0 B12R1.367 C/C=C(\C)/c1ccc(c(c1)F)F AIFCHEM-94584217608 [0,1,0,0,0,0|2,0,1]=4 1 B12R1.367 C/C=C(\C)/c1ccc(c(c1)N)F AIFCHEM-94584216942 [0,1,0,0,0,0|2,0,1]=4 2 B12R1.367 C/C=C(\C)/c1ccc(c(c1)O)N AIFCHEM-94584218023 [0,1,0,0,0,0|1,0,1]=3 3 B12R1.367 C/C=C(\C)/c1ccc(c(c1)O)O AIFCHEM-94584214301 [0,1,0,0,0,0|1,0,1]=3 4 B12R1.367 C/C=C(\C)/c1cnc(c(c1)O)N AIFCHEM-94584218233 [0,1,0,0,0,0|2,0,1]=4 5 B12R1.19 CC(=Cc1cc(c(cn1)C)C)C AIFCHEM-6429314046 [0,0,0,0,0,1|2,0,1]=4 6 B12R1.19 CC(=Cc1ccc(c(c1)N)N)C AIFCHEM-6298159563 [0,0,0,0,0,1|2,0,1]=4 7 B12R1.19 CC(=Cc1ccc(c(c1)O)O)C AIFCHEM-6398326996 [0,0,0,0,0,1|1,0,1]=3 8 B12R1.19 CC(=Cc1cnc(c(c1)O)C)C AIFCHEM-6298560533 [0,0,0,0,0,1|1,0,1]=3 9 B12R1.19 CC(=Cc1cnc(c(c1)O)N)C AIFCHEM-6237410734 [0,0,0,0,0,1|2,0,1]=4 10 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O AIFCHEM-94535592055 [0,0,0,0,0,1|2,0,1]=4 11 B11R1.22 C/C=C(\C)/c1ccc(cc1)C AIFCHEM-94584220431 [1,1,0,0,0,0|0,0,1]=3 12 B11R1.22 CCN(C)c1ccc(cc1)Br AIFCHEM-94537424462 [1,1,0,0,0,0|2,0,0]=4 13 B11R1.22 CCN(C)c1ccc(cc1)C AIFCHEM-94537423659 [1,1,0,0,0,0|1,0,0]=3 14 B11R1.22 CCN(C)c1ccc(cc1)I AIFCHEM-94568454920 [1,1,0,0,0,0|2,0,0]=4 15 B11R1.22 CCN(C)c1ccc(cc1)O AIFCHEM-94520567749 [1,1,0,0,0,0|2,0,0]=4 16 B11R1.23 C/C=C(\C)/c1cccc(c1)F AIFCHEM-94584209876 [1,1,0,0,0,0|1,0,1]=4 17 B11R1.23 C/C=C(\C)/c1cccc(n1)O AIFCHEM-94584216776 [1,1,0,0,0,0|1,0,1]=4 18 B11R1.23 CCN(C)c1cccc(c1)Br AIFCHEM-94537415946 [1,1,0,0,0,0|2,0,0]=4 19 B11R1.192 CC=Cc1ccc(c(c1)C)C AIFCHEM-94530432251 [1,1,0,0,0,0|1,0,1]=4 20 B11R1.192 CC=Cc1ccc(c(c1)N)C AIFCHEM-5799362878 [1,1,0,0,0,0|1,0,1]=4 21 B11R1.192 CC=Cc1ccc(c(c1)O)O AIFCHEM-6368218750 [1,1,0,0,0,0|1,0,1]=4 22 B11R1.192 CCNc1cc(c(cn1)C)Br AIFCHEM-94537411613 [1,1,0,0,0,0|2,0,0]=4 23 B11R1.192 CCNc1ccc(c(c1)C)Cl AIFCHEM-94537419953 [1,1,0,0,0,0|2,0,0]=4 24 B11R1.192 CCNc1ccc(c(c1)Cl)Br