0 B11R1.83 CNCc1ccc(cc1)OC BC645310 [0,0,0,0,0,0|1,0,1]=2 1 B11R1.83 COCc1ccc(cc1)OC BC620665 [0,0,0,0,0,0|1,0,1]=2 2 B10R1.1 COCc1ccc(cc1)O BC674868 [1,0,0,0,0,0|1,0,1]=3 3 B10R1.1 Cc1ccc(cc1)CC#N BC205621 [1,0,0,0,0,0|1,0,2]=4 4 B10R1.1 c1cc(ccc1CCO)O BC676907 [1,0,0,0,0,0|1,0,2]=4 5 B10R1.1 c1cc(ccc1\C=N\O)F BC684728 [1,0,0,0,0,0|3,0,0]=4 6 B10R1.3 C=Cc1ccc(cc1)CCl BC214833 [1,0,0,0,0,0|2,0,0]=3 7 B10R1.3 C=Cc1ccc(cc1)CO BC221109 [1,0,0,0,0,0|2,0,0]=3 8 B10R1.3 COc1ccc(cc1)C#C BC215299 [1,0,0,0,0,0|0,0,2]=3 9 B10R1.3 COc1ccc(cc1)CCl BC676749 [1,0,0,0,0,0|1,0,1]=3 10 B10R1.3 COc1ccc(cc1)CN BC208901 [1,0,0,0,0,0|1,0,1]=3 11 B10R1.3 COc1ccc(cc1)CS BC208815 [1,0,0,0,0,0|1,0,1]=3 12 B10R1.3 COc1ccc(cc1)NN BC206166 [1,0,0,0,0,0|2,0,0]=3 13 B10R1.3 COc1ccc(cc1)[Mg]Br BC653679 [1,0,0,0,0,0|2,0,0]=3 14 B10R1.3 COc1ccc(cn1)NN BC675241 [1,0,0,0,0,0|3,0,0]=4 15 B10R1.3 COc1ncc(cn1)C=O BC200326 [1,0,0,0,0,0|3,0,0]=4 16 B10R1.3 c1cc(ccc1C=O)C#N BC209249 [1,0,0,0,0,0|3,0,0]=4 17 B12R1.4 CC(=O)Cc1ccc(cc1)OC BC204252 [0,1,0,0,0,0|0,0,1]=2 18 B12R1.4 CC(=O)Oc1ccc(cc1)CBr BC600179 [0,1,0,0,0,0|3,0,0]=4 19 B12R1.4 COc1ccc(cc1)CC(=O)O BC675206 [0,1,0,0,0,0|1,0,1]=3 20 B12R1.5 COC(=O)c1ccc(cc1)C#N BC206382 [0,1,0,0,0,0|3,0,0]=4 21 B12R1.5 COC(=O)c1ccc(cc1)C=O BC206269 [0,1,0,0,0,0|3,0,0]=4 22 B12R1.5 COC(=O)c1ccc(cc1)CBr BC204605 [0,1,0,0,0,0|3,0,0]=4 23 B12R1.5 COC(=O)c1ccc(cc1)CCl BC206284 [0,1,0,0,0,0|3,0,0]=4 24 B12R1.5 COC(=O)c1ccc(cc1)CO BC651940 [0,1,0,0,0,0|3,0,0]=4 25 B12R1.5 COc1ccc(cc1)C(=O)CCl BC220494 [0,1,0,0,0,0|1,0,1]=3 26 B12R1.5 COc1ccc(cc1)C(=O)CN BC201177 [0,1,0,0,0,0|1,0,1]=3 27 B12R1.5 COc1ccc(cn1)C(=O)OC BC213243 [0,1,0,0,0,0|2,0,0]=3 28 B12R1.71 COCCc1ccc(cc1)OC BC600844 [0,1,0,0,0,0|0,0,2]=3 29 B12R1.71 COc1ccc(cc1)OCCO BC689549 [0,1,0,0,0,0|1,0,1]=3 30 B12R1.114 COc1ccc(c(c1)Cl)CCN BC217283 [0,1,0,0,0,0|1,0,2]=4 31 B12R1.288 COc1ccc(cc1F)CC#N BC210982 [0,1,0,0,0,0|1,0,2]=4 32 B12R2.44 COc1cc2cc[nH]c2nc1 BC256570 [0,0,0,1,0,0|2,0,1]=4 33 B12R2.44 COc1ccc2c(c1)CCN2 BC207896 [0,0,0,1,0,0|1,0,1]=3 34 B12R2.44 