0 B12R1.354 C/C=C(\C)/c1cc(ccc1F)C AIFCHEM-94584218727 [0,1,0,0,0,0|2,0,0]=3 1 B12R1.354 C/C=C(\C)/c1cc(ccc1F)F AIFCHEM-94584218232 [0,1,0,0,0,0|3,0,0]=4 2 B12R1.354 C/C=C(\C)/c1cc(ccc1N)O AIFCHEM-94584221559 [0,1,0,0,0,0|3,0,0]=4 3 B12R1.354 C/C=C(\C)/c1cc(ccc1O)C AIFCHEM-94584220859 [0,1,0,0,0,0|1,0,0]=2 4 B12R1.354 C/C=C(\C)/c1cc(ccc1O)O AIFCHEM-94584220013 [0,1,0,0,0,0|2,0,0]=3 5 B12R1.354 C/C=C(\C)/c1cc(cnc1C)C AIFCHEM-94584214227 [0,1,0,0,0,0|3,0,0]=4 6 B12R1.354 C/C=C(\C)/c1cc(cnc1N)C AIFCHEM-94584214274 [0,1,0,0,0,0|3,0,0]=4 7 B12R1.354 C/C=C(\C)/c1cn(ccc1=O)C AIFCHEM-94584222858 [0,1,0,0,0,0|2,0,1]=4 8 B12R1.127 CC(=Cc1cc(ccc1N)F)C AIFCHEM-5595307750 [0,0,0,0,0,1|3,0,0]=4 9 B12R1.127 CC(=Cc1cc(ccc1O)N)C AIFCHEM-6050835391 [0,0,0,0,0,1|2,0,0]=3 10 B12R1.127 CC(=O)Nc1cc(c[nH]c1=O)Br AIFCHEM-94605358198 [0,0,0,0,0,1|2,0,1]=4 11 B12R1.127 CC(=O)Nc1cc(c[nH]c1=O)Cl AIFCHEM-6033893188 [0,0,0,0,0,1|2,0,1]=4 12 B12R1.127 CC(=O)Nc1cc(ccc1Br)Br AIFCHEM-94570348023 [0,0,0,0,0,1|2,0,0]=3 13 B12R1.127 CC(=O)Nc1cc(ccc1Br)I AIFCHEM-5708441140 [0,0,0,0,0,1|2,0,0]=3 14 B12R1.127 CC(=O)Nc1cc(ccc1C)C AIFCHEM-5778903028 [0,0,0,0,0,1|1,0,0]=2 15 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl AIFCHEM-94528739919 [0,0,0,0,0,1|2,0,0]=3 16 B12R1.127 CC(=O)Nc1cc(ccc1F)Br AIFCHEM-94535595050 [0,0,0,0,0,1|2,0,0]=3 17 B12R1.127 CC(=O)Nc1cc(ccc1I)Br AIFCHEM-94535598373 [0,0,0,0,0,1|2,0,0]=3 18 B12R1.127 CC(=O)Nc1cc(ccc1I)F AIFCHEM-94535594622 [0,0,0,0,0,1|2,0,0]=3 19 B12R1.127 CC(=O)Nc1cc(ccc1O)C AIFCHEM-94535601312 [0,0,0,0,0,1|0,0,0]=1 20 B12R1.127 CC(=O)Nc1cc(cnc1C)Cl AIFCHEM-94605357325 [0,0,0,0,0,1|3,0,0]=4 21 B12R1.127 CC(=O)Nc1cc(ncc1C)O AIFCHEM-94605358045 [0,0,0,0,0,1|3,0,0]=4 22 B12R1.127 CC(=O)Nc1nc(ccc1Br)O AIFCHEM-94605353722 [0,0,0,0,0,1|3,0,0]=4 23 B11R1.182 CC=Cc1cc(ccc1N)N AIFCHEM-6397726964 [1,1,0,0,0,0|2,0,0]=4 24 B11R1.182 CC=Cc1cc(cnc1C)C AIFCHEM-6350669460 [1,1,0,0,0,0|2,0,0]=4 25 B11R1.182 CCNc1cc(ccc1I)C AIFCHEM-94537414464 [1,1,0,0,0,0|1,0,1]=4 26 B11R1.222 C/C=C(\C)/c1ccccc1O AIFCHEM-94584219423 [1,1,0,0,0,0|1,0,0]=3 27 B11R1.222 C/C=C(\C)/c1ncccc1O AIFCHEM-94584218309 [1,1,0,0,0,0|2,0,0]=4 28 B11R1.23 C/C=C(\C)/c1cc(ccn1)C AIFCHEM-94584218926 [1,1,0,0,0,0|2,0,0]=4 29 B11R1.23 C/C=C(\C)/c1cccc(c1)F