0 B13R1.643 CC(C)NCc1cccc(c1)C#N AIFCHEM-94520539120 [0,0,0,0,0,0|1,0,3]=4 1 B13R1.643 CC(O)C=Cc1cccc(c1)CN AIFCHEM-6203376330 [0,0,0,0,0,0|2,0,2]=4 2 B12R1.226 CC(=O)NCc1cccc(n1)C AIFCHEM-5718068665 [1,0,0,0,0,0|2,0,0]=3 3 B12R1.226 CC(=O)NCc1cncc(c1)C AIFCHEM-94535591610 [1,0,0,0,0,0|2,0,0]=3 4 B12R1.226 CC(C)NCc1cccc(c1)Br AIFCHEM-94520539518 [1,0,0,0,0,0|2,0,1]=4 5 B12R1.226 CC(C)NCc1cccc(c1)I AIFCHEM-94520541615 [1,0,0,0,0,0|2,0,1]=4 6 B12R1.226 Cc1ccnc(c1)CNC(C)C AIFCHEM-94520540677 [1,0,0,0,0,0|2,0,1]=4 7 B14R1.75 CC(C)N(C)Cc1cccc(c1)CO AIFCHEM-94547939518 [0,1,0,0,0,0|2,0,1]=4 8 B14R1.75 COc1cccc(c1)CN(C)C(=O)C AIFCHEM-5677985105 [0,1,0,0,0,0|3,0,0]=4 9 B14R1.77 CCc1cccc(c1)CNC(C)CF AIFCHEM-6109297977 [0,1,0,0,0,0|2,0,1]=4 10 B14R1.77 CCc1cccc(c1)CNC(C)CO AIFCHEM-6481600971 [0,1,0,0,0,0|2,0,1]=4 11 B14R1.77 CCc1cccc(c1)CN[C@@H](C)CF AIFCHEM-6033628092 [0,1,0,0,0,0|2,0,1]=4 12 B14R1.77 CCc1cccc(c1)CN[C@@H](C)CO AIFCHEM-6446944031 [0,1,0,0,0,0|2,0,1]=4 13 B14R1.77 CCc1cccc(c1)CN[C@H](C)CF AIFCHEM-6168940018 [0,1,0,0,0,0|2,0,1]=4 14 B14R1.77 CCc1cccc(c1)CN[C@H](C)CO AIFCHEM-6452932874 [0,1,0,0,0,0|2,0,1]=4 15 B14R1.81 COc1cccc(c1O)CNC(=O)C AIFCHEM-94605344911 [0,1,0,0,0,0|3,0,0]=4 16 B14R1.376 COc1cc(cc(c1)CNC(=O)C)F AIFCHEM-94535600885 [0,1,0,0,0,0|3,0,0]=4 17 B14R1.468 CC=Cc1cccc(c1)CNC(=O)C AIFCHEM-6341233134 [0,1,0,0,0,0|2,0,1]=4 18 B14R1.2335 CC(C)NCc1cc(ccc1O)CO AIFCHEM-94520541860 [0,1,0,0,0,0|2,0,1]=4 19 B14R1.6355 CC(=O)NCc1cccc(c1)C(F)F AIFCHEM-6135010281 [0,1,0,0,0,0|2,0,0]=3 20 B14R1.6355 CC(=O)NCc1cncc(c1)C(=O)N AIFCHEM-94605348623 [0,1,0,0,0,0|2,0,1]=4 21 B14R1.6355 CC(C)NCc1cccc(c1)C(C)C AIFCHEM-94520539695 [0,1,0,0,0,0|2,0,1]=4 22 B14R2.1264 CC(C)NCc1ccc2c(c1)CC2 AIFCHEM-94520536748 [0,0,0,1,0,0|2,0,1]=4 23 B12R1.438 CC(=Cc1cccc(c1)CO)C AIFCHEM-6458433281 [0,0,0,0,1,0|2,0,1]=4 24 B12R1.438 CSc1cccc(c1)NC(=O)C AIFCHEM-94535592741 [0,0,0,0,1,0|3,0,0]=4 25 B14R1.76 CCc1cccc(c1)CNCC(=O)N AIFCHEM-94550117521 [0,0,0,0,0,1|2,0,1]=4 26 B14R1.76 CCc1cccc(c1)CNCC(C)O AIFCHEM-94558283496 [0,0,0,0,0,1|2,0,1]=4 27 B14R1.76 CCc1cccc(c1)CNC[C@@H](C)O AIFCHEM-6490974845 [0,0,0,0,0,1|2,0,1]=4 28 