COc1ccc2c(c1)cc[nH]2 BC200872 [0,0,0,1,0,0|1,0,1]=3 35 B12R2.44 COc1ccc2c(c1)cn[nH]2 BC210283 [0,0,0,1,0,0|2,0,1]=4 36 B12R2.44 COc1ccc2c(n1)cc[nH]2 BC641859 [0,0,0,1,0,0|2,0,1]=4 37 B12R2.44 COc1ccc2cc[nH]c2c1 BC208019 [0,0,0,1,0,0|1,0,0]=2 38 B12R2.44 CSc1ccc2c(c1)cc[nH]2 BC677373 [0,0,0,1,0,0|1,1,1]=4 39 B9R1.1 C#Cc1ccc(cc1)O BC671095 [2,0,0,0,0,0|0,0,2]=4 40 B9R1.1 C=Cc1ccc(cc1)F BC227580 [2,0,0,0,0,0|1,0,0]=3 41 B9R1.1 CNc1ccc(cc1)N BC220840 [2,0,0,0,0,0|2,0,0]=4 42 B9R1.1 COc1cc[n+](cc1)[O-] BC209280 [2,0,0,0,0,0|2,0,0]=4 43 B9R1.1 COc1ccc(cc1)Br BC676620 [2,0,0,0,0,0|1,0,0]=3 44 B9R1.1 COc1ccc(cc1)N BC206279 [2,0,0,0,0,0|1,0,0]=3 45 B9R1.1 COc1ccc(cn1)F BC208854 [2,0,0,0,0,0|2,0,0]=4 46 B9R1.1 COc1ccc(cn1)I BC228888 [2,0,0,0,0,0|2,0,0]=4 47 B9R1.1 COc1ccc(cn1)N BC204592 [2,0,0,0,0,0|2,0,0]=4 48 B9R1.1 COc1ccc(cn1)O BC678852 [2,0,0,0,0,0|2,0,0]=4 49 B9R1.1 Cc1ccc(cc1)C#C BC213353 [2,0,0,0,0,0|0,0,2]=4 50 B9R1.1 Cc1ccc(cc1)C#N BC676397 [2,0,0,0,0,0|1,0,1]=4 51 B9R1.1 Cc1ccc(cc1)C=O BC211019 [2,0,0,0,0,0|1,0,0]=3 52 B9R1.1 Cc1ccc(cc1)CBr BC200614 [2,0,0,0,0,0|1,0,1]=4 53 B9R1.1 Cc1ccc(cc1)CN BC211128 [2,0,0,0,0,0|1,0,1]=4 54 B9R1.1 Cc1ccc(cc1)NN BC213413 [2,0,0,0,0,0|2,0,0]=4 55 B9R1.1 Cc1ccc(cc1)NN BC216063 [2,0,0,0,0,0|2,0,0]=4 56 B9R1.1 Cc1ccc(cn1)C=C BC219567 [2,0,0,0,0,0|1,0,0]=3 57 B9R1.1 Cc1ccc(cn1)OC BC224186 [2,0,0,0,0,0|1,0,0]=3 58 B9R1.1 Cc1ccc(nc1)C=C BC211746 [2,0,0,0,0,0|1,0,0]=3 59 B9R1.1 Cc1ccc(nc1)C=O BC207526 [2,0,0,0,0,0|2,0,0]=4 60 B9R1.1 c1cc(ccc1C=O)Br BC213531 [2,0,0,0,0,0|2,0,0]=4 61 B9R1.1 c1cc(ccc1C=O)N BC204291 [2,0,0,0,0,0|2,0,0]=4 62 B9R1.1 c1cc(ccc1C=O)O BC227835 [2,0,0,0,0,0|1,0,0]=3 63 B9R1.1 c1cc(ccc1CN)O BC210625 [2,0,0,0,0,0|1,0,1]=4 64 B9R1.1 c1cc(ccc1CO)O BC227836 [2,0,0,0,0,0|1,0,1]=4 65 B9R1.1 c1cc(ncc1C=O)O BC650796 [2,0,0,0,0,0|2,0,0]=4 66 B9R1.8 c1ccc(cc1)CC=O BC250050 [2,0,0,0,0,0|1,0,1]=4 67 B11R1.1 c1cc(ccc1\C=C\CO)Br BC600228 [1,1,0,0,0,0|1,0,0]=3 68 B11R1.20 CC(=O)Cc1ccc(cc1)O BC211152 [1,1,0,0,0,0|0,0,1]=3 69 B11R1.20 CC(=O)Nc1ccc(cc1)O BC204766 [1,1,0,0,0,0|1,0,0]=3 70 B11R1.20 