0 B11R1.22 C/C=C(\C)/c1ccc(cc1)C AIFCHEM-94584220431 [0,0,0,0,0,0|1,0,1]=2 1 B11R1.22 C/C=C(\C)/c1ccc(nc1)O AIFCHEM-94584212304 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.22 C/C=C(\C)/c1ccc(nn1)C AIFCHEM-94584220752 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.22 CCN(C)c1ccc(cc1)Br AIFCHEM-94537424462 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.22 CCN(C)c1ccc(cc1)C AIFCHEM-94537423659 [0,0,0,0,0,0|2,0,1]=3 5 B11R1.22 CCN(C)c1ccc(cc1)I AIFCHEM-94568454920 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.22 CCN(C)c1ccc(cc1)O AIFCHEM-94520567749 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.1 CC=Cc1ccc(cc1)N AIFCHEM-94608719473 [1,0,0,0,0,0|2,0,1]=4 8 B10R1.1 CCNc1ccc(cc1)C AIFCHEM-94537411875 [1,0,0,0,0,0|2,0,1]=4 9 B10R1.15 C/C=C(\C)/c1ccccn1 AIFCHEM-94584209692 [1,0,0,0,0,0|2,0,1]=4 10 B12R1.5 C/C=C(\C)/c1ccc(cc1)SC AIFCHEM-94584209307 [0,1,0,0,0,0|1,0,1]=3 11 B12R1.5 CCN(C)c1ccc(cc1)OC AIFCHEM-94537411832 [0,1,0,0,0,0|2,0,1]=4 12 B12R1.16 CCCN(C)c1ccc(cc1)C AIFCHEM-94569020742 [0,1,0,0,0,0|2,0,1]=4 13 B12R1.16 CCNC(C)c1ccc(cc1)C AIFCHEM-94537423224 [0,1,0,0,0,0|1,0,1]=3 14 B12R1.16 CCNC(C)c1ccc(cc1)Cl AIFCHEM-94537423780 [0,1,0,0,0,0|2,0,1]=4 15 B12R1.16 CCN[C@@H](C)c1ccc(cc1)C AIFCHEM-94526455596 [0,1,0,0,0,0|1,0,1]=3 16 B12R1.16 CCN[C@@H](C)c1ccc(cc1)Cl AIFCHEM-94563416897 [0,1,0,0,0,0|2,0,1]=4 17 B12R1.16 CCN[C@@H](C)c1ccc(cc1)O AIFCHEM-94537411195 [0,1,0,0,0,0|2,0,1]=4 18 B12R1.16 CCN[C@H](C)c1ccc(cc1)C AIFCHEM-94537421477 [0,1,0,0,0,0|1,0,1]=3 19 B12R1.16 CCN[C@H](C)c1ccc(cc1)Cl AIFCHEM-94600892790 [0,1,0,0,0,0|2,0,1]=4 20 B12R1.16 CCN[C@H](C)c1ccc(cc1)O AIFCHEM-94537418040 [0,1,0,0,0,0|2,0,1]=4 21 B12R1.20 CC(=O)N(C)c1ccc(cc1)I AIFCHEM-5731761315 [0,1,0,0,0,0|2,0,0]=3 22 B12R1.20 CC(=O)N(C)c1ccc(nc1)C AIFCHEM-5897531248 [0,1,0,0,0,0|2,0,0]=3 23 B12R1.367 C/C=C(\C)/c1ccc(c(c1)F)F AIFCHEM-94584217608 [0,1,0,0,0,0|2,0,1]=4 24 B12R1.367 C/C=C(\C)/c1ccc(c(c1)N)F AIFCHEM-94584216942 [0,1,0,0,0,0|2,0,1]=4 25 B12R1.367 C/C=C(\C)/c1ccc(c(c1)O)N AIFCHEM-94584218023 [0,1,0,0,0,0|2,0,1]=4 26 B12R1.367 C/C=C(\C)/c1ccc(c(c1)O)O AIFCHEM-94584214301 [0,1,0,0,0,0|2,0,1]=4 27 B12R1.1703 C/C=C(\C)/c1ccc(cc1N)N AIFCHEM-94584220466 [0,1,0,0,0,0|2,0,1]=4 