AIFCHEM-94537418358 [1,1,0,0,0,0|2,0,0]=4 25 B11R1.192 CCNc1ccc(c(c1)Cl)Cl AIFCHEM-94563320197 [1,1,0,0,0,0|2,0,0]=4 26 B11R1.192 CCNc1ccc(c(c1)F)C AIFCHEM-94537421787 [1,1,0,0,0,0|1,0,0]=3 27 B11R1.192 CCNc1ccc(c(c1)F)I AIFCHEM-94537424115 [1,1,0,0,0,0|2,0,0]=4 28 B11R1.192 CCNc1ccc(c(c1)I)O AIFCHEM-94537426737 [1,1,0,0,0,0|2,0,0]=4 29 B11R1.192 CCNc1ccc(c(c1)O)O AIFCHEM-94537416152 [1,1,0,0,0,0|1,0,0]=3 30 B13R1.35 CC(=Cc1ccc(c(c1)C)CN)C AIFCHEM-94574533182 [0,1,0,0,0,1|1,0,1]=4 31 B13R1.35 CC(=Cc1ccc(c(c1)N)CO)C AIFCHEM-6462582016 [0,1,0,0,0,1|1,0,1]=4 32 B13R1.35 CC(=Cc1ccc(c(c1)O)C=O)C AIFCHEM-6404265018 [0,1,0,0,0,1|0,0,2]=4 33 B13R1.35 CC(=Cc1ccc(c(c1)O)CN)C AIFCHEM-94527572602 [0,1,0,0,0,1|0,0,1]=3 34 B13R1.35 COc1ncc(cc1O)C=C(C)C AIFCHEM-6295677022 [0,1,0,0,0,1|1,0,1]=4 35 B13R1.52 CC(=Cc1ccc(c(c1)CO)F)C AIFCHEM-6298930923 [0,1,0,0,0,1|1,0,1]=4 36 B13R1.52 CC(=Cc1cnc(c(c1)CO)C)C AIFCHEM-6314022941 [0,1,0,0,0,1|1,0,1]=4 37 B13R1.52 COc1cc(ccc1N)C=C(C)C AIFCHEM-5750864117 [0,1,0,0,0,1|1,0,1]=4 38 B13R1.876 CC(=Cc1cc(c(cc1C)C)N)C AIFCHEM-6271034376 [0,1,0,0,0,1|1,0,1]=4 39 B13R1.876 CC(=Cc1cc(c(cc1F)C)C)C AIFCHEM-6371680790 [0,1,0,0,0,1|1,0,1]=4 40 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)C AIFCHEM-94526503888 [0,1,0,0,0,1|1,0,1]=4 41 B13R1.2879 CCN(C)Cc1ccc(c(c1)Br)C AIFCHEM-6125412917 [0,1,0,0,0,1|2,0,0]=4 42 B13R1.2879 CCN(C)Cc1ccc(c(c1)Cl)C AIFCHEM-94563258156 [0,1,0,0,0,1|2,0,0]=4 43 B13R1.2879 CCN(C)Cc1ccc(c(c1)F)C AIFCHEM-6118541489 [0,1,0,0,0,1|2,0,0]=4 44 B13R1.2879 CCN(C)Cc1ccc(c(c1)O)O AIFCHEM-94537411526 [0,1,0,0,0,1|2,0,0]=4 45 B13R1.2879 Cc1cc(ccc1Cl)NC(C)CO AIFCHEM-94583424246 [0,1,0,0,0,1|2,0,0]=4 46 B13R1.2879 Cc1cc(ccc1F)NC(C)CO AIFCHEM-5814471132 [0,1,0,0,0,1|2,0,0]=4 47 B13R1.3528 CC(=Cc1ccc(c(c1F)O)F)C AIFCHEM-6409897037 [0,1,0,0,0,1|1,0,1]=4 48 B13R1.3763 CC(=Cc1cc(c(c(c1)F)O)O)C AIFCHEM-6368913918 [0,1,0,0,0,1|1,0,1]=4 49 B13R1.3763 CC(=Cc1cc(c(c(c1)O)O)O)C AIFCHEM-6387680473 [0,1,0,0,0,1|1,0,1]=4 50 B13R1.144 CC=Cc1ccc(cc1C)N(C)C AIFCHEM-94562686473 [0,2,0,0,0,0|2,0,0]=4 51 B13R1.3088 C/C=C(\C)/c1ccc(c(c1)C)NC AIFCHEM-94584220162 [0,2,0,0,0,0|1,0,1]=4 52 B13R1.3088 C/C=C(\C)/c1ccc(c(c1)F)CN AIFCHEM-94600286276 [0,2,0,0,0,0|1,0,1]=4 53 B13R1.3088 C/C=C(\C)/c1ccc(c(c1)N)CO AIFCHEM-94584224111 [0,2,0,0,0,0|1,0,1]=4 54 B13R1.3088 C/C=C(\C)/c1ccc(c(c1)O)CN AIFCHEM-94527574850 [0,2,0,0,0,0|0,0,1]=3 55 B13R1.3088 C/C=C(\C)/c1ccc(c(c1)O)CO AIFCHEM-94584214201 [0,2,0,0,0,0|0,0,1]=3 56 B13R1.49 C/C=C(\C)/c1ccc(c(c1)C#N)C AIFCHEM-94584219273 [0,2,0,0,0,0|1,0,1]=4 57 B13R1.49 C/C=C(\C)/c1ccc(c(c1)OC)O AIFCHEM-94584221496 [0,2,0,0,0,0|1,0,1]=4 58 B13R1.49 C/C=C(\C)/c1cnc(c(c1)CO)C AIFCHEM-94584212300 [0,2,0,0,0,0|1,0,1]=4 59 B13R1.1807 C/C=C(\C)/c1cc(c(cc1C)C)N AIFCHEM-94584221106 [0,2,0,0,0,0|1,0,1]=4 60 B13R1.331 CCN(CC)c1ccc(c(c1)C)C AIFCHEM-94537419532 [0,2,0,0,0,0|2,0,0]=4 61 B13R1.466 CCNC(C)c1ccc(c(c1)C)F AIFCHEM-94576212269 [0,2,0,0,0,0|2,0,0]=4 62 B13R1.466 CCNC(C)c1ccc(c(c1)Cl)Cl AIFCHEM-94583786479 [0,2,0,0,0,0|2,0,0]=4 63 B13R1.466 CCNC(C)c1ccc(c(c1)F)F AIFCHEM-94537419613 [0,2,0,0,0,0|2,0,0]=4 64 B13R1.466 CCN[C@@H](C)c1ccc(c(c1)C)F AIFCHEM-94537413356 [0,2,0,0,0,0|2,0,0]=4 65 B13R1.466 CCN[C@@H](C)c1ccc(c(c1)Cl)Cl AIFCHEM-94549769915 [0,2,0,0,0,0|2,0,0]=4 66 B13R1.466 CCN[C@@H](C)c1ccc(c(c1)F)F AIFCHEM-94553998507 [0,2,0,0,0,0|2,0,0]=4 67 B13R1.466 CCN[C@H](C)c1ccc(c(c1)Cl)Cl AIFCHEM-94537415842 [0,2,0,0,0,0|2,0,0]=4 68 B13R1.466 CCN[C@H](C)c1ccc(c(c1)F)F AIFCHEM-94537421693 [0,2,0,0,0,0|2,0,0]=4 69 B13R1.1808 C/C=C(\C)/c1ccc(c(c1C)N)C AIFCHEM-94584219504 [0,2,0,0,0,0|1,0,1]=4 70 B13R1.1808 C/C=C(\C)/c1ccc(c(c1F)F)C AIFCHEM-94584223627 [0,2,0,0,0,0|1,0,1]=4 71 B13R1.2678 C/C=C(\C)/c1cc(c(c(c1)F)O)O AIFCHEM-94584222812 [0,2,0,0,0,0|1,0,1]=4 72 B13R1.2678 C/C=C(\C)/c1cc(c(c(c1)O)N)C AIFCHEM-94584210589 [0,2,0,0,0,0|1,0,1]=4 73 B13R1.2678 C/C=C(\C)/c1cc(c(c(c1)O)O)O AIFCHEM-94584214002 [0,2,0,0,0,0|1,0,1]=4 74 B13R2.1279 CC(=Cc1ccc2c(c1)CC2)C AIFCHEM-6350037789 [0,0,0,1,0,1|1,0,1]=4 75 B11R1.157 CC(=Cc1cncc(c1)O)C AIFCHEM-6405765996 [1,0,0,0,0,1|1,0,1]=4 76 B13R1.511 CC(C)CNc1ccc(c(c1)F)I AIFCHEM-94572983452 [0,0,0,0,0,2|2,0,0]=4 77 B13R1.511 CC(C)CNc1ccc(c(c1)I)Cl AIFCHEM-94572982399 [0,0,0,0,0,2|2,0,0]=4 78 B13R1.511 CC(C)CNc1ccc(c(c1)I)O AIFCHEM-94572986074 [0,0,0,0,0,2|2,0,0]=4 79 B13R1.511 CC(C)NCc1ccc(c(c1)F)O AIFCHEM-94520540088 [0,0,0,0,0,2|2,0,0]=4 80 B13R1.511 CC(C)NCc1ccc(c(c1)I)F AIFCHEM-94520538932 [0,0,0,0,0,2|2,0,0]=4 81 B13R1.511 CC(C)NCc1ccc(c(c1)I)O AIFCHEM-94520541095 [0,0,0,0,0,2|2,0,0]=4 82 B13R1.511 CC(C)NCc1ccc(c(c1)O)Cl AIFCHEM-94520540902 [0,0,0,0,0,2|1,0,0]=3 83 B13R1.511 CC(O)C=Cc1ccc(c(c1)O)O AIFCHEM-6368210826 [0,0,0,0,0,2|2,0,0]=4 84 B13R1.511 Cc1cc(ccc1Br)CNC(C)C AIFCHEM-94520541980 [0,0,0,0,0,2|2,0,0]=4 85 B13R1.511 Cc1cc(ccc1Cl)NCC(C)C AIFCHEM-94583429383 [0,0,0,0,0,2|2,0,0]=4 86 B13R1.511 Cc1cc(ccc1F)NCC(C)C AIFCHEM-94572981122 [0,0,0,0,0,2|2,0,0]=4 87 B13R1.511 Cc1cc(ccc1O)NCC(C)C AIFCHEM-94527203602 [0,0,0,0,0,2|2,0,0]=4 88 B13R1.511 Cc1cc(cnc1C)NCC(C)C AIFCHEM-94572983500 [0,0,0,0,0,2|2,0,0]=4 89 B13R1.511 Cc1ccc(cc1Br)CNC(C)C AIFCHEM-94520539845 [0,0,0,0,0,2|1,0,0]=3 90 B13R1.511 Cc1ccc(cc1C)NCC(C)C AIFCHEM-94572984268 [0,0,0,0,0,2|1,0,0]=3 91 B13R1.511 Cc1ccc(cc1I)CNC(C)C AIFCHEM-94520541013 [0,0,0,0,0,2|1,0,0]=3 92 B13R1.511 Cc1ccc(cc1I)NCC(C)C AIFCHEM-94572980042 [0,0,0,0,0,2|1,0,0]=3 93 B13R1.511 Cc1ccc(cc1O)C=CC(C)O AIFCHEM-6353214399 [0,0,0,0,0,2|1,0,0]=3 94 B13R1.511 Cc1ccc(cc1O)CNC(C)C AIFCHEM-94520540918 [0,0,0,0,0,2|0,0,0]=2 95 B13R1.511 Cc1cnc(cc1Cl)NCC(C)C AIFCHEM-94572970949 [0,0,0,0,0,2|2,0,0]=4