CC(=O)Nc1ccc(cc1)S BC210348 [1,1,0,0,0,0|1,1,0]=4 71 B11R1.20 c1cc(ccc1CC(=O)O)O BC228201 [1,1,0,0,0,0|1,0,1]=4 72 B11R1.22 CCC(=O)c1ccc(cc1)N BC210208 [1,1,0,0,0,0|1,0,1]=4 73 B11R1.22 CCC(=O)c1ccc(cc1)O BC227841 [1,1,0,0,0,0|0,0,1]=3 74 B11R1.22 CNC(=O)c1ccc(cc1)Br BC290335 [1,1,0,0,0,0|2,0,0]=4 75 B11R1.22 COC(=O)c1ccc(cc1)Br BC215377 [1,1,0,0,0,0|2,0,0]=4 76 B11R1.22 COC(=O)c1ccc(cc1)I BC213654 [1,1,0,0,0,0|2,0,0]=4 77 B11R1.22 COC(=O)c1ccc(cc1)[O-] BC209217 [1,1,0,0,0,0|1,0,1]=4 78 B11R1.22 COC(=O)c1ccc(cn1)O BC224006 [1,1,0,0,0,0|2,0,0]=4 79 B11R1.22 Cc1ccc(cc1)C(=O)CN BC201176 [1,1,0,0,0,0|1,0,1]=4 80 B11R1.22 Cc1ccc(cc1)C(C)C=O BC600219 [1,1,0,0,0,0|1,0,1]=4 81 B11R1.22 Cc1ccc(cn1)C(=O)OC BC207925 [1,1,0,0,0,0|2,0,0]=4 82 B11R1.22 c1cc(ccc1C(=O)CBr)O BC685303 [1,1,0,0,0,0|1,0,1]=4 83 B11R1.81 CCCc1ccc(cc1O)O BC207608 [1,1,0,0,0,0|0,0,2]=4 84 B11R1.3 B(c1ccc(cc1)OC)(O)O BC298193 [1,1,0,0,0,0|2,0,0]=4 85 B11R1.3 C=Cc1ccc(cc1)C(=O)O BC685896 [1,1,0,0,0,0|2,0,0]=4 86 B11R1.3 CCc1ccc(cc1)C(=O)O BC250059 [1,1,0,0,0,0|2,0,0]=4 87 B11R1.3 CN(C)c1ccc(cc1)OC BC214399 [1,1,0,0,0,0|1,0,0]=3 88 B11R1.3 CNc1ccc(cc1)C(=O)O BC214404 [1,1,0,0,0,0|2,0,0]=4 89 B11R1.3 COc1ccc(cn1)C(=O)O BC681662 [1,1,0,0,0,0|2,0,0]=4 90 B11R1.3 COc1ccc(nc1)C(=O)O BC650815 [1,1,0,0,0,0|2,0,0]=4 91 B11R1.3 C[C@H](c1ccc(cc1)OC)N BC222031 [1,1,0,0,0,0|0,0,1]=3 92 B11R1.279 COc1ccc(c(c1)Cl)C=O BC297603 [1,1,0,0,0,0|1,0,0]=3 93 B11R1.279 COc1ccc(cc1F)C=O BC207248 [1,1,0,0,0,0|1,0,0]=3 94 B11R1.279 COc1ccc(cc1O)C#N BC210628 [1,1,0,0,0,0|1,0,1]=4 95 B11R1.279 COc1ccc(cc1O)C=O BC204204 [1,1,0,0,0,0|1,0,0]=3 96 B13R1.35 COc1ccc(cc1O)CC(=O)O BC676490 [0,2,0,0,0,0|1,0,1]=4 97 B13R1.36 COc1ccc(cc1)C(C(=O)O)N BC203524 [0,2,0,0,0,0|1,0,1]=4 98 B13R1.36 COc1ccc(cc1)C(C(=O)O)O BC215716 [0,2,0,0,0,0|1,0,1]=4 99 B13R1.142 COCc1ccc(cc1)CC(=O)O BC256311 [0,2,0,0,0,0|1,0,1]=4 100 B13R1.653 COc1ccc(c(c1)Br)CC(=O)O BC676489 [0,2,0,0,0,0|1,0,1]=4 101 B13R1.39 COc1ccc(cc1)C(C=O)C=O BC651644 [0,2,0,0,0,0|1,0,1]=4 102 B13R1.95 CNc1ccc(c(c1)Cl)C(=O)OC BC204566 [0,2,0,0,0,0|2,0,0]=4 