28 B12R1.49 CC(CO)Nc1ccc(cc1)F AIFCHEM-94552015989 [0,0,0,0,0,1|1,0,2]=4 29 B12R1.49 Cc1ccc(cn1)NC(C)CO AIFCHEM-6030935790 [0,0,0,0,0,1|1,0,2]=4 30 B11R1.1 Cc1ccc(cc1)C=CCO AIFCHEM-6341313267 [1,1,0,0,0,0|0,0,2]=4 31 B11R1.20 CC(=O)Nc1ccc(cn1)C AIFCHEM-5874295902 [1,1,0,0,0,0|2,0,0]=4 32 B11R1.81 CC=Cc1ccc(cc1C)C AIFCHEM-94527147474 [1,1,0,0,0,0|1,0,1]=4 33 B11R1.81 CC=Cc1ccc(cc1F)C AIFCHEM-6296674060 [1,1,0,0,0,0|1,0,1]=4 34 B11R1.192 CC=Cc1ccc(c(c1)C)C AIFCHEM-94530432251 [1,1,0,0,0,0|1,0,1]=4 35 B11R1.192 CC=Cc1ccc(c(c1)N)C AIFCHEM-5799362878 [1,1,0,0,0,0|1,0,1]=4 36 B11R1.23 C/C=C(\C)/c1cccc(c1)F AIFCHEM-94584209876 [1,1,0,0,0,0|1,0,1]=4 37 B11R1.36 CC(=O)N(C)c1ccccn1 AIFCHEM-94605353384 [1,1,0,0,0,0|2,0,0]=4 38 B11R1.36 CC(=O)N(C)c1cccnc1 AIFCHEM-6180237801 [1,1,0,0,0,0|2,0,0]=4 39 B11R1.222 C/C=C(\C)/c1ccccc1O AIFCHEM-94584219423 [1,1,0,0,0,0|1,0,1]=4 40 B13R1.5 CC(CO)Nc1ccc(cc1)CO AIFCHEM-6387174164 [0,1,0,0,0,1|0,0,2]=4 41 B13R1.5 CCc1ccc(cc1)NC(C)CO AIFCHEM-5786194468 [0,1,0,0,0,1|0,0,2]=4 42 B13R1.5 COc1ccc(cc1)NC(C)CO AIFCHEM-94577699851 [0,1,0,0,0,1|0,0,2]=4 43 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)O AIFCHEM-5781434716 [0,1,0,0,0,1|2,0,0]=4 44 B13R1.133 Cc1ccc(cc1)NC(C)C(F)F AIFCHEM-94547755701 [0,1,0,0,0,1|1,0,1]=4 45 B13R1.145 CCC(CO)Nc1ccc(cc1)C AIFCHEM-94584228700 [0,1,0,0,0,1|0,0,2]=4 46 B13R1.36 CC(=O)N(C)c1ccc(cc1)C#N AIFCHEM-94535596731 [0,2,0,0,0,0|1,0,1]=4 47 B13R1.36 COc1ccc(cc1)N(C)C(=O)C AIFCHEM-94605337723 [0,2,0,0,0,0|1,0,0]=3 48 B13R1.95 C/C=C(\C)/c1ccc(cc1C)NC AIFCHEM-94584222064 [0,2,0,0,0,0|1,0,1]=4 49 B13R1.95 C/C=C(\C)/c1ccc(cc1F)OC AIFCHEM-94584218757 [0,2,0,0,0,0|1,0,1]=4 50 B13R1.95 C/C=C(\C)/c1ccc(cc1O)OC AIFCHEM-94584218405 [0,2,0,0,0,0|1,0,1]=4 51 B13R1.139 C/C=C(\C)/c1ccc(cc1)CC#N AIFCHEM-94584219211 [0,2,0,0,0,0|1,0,1]=4 52 B13R1.452 CCNC(C)c1ccc(cc1)CC AIFCHEM-94537415691 [0,2,0,0,0,0|1,0,1]=4 53 B13R1.537 C/C=C(\C)/c1ccc(cc1)C(C)N AIFCHEM-94584216318 [0,2,0,0,0,0|1,0,1]=4 54 B13R1.537 C/C=C(\C)/c1ccc(cc1)N(C)C AIFCHEM-94584221172 [0,2,0,0,0,0|1,0,1]=4 55 B13R1.537 C/C=C(\C)/c1ccc(cc1)[C@@H](C)N AIFCHEM-94584220673 [0,2,0,0,0,0|1,0,1]=4 56 B13R1.537 C/C=C(\C)/c1ccc(cc1)[C@H](C)N AIFCHEM-94584212060 [0,2,0,0,0,0|1,0,1]=4 