AIFCHEM-94584209876 [1,1,0,0,0,0|2,0,0]=4 30 B11R1.23 C/C=C(\C)/c1cccc(n1)C AIFCHEM-94584219398 [1,1,0,0,0,0|2,0,0]=4 31 B11R1.23 C/C=C(\C)/c1ccnc(c1)C AIFCHEM-94584215958 [1,1,0,0,0,0|2,0,0]=4 32 B13R1.97 COc1cc(c(cn1)C)NC(=O)C AIFCHEM-5601383113 [0,1,0,0,0,1|2,0,0]=4 33 B13R1.876 CC(=Cc1cc(c(cc1C)F)C)C AIFCHEM-6311235041 [0,1,0,0,0,1|2,0,0]=4 34 B13R1.876 CC(=Cc1cc(c(cc1F)C)C)C AIFCHEM-6371680790 [0,1,0,0,0,1|2,0,0]=4 35 B13R1.876 CC(=Cc1cc(c(cc1O)F)N)C AIFCHEM-94540399628 [0,1,0,0,0,1|2,0,0]=4 36 B13R1.876 CC(=O)Nc1cc(c(cc1Br)Br)F AIFCHEM-94605335321 [0,1,0,0,0,1|2,0,0]=4 37 B13R1.876 CC(=O)Nc1cc(c(cc1Br)C)F AIFCHEM-94535593524 [0,1,0,0,0,1|2,0,0]=4 38 B13R1.876 CC(=O)Nc1cc(c(cc1Br)F)Br AIFCHEM-94535592539 [0,1,0,0,0,1|2,0,0]=4 39 B13R1.876 CC(=O)Nc1cc(c(cc1Br)O)Br AIFCHEM-94605356952 [0,1,0,0,0,1|2,0,0]=4 40 B13R1.876 CC(=O)Nc1cc(c(cc1C)C)Br AIFCHEM-6235944589 [0,1,0,0,0,1|2,0,0]=4 41 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)Br AIFCHEM-94535598199 [0,1,0,0,0,1|2,0,0]=4 42 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)F AIFCHEM-5801843501 [0,1,0,0,0,1|2,0,0]=4 43 B13R1.876 CC(=O)Nc1cc(c(cc1I)Br)C AIFCHEM-94605346368 [0,1,0,0,0,1|1,0,0]=3 44 B13R1.876 CC(=O)Nc1cc(c(cc1I)C)Br AIFCHEM-94535592321 [0,1,0,0,0,1|2,0,0]=4 45 B13R1.876 CC(=O)Nc1cc(c(cc1I)C)C AIFCHEM-94535589288 [0,1,0,0,0,1|1,0,0]=3 46 B13R1.876 CC(=O)Nc1cc(c(cc1I)Cl)F AIFCHEM-94605339164 [0,1,0,0,0,1|2,0,0]=4 47 B13R1.876 CC(=O)Nc1cc(c(cc1O)Cl)Br AIFCHEM-94535588335 [0,1,0,0,0,1|1,0,0]=3 48 B13R1.876 CC(=O)Nc1cc(c(cc1O)F)F AIFCHEM-94605351671 [0,1,0,0,0,1|1,0,0]=3 49 B13R1.885 CC(=O)Nc1c(ccc(c1C)Cl)Cl AIFCHEM-94535598108 [0,1,0,0,0,1|2,0,0]=4 50 B13R1.885 CC(=O)Nc1c(ccc(c1F)C)Cl AIFCHEM-94605355603 [0,1,0,0,0,1|1,0,0]=3 51 B13R1.885 CC(=O)Nc1c(ccc(c1F)F)F AIFCHEM-5864554788 [0,1,0,0,0,1|2,0,0]=4 52 B13R1.885 CC(=O)Nc1c(ccc(c1F)F)I AIFCHEM-94605347746 [0,1,0,0,0,1|2,0,0]=4 53 B13R1.897 CC(=O)N(C)c1cc(ccc1Cl)Cl AIFCHEM-5944835847 [0,1,0,0,0,1|2,0,0]=4 54 B13R1.2816 CC(=Cc1cc(cc(c1C)C)C)C AIFCHEM-94591957835 [0,1,0,0,0,1|2,0,0]=4 55 B13R1.2816 CC(=O)Nc1cc(cc(c1Br)C)F AIFCHEM-94605345413 [0,1,0,0,0,1|2,0,0]=4 56 B13R1.2816 CC(=O)Nc1cc(cc(c1C)F)Br AIFCHEM-94535600497 [0,1,0,0,0,1|2,0,0]=4 57 B13R1.2816 