B14R1.76 CCc1cccc(c1)CNC[C@H](C)O AIFCHEM-6495846807 [0,0,0,0,0,1|2,0,1]=4 29 B11R1.24 CCNCc1cccc(c1)C AIFCHEM-94537252418 [2,0,0,0,0,0|0,0,1]=3 30 B11R1.24 CCNCc1cccc(n1)C AIFCHEM-94537414853 [2,0,0,0,0,0|1,0,1]=4 31 B11R1.24 CCNCc1cncc(c1)C AIFCHEM-94537415593 [2,0,0,0,0,0|1,0,1]=4 32 B11R1.91 CC(=O)NCc1ccccn1 AIFCHEM-5686879180 [2,0,0,0,0,0|2,0,0]=4 33 B11R1.189 CC=Cc1cccc(c1)CO AIFCHEM-6418881109 [2,0,0,0,0,0|1,0,1]=4 34 B13R1.15 CCC(=O)NCc1cccc(c1)O AIFCHEM-94526510073 [1,1,0,0,0,0|2,0,0]=4 35 B13R1.15 Cc1cccc(n1)CNC(=O)CO AIFCHEM-5766022009 [1,1,0,0,0,0|2,0,0]=4 36 B13R1.15 O=C(CO)NCc1cccc(c1)Br AIFCHEM-94532674370 [1,1,0,0,0,0|2,0,0]=4 37 B13R1.147 CC(=O)N[C@@H](C)c1cccc(c1)O AIFCHEM-94586561523 [1,1,0,0,0,0|2,0,0]=4 38 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)O AIFCHEM-94535600030 [1,1,0,0,0,0|2,0,0]=4 39 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Cl AIFCHEM-94535596079 [1,1,0,0,0,0|2,0,0]=4 40 B13R1.150 CC(=O)NCc1cccc(c1Cl)F AIFCHEM-94605355735 [1,1,0,0,0,0|2,0,0]=4 41 B13R1.150 CC(=O)NCc1cccc(c1O)Br AIFCHEM-94605347587 [1,1,0,0,0,0|2,0,0]=4 42 B13R1.150 CC(=O)NCc1cccc(c1O)C AIFCHEM-94605348593 [1,1,0,0,0,0|1,0,0]=3 43 B13R1.150 CC(=O)NCc1cccc(c1O)F AIFCHEM-94535593612 [1,1,0,0,0,0|2,0,0]=4 44 B13R1.150 CC(=O)NCc1cccc(c1O)O AIFCHEM-94535589508 [1,1,0,0,0,0|2,0,0]=4 45 B13R1.150 Cc1cccc(c1Br)CNC(C)C AIFCHEM-94520536627 [1,1,0,0,0,0|1,0,1]=4 46 B13R1.150 Cc1cccc(c1Cl)CNC(C)C AIFCHEM-94520541197 [1,1,0,0,0,0|1,0,1]=4 47 B13R1.150 Cc1cccc(c1F)CNC(C)C AIFCHEM-94520542467 [1,1,0,0,0,0|1,0,1]=4 48 B13R1.150 Cc1cccc(c1O)CNC(C)C AIFCHEM-94520542072 [1,1,0,0,0,0|1,0,1]=4 49 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Br AIFCHEM-94590031293 [1,1,0,0,0,0|2,0,0]=4 50 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)F AIFCHEM-5841829334 [1,1,0,0,0,0|2,0,0]=4 51 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Cl AIFCHEM-94605355739 [1,1,0,0,0,0|2,0,0]=4 52 B13R1.511 CC(=O)NCc1ccc(c(c1)O)F AIFCHEM-6047279791 [1,1,0,0,0,0|2,0,0]=4 53 B13R1.511 CC(=O)NCc1ccc(c(c1)O)O AIFCHEM-94535592243 [1,1,0,0,0,0|2,0,0]=4 54 B13R1.511 Cc1cc(ccc1Br)CNC(C)C AIFCHEM-94520541980 [1,1,0,0,0,0|1,0,1]=4 