103 B13R1.139 COC(=O)c1ccc(cc1)CC=O BC253937 [0,2,0,0,0,0|1,0,1]=4 104 B13R1.452 COc1ccc(cc1)C(=O)CCCl BC200635 [0,2,0,0,0,0|0,0,1]=3 105 B13R1.537 CC(=O)c1ccc(cc1)C(=O)OC BC689276 [0,2,0,0,0,0|2,0,0]=4 106 B13R1.537 C[C@H](c1ccc(cc1)C(=O)OC)N BC280847 [0,2,0,0,0,0|2,0,0]=4 107 B13R1.3088 COc1ccc(cc1I)C(=O)OC BC683957 [0,2,0,0,0,0|1,0,0]=3 108 B13R1.3088 COc1ccc(cc1N)C(=O)OC BC646265 [0,2,0,0,0,0|1,0,0]=3 109 B13R1.3 COc1ccc(cc1)\C=C\C(=O)Cl BC222508 [0,2,0,0,0,0|0,0,1]=3 110 B13R1.3 COc1ccc(cc1)\C=C\C(=O)Cl BC600137 [0,2,0,0,0,0|0,0,1]=3 111 B13R1.74 CN(C)c1ccc(cc1)\C=C\C=O BC650736 [0,2,0,0,0,0|1,0,1]=4 112 B13R1.371 COc1ccc(cc1)CCCCO BC226685 [0,2,0,0,0,0|0,0,2]=4 113 B11R1.267 COc1cccc(c1O)C=O BC652266 [0,0,1,1,0,0|2,0,0]=4 114 B11R1.280 CCc1cc(ccc1I)OC BC600018 [0,0,1,1,0,0|1,0,1]=4 115 B11R2.36 Cc1cc2c(cc[nH]2)cn1 BC249555 [1,0,0,1,0,0|2,0,0]=4 116 B11R2.36 c1cc(cc2c1cc[nH]2)Br BC207398 [1,0,0,1,0,0|2,0,0]=4 117 B11R2.36 c1cc(cc2c1cc[nH]2)F BC214939 [1,0,0,1,0,0|2,0,0]=4 118 B11R2.36 c1cc(cc2c1cc[nH]2)N BC201232 [1,0,0,1,0,0|2,0,0]=4 119 B11R2.36 c1cc(cc2c1cc[nH]2)O BC213327 [1,0,0,1,0,0|1,0,0]=3 120 B11R2.36 c1cc2c(cc[nH]2)cc1O BC201869 [1,0,0,1,0,0|1,0,1]=4 121 B11R2.190 C=Cc1ccc2c(c1)CC2 BC225114 [1,0,0,1,0,0|1,0,0]=3 122 B13R2.2121 COc1ccc2c(c1)CC(=O)N2 BC223723 [0,1,0,1,0,0|1,0,0]=3 123 B13R2.2121 COc1ccc2c(c1)NC(=O)C2 BC676537 [0,1,0,1,0,0|1,0,1]=4 124 B13R2.2121 Cc1cc2cc(ccc2[nH]1)OC BC675663 [0,1,0,1,0,0|1,0,0]=3 125 B13R2.2130 COc1ccc2c(c1)[nH]nc2O BC600083 [0,1,0,1,0,0|2,0,0]=4 126 B13R2.2130 Cn1ccc2c1ccc(c2)OC BC215322 [0,1,0,1,0,0|1,0,1]=4 127 B13R2.57 COc1ccc2ccccc2n1 BC262285 [0,1,0,1,0,0|1,0,1]=4 128 B13R2.57 COc1ccc2ccncc2c1 BC213978 [0,1,0,1,0,0|0,0,1]=3 129 B13R2.669 COc1cc2c(c[nH]c2nc1)Br BC639711 [0,1,0,1,0,0|2,0,0]=4 130 B13R2.669 COc1ccc2c(c1)C(=O)CC2 BC205708 [0,1,0,1,0,0|1,0,1]=4 131 B13R2.669 COc1ccc2c(n1)c(c[nH]2)I BC641860 [0,1,0,1,0,0|2,0,0]=4 132 B13R2.84 COc1c(c2c(cc[nH]2)cn1)Br BC260591 [0,1,0,1,0,0|2,0,0]=4 133 B13R2.599 COc1cc2c(cc[nH]2)cc1F BC600087 [0,1,0,1,0,0|1,0,0]=3