CC(=O)Nc1cc(cc(c1F)Br)Cl AIFCHEM-5673321472 [0,1,0,0,0,1|2,0,0]=4 58 B13R1.2816 CC(=O)Nc1cc(cc(c1I)F)C AIFCHEM-5886753909 [0,1,0,0,0,1|1,0,0]=3 59 B13R1.2816 CC(=O)Nc1cc(cc(c1I)F)Cl AIFCHEM-94535593713 [0,1,0,0,0,1|2,0,0]=4 60 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Br)Cl AIFCHEM-94535592781 [0,1,0,0,0,1|1,0,0]=3 61 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)C AIFCHEM-94605353056 [0,1,0,0,0,1|0,0,0]=2 62 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)Cl AIFCHEM-94605356356 [0,1,0,0,0,1|1,0,0]=3 63 B13R1.2872 C#CC(=O)Nc1cc(ccc1C)C AIFCHEM-94525199563 [0,1,0,0,0,1|1,0,1]=4 64 B13R1.2872 C#CC(=O)Nc1cc(ccc1I)C AIFCHEM-94525193160 [0,1,0,0,0,1|1,0,1]=4 65 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)F AIFCHEM-94526498880 [0,1,0,0,0,1|2,0,0]=4 66 B13R1.2872 CCC(=O)Nc1cc(ccc1F)Br AIFCHEM-94526505972 [0,1,0,0,0,1|2,0,0]=4 67 B13R1.2872 CCC(=O)Nc1cc(ccc1I)C AIFCHEM-94526501607 [0,1,0,0,0,1|1,0,0]=3 68 B13R1.2872 CCC(=O)Nc1cc(ccc1O)Cl AIFCHEM-94526512235 [0,1,0,0,0,1|1,0,0]=3 69 B13R1.2872 CCC(=O)Nc1cc(cnc1C)C AIFCHEM-94526511580 [0,1,0,0,0,1|2,0,0]=4 70 B13R1.2872 CCC(=O)Nc1cc(ncc1C)C AIFCHEM-94526505039 [0,1,0,0,0,1|2,0,0]=4 71 B13R1.2872 CCN(C)Cc1cc(ccc1O)C AIFCHEM-94563259645 [0,1,0,0,0,1|2,0,0]=4 72 B13R1.2872 Cc1ccc(c(n1)NC(=O)CO)C AIFCHEM-94532685884 [0,1,0,0,0,1|2,0,0]=4 73 B13R1.2872 Cc1ccc(cc1NC(=O)CO)Br AIFCHEM-94532682233 [0,1,0,0,0,1|2,0,0]=4 74 B13R1.2872 Cc1ccc(cc1NC(=O)CO)Cl AIFCHEM-94528740326 [0,1,0,0,0,1|2,0,0]=4 75 B13R1.2872 Cc1ccc(cc1NC(=O)CO)F AIFCHEM-94532681982 [0,1,0,0,0,1|2,0,0]=4 76 B13R1.2872 O=C(CO)Nc1cc(ccc1Br)F AIFCHEM-94532674085 [0,1,0,0,0,1|2,0,0]=4 77 B13R1.2872 O=C(CO)Nc1cc(ccc1Cl)Br AIFCHEM-94532684117 [0,1,0,0,0,1|2,0,0]=4 78 B13R1.2872 O=C(CO)Nc1cc(ccc1F)Br AIFCHEM-94532681177 [0,1,0,0,0,1|2,0,0]=4 79 B13R1.2872 O=C(CO)Nc1cc(ccc1I)F AIFCHEM-94532680749 [0,1,0,0,0,1|2,0,0]=4 80 B13R1.2872 O=C(CO)Nc1cc(ccc1O)Br AIFCHEM-94532682433 [0,1,0,0,0,1|1,0,0]=3 81 B13R1.2872 O=C(CO)Nc1cc(ccc1O)Cl AIFCHEM-94532687440 [0,1,0,0,0,1|1,0,0]=3 82 B13R1.2872 O=C(CO)Nc1cc(ccc1O)O AIFCHEM-94523922057 [0,1,0,0,0,1|1,0,0]=3 83 B13R1.3089 COc1cnc(cc1C=C(C)C)C AIFCHEM-6367609498 [0,1,0,0,0,1|2,0,0]=4 84 B13R1.141 CCNc1ccc(cc1C(=O)O)C AIFCHEM-94537419843 [0,2,0,0,0,0|2,0,0]=4 