55 B13R1.838 Cc1cccc(c1)CNC(C)(C)C AIFCHEM-94589407394 [1,1,0,0,0,0|1,0,1]=4 56 B13R1.893 CC(=O)NCc1cc(ccc1C)Cl AIFCHEM-94570248829 [1,1,0,0,0,0|2,0,0]=4 57 B13R1.893 CC(=O)NCc1cc(ccc1F)Br AIFCHEM-94605348980 [1,1,0,0,0,0|2,0,0]=4 58 B13R1.893 CC(=O)NCc1cc(ccc1O)Br AIFCHEM-94535592844 [1,1,0,0,0,0|2,0,0]=4 59 B13R1.893 CC(=O)NCc1cc(ccc1O)C AIFCHEM-94577951124 [1,1,0,0,0,0|1,0,0]=3 60 B13R1.893 CC(=O)NCc1cc(ccc1O)Cl AIFCHEM-94535596130 [1,1,0,0,0,0|2,0,0]=4 61 B13R1.893 CC(=O)NCc1cc(ccc1O)F AIFCHEM-94535589094 [1,1,0,0,0,0|2,0,0]=4 62 B13R1.893 Cc1ccc(c(c1)CNC(C)C)Cl AIFCHEM-94520537854 [1,1,0,0,0,0|1,0,1]=4 63 B13R1.893 Cc1ccc(c(c1)CNC(C)C)O AIFCHEM-94520541173 [1,1,0,0,0,0|1,0,1]=4 64 B13R1.3420 CC(=O)NCc1cc(cc(c1)C)C AIFCHEM-5610552638 [1,1,0,0,0,0|1,0,0]=3 65 B13R1.3420 CC(=O)NCc1cc(cc(c1)F)O AIFCHEM-6203779326 [1,1,0,0,0,0|2,0,0]=4 66 B13R1.3420 Cc1cc(cc(c1)CNC(C)C)Cl AIFCHEM-94520536428 [1,1,0,0,0,0|1,0,1]=4 67 B13R1.666 CCCNCc1cccc(c1)CC AIFCHEM-94521369079 [1,1,0,0,0,0|1,0,1]=4 68 B13R1.666 CCc1cccc(c1)CNCCF AIFCHEM-5800590174 [1,1,0,0,0,0|1,0,1]=4 69 B13R1.52 CC(=Cc1ccc(c(c1)CN)O)C AIFCHEM-5659313066 [0,1,0,0,1,0|1,0,1]=4 70 B13R1.587 CC(=O)Nc1cccc(c1)C(=S)N AIFCHEM-94605356276 [0,1,0,0,1,0|1,0,1]=4 71 B13R1.641 CC(=Cc1cccc(c1O)CN)C AIFCHEM-6249212467 [0,1,0,0,1,0|1,0,1]=4 72 B15R1.1569 CCc1cccc(c1)CNCC(=O)OC AIFCHEM-6212810652 [0,1,0,0,0,1|2,0,0]=4 73 B15R1.569 CCOc1cccc(c1)CNC(=O)CO AIFCHEM-94532687174 [0,2,0,0,0,0|2,0,0]=4 74 B15R1.1106 CCC(=O)NCc1cccc(c1)C(=O)N AIFCHEM-94548714370 [0,2,0,0,0,0|1,0,1]=4 75 B15R2.18 Cc1nc(cs1)c2cccc(c2)CN AIFCHEM-6348828304 [0,0,0,1,0,1|1,0,1]=4 76 B11R1.75 CC(=O)NCc1ccc(s1)C AIFCHEM-94561602504 [1,0,0,0,1,0|2,0,0]=4 77 B11R1.157 CC(=O)Nc1cccc(c1)C AIFCHEM-94605355038 [1,0,0,0,1,0|1,0,0]=3 78 B11R1.157 CC(=O)Nc1cccc(c1)F AIFCHEM-94579356885 [1,0,0,0,1,0|2,0,0]=4 79 B11R1.157 CC(=O)Nc1cccc(c1)I AIFCHEM-94605354864 [1,0,0,0,1,0|2,0,0]=4 80 B11R1.157 CC(=O)Nc1cncc(c1)C AIFCHEM-94524195082 [1,0,0,0,1,0|2,0,0]=4 81 B13R1.149 Cc1cccc(c1)CNCC(C)C AIFCHEM-94563723600 [1,0,0,0,0,1|1,0,1]=4 82 B13R1.3 CCc1ccc(cc1)CNC(=O)C AIFCHEM-94605355910 [0,0,0,0,1,1|2,0,0]=4