 [1,1,0,0,0,0|0,0,0]=2 72 B10R1.176 COc1ccc(c(c1)N)N A2Z00097879 [1,1,0,0,0,0|1,0,0]=3 73 B10R1.176 Cc1cc(ccc1O)N=O A2Z00061535 [1,1,0,0,0,0|2,0,0]=4 74 B10R1.176 Cc1ccc(cc1N)OC A2Z00070457 [1,1,0,0,0,0|0,0,0]=2 75 B10R1.176 c1cc(c(cc1C=O)O)O A2Z00036666 [1,1,0,0,0,0|2,0,0]=4 76 B12R1.5 CCC(=O)c1ccc(cc1)OC A2Z00094035 [0,2,0,0,0,0|1,0,0]=3 77 B12R1.5 CCc1ccc(cc1)C(=O)CCl A2Z00094268 [0,2,0,0,0,0|2,0,0]=4 78 B12R1.5 COC(=O)c1ccc(cc1)CN A2Z00069064 [0,2,0,0,0,0|2,0,0]=4 79 B12R1.5 COC(=O)c1ccc(cc1)CN A2Z00096145 [0,2,0,0,0,0|2,0,0]=4 80 B12R1.5 COc1ccc(cc1)C(=O)CCl A2Z00094274 [0,2,0,0,0,0|1,0,0]=3 81 B12R1.5 COc1ccc(cc1)C(C#N)N A2Z00047032 [0,2,0,0,0,0|1,0,1]=4 82 B12R1.5 COc1ccc(cc1)C(CN)O A2Z00095910 [0,2,0,0,0,0|1,0,0]=3 83 B12R1.5 COc1cnc(cn1)C(=O)OC A2Z00096404 [0,2,0,0,0,0|2,0,0]=4 84 B12R1.6 CC(C)(c1ccc(cc1)OC)N A2Z00061577 [0,2,0,0,0,0|1,0,0]=3 85 B12R1.6 COc1ccc(cc1)S(=O)(=O)Cl A2Z00094078 [0,2,0,0,0,0|1,1,0]=4 86 B12R1.48 CC(=O)c1ccc(c(c1)Br)OC A2Z00048841 [0,2,0,0,0,0|1,0,0]=3 87 B12R1.48 CC(=O)c1ccc(c(c1)Br)SC A2Z00096050 [0,2,0,0,0,0|1,1,0]=4 88 B12R1.48 CC(C)c1ccc(c(c1)Br)OC A2Z00049810 [0,2,0,0,0,0|1,0,0]=3 89 B12R1.48 COc1ccc(cc1Br)C(=O)O A2Z00095298 [0,2,0,0,0,0|2,0,0]=4 90 B12R1.48 COc1ccc(cc1Br)C(=S)N A2Z00038496 [0,2,0,0,0,0|2,0,0]=4 91 B12R1.48 COc1ccc(cc1Br)S(=O)O A2Z00049796 [0,2,0,0,0,0|1,1,0]=4 92 B12R1.48 COc1ccc(cc1N)C(=O)O A2Z00048893 [0,2,0,0,0,0|2,0,0]=4 93 B12R1.48 Cc1cc(ccc1OC)C(=O)C A2Z00046352 [0,2,0,0,0,0|1,0,0]=3 94 B12R1.113 CC(C)c1ccc(cc1)CCN A2Z00050042 [0,2,0,0,0,0|2,0,0]=4 95 B12R1.113 CCOc1ccc(cc1)C(=O)O A2Z00034515 [0,2,0,0,0,0|2,0,0]=4 96 B12R1.113 CN(C)c1ccc(cc1)CCN A2Z00045071 [0,2,0,0,0,0|2,0,0]=4 97 B12R1.452 COc1ccc(c(c1)N)C(=O)O A2Z00061322 [0,2,0,0,0,0|2,0,0]=4 98 B12R1.4 COc1ccc(cc1)CC(=O)Cl A2Z00094314 [0,2,0,0,0,0|1,0,1]=4 99 B12R1.4 COc1ccc(cc1)CC(=O)O A2Z00093941 [0,2,0,0,0,0|1,0,1]=4 100 B12R1.4 COc1ccc(cc1)CC(=S)N A2Z00097997 [0,2,0,0,0,0|1,0,1]=4 101 B12R1.71 CCCOc1ccc(cc1)C=O A2Z00093915 [0,2,0,0,0,0|2,0,0]=4 102 B12R1.71 CNCCc1ccc(cc1)OC A2Z00045070 [0,2,0,0,0,0|1,0,0]=3 103 B12R1.71 COc1ccc(cc1)CCCN A2Z00046194 [0,2,0,0,0,0|1,0,0]=3 104 B12R1.71 COc1ccc(cc1)CN=[N+]=[N-] A2Z00096609 [0,2,0,0,0,0|2,0,0]=4 105 B12R1.71 COc1ccc(cc1)OCC#N A2Z00038566 [0,2,0,0,0,0|0,0,0]=2 106 B12R1.71 COc1ccc(cc1)OCCBr A2Z00098310 [0,2,0,0,0,0|0,0,0]=2 107 B12R1.71 COc1ccc(cc1)OCCN A2Z00038367 [0,2,0,0,0,0|0,0,0]=2 108 B12R1.114 CCOc1ccc(cc1Br)C#N A2Z00093932 [0,2,0,0,0,0|2,0,0]=4 109 B12R1.288 COc1ccc(cc1F)CCO A2Z00049197 [0,2,0,0,0,0|1,0,0]=3 110 B12R1.78 CNc1ccc(c(c1)OC)OC A2Z00048083 [0,2,0,0,0,0|1,0,0]=3 111 B12R1.78 COc1ccc(c(c1)C=O)OC A2Z00038628 [0,2,0,0,0,0|0,0,0]=2 112 B12R1.78 COc1ccc(cc1OC)C#N A2Z00093452 [0,2,0,0,0,0|2,0,0]=4 113 B12R1.78 COc1ccc(cc1OC)C=O A2Z00093447 [0,2,0,0,0,0|2,0,0]=4 114 B12R1.78 COc1ccc(cc1OC)CS A2Z00050009 [0,2,0,0,0,0|2,0,0]=4 115 B12R1.653 COc1ccc(c(c1O)Br)C=O A2Z00056153 [0,2,0,0,0,0|2,0,0]=4 116 B12R2.9 COc1ccc(cc1)C2CO2 A2Z00094232 [0,1,0,1,0,0|0,0,0]=2 117 B12R2.44 COc1ccc2c(c1)CCO2 A2Z00050460 [0,1,0,1,0,0|0,0,0]=2 118 B12R2.44 COc1ccc2c(c1)[nH]cn2 A2Z00097328 [0,1,0,1,0,0|1,0,1]=4 119 B12R2.44 COc1ccc2c(c1)cc[nH]2 A2Z00047975 [0,1,0,1,0,0|1,0,1]=4 120 B12R2.44 COc1ccc2c(c1)nc[nH]2 A2Z00062449 [0,1,0,1,0,0|1,0,1]=4 121 B12R2.44 COc1ccc2c(c1)ncs2 A2Z00062352 [0,1,0,1,0,0|0,1,1]=4 122 B12R2.44 c1cc2c(cc1CN)OCO2 A2Z00093436 [0,1,0,1,0,0|2,0,0]=4 123 B12R2.44 c1cc2c(cc1CS)OCO2 A2Z00050008 [0,1,0,1,0,0|2,0,0]=4