85 B13R1.2209 C/C=C(\C)/c1cc(cnc1OC)C AIFCHEM-94584221351 [0,2,0,0,0,0|2,0,0]=4 86 B13R1.2209 C/C=C(\C)/c1nc(ccc1OC)C AIFCHEM-94584216300 [0,2,0,0,0,0|2,0,0]=4 87 B13R1.1807 C/C=C(\C)/c1cc(c(cc1F)F)C AIFCHEM-94584213751 [0,2,0,0,0,0|2,0,0]=4 88 B13R1.2431 C/C=C(\C)/c1cc(ccc1F)CO AIFCHEM-94584221864 [0,2,0,0,0,0|2,0,0]=4 89 B13R1.2431 C/C=C(\C)/c1cc(ccc1O)C=O AIFCHEM-94584220203 [0,2,0,0,0,0|1,0,1]=4 90 B13R1.2431 C/C=C(\C)/c1cc(ccc1O)OC AIFCHEM-94584214295 [0,2,0,0,0,0|1,0,0]=3 91 B13R1.387 CC=Cc1ccc(c(c1)C(=O)N)C AIFCHEM-6292096405 [0,2,0,0,0,0|2,0,0]=4 92 B13R1.387 CC=Cc1ccc(c(c1)C(=O)O)C AIFCHEM-6381464262 [0,2,0,0,0,0|2,0,0]=4 93 B13R1.387 CC=Cc1ccc(c(c1)C(=O)O)F AIFCHEM-6351942504 [0,2,0,0,0,0|2,0,0]=4 94 B13R1.387 CC=Cc1ccc(c(c1)C(C)C)O AIFCHEM-6369487315 [0,2,0,0,0,0|1,0,1]=4 95 B13R1.387 CCNc1ccc(c(c1)C(=O)O)Cl AIFCHEM-94537426645 [0,2,0,0,0,0|2,0,0]=4 96 B13R1.387 CCNc1ccc(c(c1)C(=O)O)O AIFCHEM-94537426646 [0,2,0,0,0,0|1,0,0]=3 97 B11R1.605 CC=Cc1c(cccc1O)C AIFCHEM-6359042356 [0,0,1,1,0,0|1,0,0]=3 98 B11R1.86 CC(=O)Nc1ccccc1C AIFCHEM-94578149958 [0,0,1,1,0,0|2,0,0]=4 99 B11R1.20 CC(=O)Nc1ccc(cn1)C AIFCHEM-5874295902 [0,0,1,1,0,0|2,0,0]=4 100 B11R1.157 CC(=O)Nc1cc(ccn1)O AIFCHEM-94605352203 [1,0,0,0,0,1|2,0,0]=4 101 B11R1.157 CC(=O)Nc1cccc(c1)C AIFCHEM-94605355038 [1,0,0,0,0,1|0,0,0]=2 102 B11R1.157 CC(=O)Nc1cccc(c1)F AIFCHEM-94579356885 [1,0,0,0,0,1|1,0,0]=3 103 B11R1.157 CC(=O)Nc1cccc(c1)I AIFCHEM-94605354864 [1,0,0,0,0,1|1,0,0]=3 104 B11R1.157 CC(=O)Nc1cncc(c1)C AIFCHEM-94524195082 [1,0,0,0,0,1|1,0,0]=3 105 B11R1.157 CC(=O)Nc1cncc(c1)F AIFCHEM-5999042768 [1,0,0,0,0,1|2,0,0]=4 106 B11R1.157 CC(=O)Nc1cncc(n1)C AIFCHEM-5599952056 [1,0,0,0,0,1|2,0,0]=4 107 B13R1.893 CC(=O)NCc1cc(ccc1C)Cl AIFCHEM-94570248829 [0,0,0,0,0,2|2,0,0]=4 108 B13R1.893 CC(=O)NCc1cc(ccc1F)Br AIFCHEM-94605348980 [0,0,0,0,0,2|2,0,0]=4 109 B13R1.893 CC(=O)NCc1cc(ccc1O)Br AIFCHEM-94535592844 [0,0,0,0,0,2|1,0,0]=3 110 B13R1.893 CC(=O)NCc1cc(ccc1O)C AIFCHEM-94577951124 [0,0,0,0,0,2|0,0,0]=2 111 B13R1.893 CC(=O)NCc1cc(ccc1O)Cl AIFCHEM-94535596130 [0,0,0,0,0,2|1,0,0]=3 112 B13R1.893 CC(=O)NCc1cc(ccc1O)F AIFCHEM-94535589094 [0,0,0,0,0,2|1,0,0]=3 113 B13R1.893 Cc1ccc(c(c1)CNC(C)C)O AIFCHEM-94520541173 [0,0,0,0,0,2|1,0,1]=4