57 B13R1.3088 C/C=C(\C)/c1ccc(c(c1)C)NC AIFCHEM-94584220162 [0,2,0,0,0,0|1,0,1]=4 58 B13R1.3088 C/C=C(\C)/c1ccc(c(c1)F)CN AIFCHEM-94600286276 [0,2,0,0,0,0|1,0,1]=4 59 B13R1.3088 C/C=C(\C)/c1ccc(c(c1)N)CO AIFCHEM-94584224111 [0,2,0,0,0,0|1,0,1]=4 60 B13R1.3088 C/C=C(\C)/c1ccc(c(c1)O)CN AIFCHEM-94527574850 [0,2,0,0,0,0|1,0,1]=4 61 B13R1.3088 C/C=C(\C)/c1ccc(c(c1)O)CO AIFCHEM-94584214201 [0,2,0,0,0,0|1,0,1]=4 62 B13R1.706 CCN(C(=O)C)c1ccc(cc1)Br AIFCHEM-99350597732 [0,2,0,0,0,0|2,0,0]=4 63 B13R1.706 CCN(C(=O)C)c1ccc(cc1)C AIFCHEM-99350675819 [0,2,0,0,0,0|1,0,0]=3 64 B13R1.706 CCN(C(=O)C)c1ccc(cc1)F AIFCHEM-94685418996 [0,2,0,0,0,0|2,0,0]=4 65 B13R1.132 CC(=O)NC(C)c1ccc(cc1)Br AIFCHEM-5787514248 [0,2,0,0,0,0|1,0,0]=3 66 B13R1.132 CC(=O)NC(C)c1ccc(cn1)Br AIFCHEM-94605348585 [0,2,0,0,0,0|2,0,0]=4 67 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cc1)Br AIFCHEM-94605351492 [0,2,0,0,0,0|1,0,0]=3 68 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cc1)O AIFCHEM-94605335334 [0,2,0,0,0,0|1,0,0]=3 69 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cn1)Br AIFCHEM-94605342969 [0,2,0,0,0,0|2,0,0]=4 70 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)Br AIFCHEM-5772270039 [0,2,0,0,0,0|1,0,0]=3 71 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)O AIFCHEM-5627835211 [0,2,0,0,0,0|1,0,0]=3 72 B13R1.132 CC(=O)N[C@H](C)c1ccc(cn1)Br AIFCHEM-94605358050 [0,2,0,0,0,0|2,0,0]=4 73 B13R1.510 CC(=O)N(C)c1ccc(c(c1)C)Br AIFCHEM-94605356377 [0,2,0,0,0,0|2,0,0]=4 74 B13R1.49 C/C=C(\C)/c1ccc(c(c1)C#N)C AIFCHEM-94584219273 [0,2,0,0,0,0|1,0,1]=4 75 B13R1.1807 C/C=C(\C)/c1cc(c(cc1C)C)N AIFCHEM-94584221106 [0,2,0,0,0,0|1,0,1]=4 76 B13R1.1808 C/C=C(\C)/c1ccc(c(c1C)N)C AIFCHEM-94584219504 [0,2,0,0,0,0|1,0,1]=4 77 B13R1.1808 C/C=C(\C)/c1ccc(c(c1F)F)C AIFCHEM-94584223627 [0,2,0,0,0,0|1,0,1]=4 78 B13R1.2065 C/C=C(\C)/c1ccc(cc1C#N)C AIFCHEM-94584218558 [0,2,0,0,0,0|1,0,1]=4 79 B13R1.4656 C/C=C(\C)/c1c(cc(cc1F)C)F AIFCHEM-94584214583 [0,2,0,0,0,0|1,0,1]=4 80 B13R1.4656 C/C=C(\C)/c1c(cc(cc1F)C)N AIFCHEM-94584213424 [0,2,0,0,0,0|1,0,1]=4 81 B13R1.4656 C/C=C(\C)/c1c(cc(cc1F)C)O AIFCHEM-94584216236 [0,2,0,0,0,0|1,0,1]=4 82 B13R2.1069 Cc1ccc(cc1)NC2CCC2 AIFCHEM-94547752397 [0,0,0,1,0,1|1,0,1]=4