0 B12R1.32 CC#CC(=O)Nc1ccccc1 AIFCHEM-94552045484 [0,0,0,0,0,0|2,0,1]=3 1 B12R1.32 CC#CC(=O)Nc1ccncc1 AIFCHEM-94533902132 [0,0,0,0,0,0|3,0,1]=4 2 B12R1.32 CCCN(C)Cc1ccccn1 AIFCHEM-5860218756 [0,0,0,0,0,0|4,0,0]=4 3 B12R1.32 COCC(=O)Nc1ccncc1 AIFCHEM-94533902369 [0,0,0,0,0,0|4,0,0]=4 4 B12R1.32 O=C(CCO)Nc1ccccc1 AIFCHEM-94552044770 [0,0,0,0,0,0|3,0,0]=3 5 B12R1.32 O=C(CCO)Nc1ccncc1 AIFCHEM-94533901418 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.28 CCCNCc1ccncc1 AIFCHEM-5790435281 [1,0,0,0,0,0|3,0,0]=4 7 B11R1.28 CCOC=Cc1ccncc1 AIFCHEM-6380433924 [1,0,0,0,0,0|1,0,1]=3 8 B11R1.40 CCC(=O)Nc1ccccn1 AIFCHEM-94526506315 [1,0,0,0,0,0|2,0,0]=3 9 B11R1.40 CCC(=O)Nc1cccnn1 AIFCHEM-94554024128 [1,0,0,0,0,0|3,0,0]=4 10 B11R1.40 CCN(C)Cc1ccccc1 AIFCHEM-94537411577 [1,0,0,0,0,0|2,0,0]=3 11 B11R1.40 CCN(C)Cc1cccnc1 AIFCHEM-94537417880 [1,0,0,0,0,0|3,0,0]=4 12 B11R1.40 O=C(CO)Nc1cccnc1 AIFCHEM-94531016168 [1,0,0,0,0,0|3,0,0]=4 13 B13R1.19 CC#CC(=O)Nc1ccc(cc1)C AIFCHEM-94584238232 [0,1,0,0,0,0|2,0,1]=4 14 B13R1.19 CC#CC(=O)Nc1ccc(cc1)Cl AIFCHEM-94586019392 [0,1,0,0,0,0|2,0,1]=4 15 B13R1.19 CC#CC(=O)Nc1ccc(cc1)O AIFCHEM-94596165465 [0,1,0,0,0,0|2,0,1]=4 16 B13R1.19 CCCN(C)Cc1ccc(cc1)Br AIFCHEM-94538720467 [0,1,0,0,0,0|3,0,0]=4 17 B13R1.19 CCCN(C)Cc1ccc(cc1)C AIFCHEM-94569021655 [0,1,0,0,0,0|3,0,0]=4 18 B13R1.19 CCCN(C)Cc1ccc(cc1)Cl AIFCHEM-5860345714 [0,1,0,0,0,0|3,0,0]=4 19 B13R1.19 COCC(=O)Nc1ccc(cc1)C AIFCHEM-94547765747 [0,1,0,0,0,0|3,0,0]=4 20 B13R1.19 COCC(=O)Nc1ccc(cc1)I AIFCHEM-6151507728 [0,1,0,0,0,0|3,0,0]=4 21 B13R1.19 CSCC(=O)Nc1ccc(cc1)Br AIFCHEM-94608724827 [0,1,0,0,0,0|3,0,0]=4 22 B13R1.19 O=C(CCO)Nc1ccc(cc1)Cl AIFCHEM-94586018678 [0,1,0,0,0,0|3,0,0]=4 23 B13R1.20 COCC(=O)Nc1cccc(c1)Br AIFCHEM-94552712786 [0,1,0,0,0,0|3,0,0]=4 24 B13R1.20 COCC(=O)Nc1cccc(c1)O AIFCHEM-94542291004 [0,1,0,0,0,0|3,0,0]=4 25 B13R1.20 CSCC(=O)Nc1cccc(c1)Cl AIFCHEM-94523498229 [0,1,0,0,0,0|3,0,0]=4 26 B13R1.20 CSCC(=O)Nc1cccc(c1)F AIFCHEM-5690598099 [0,1,0,0,0,0|3,0,0]=4 27 B13R1.20 O=C(CCO)Nc1cccc(c1)Br AIFCHEM-94552711455 [0,1,0,0,0,0|3,0,0]=4 28 B13R1.44 C/C=C/CC(=O)Nc1ccccc1 AIFCHEM-94577031294 [0,1,0,0,0,0|2,0,1]=4 29 B13R1.44 CCCCC(=O)Nc1ccccn1 AIFCHEM-94586363259 [0,1,0,0,0,0|3,0,0]=4 30 B13R1.44 CCCCC(=O)Nc1ccncc1 AIFCHEM-94534099520 [0,1,0,0,0,0|3,0,0]=4 31 B13R1.44 CCCCN(C)Cc1ccccc1 AIFCHEM-94536079434 [0,1,0,0,0,0|3,0,0]=4 32 B13R1.44 CCCNC(=O)Cc1ncccn1 AIFCHEM-94521379928 [0,1,0,0,0,0|3,0,0]=4 33 B13R1.135 CCC(=O)N(C)Cc1ccccc1 AIFCHEM-94536109342 [0,1,0,0,0,0|3,0,0]=4 34 B13R1.135 CCC(C)C(=O)Nc1ccncc1 AIFCHEM-94533895783 [0,1,0,0,0,0|3,0,0]=4 35 B13R1.135 CCC(O)C(=O)Nc1ccncc1 AIFCHEM-94533902194 [0,1,0,0,0,0|3,0,0]=4 36 B13R1.135 CCN(C)C(=O)Cc1cccnc1 AIFCHEM-94529327136 [0,1,0,0,0,0|2,0,0]=3 37 B13R1.135 CCN(C)C(=O)Cc1ccncn1 AIFCHEM-6099484564 [0,1,0,0,0,0|3,0,0]=4 38 B13R1.135 CC[C@@H](C)C(=O)Nc1ccncc1 AIFCHEM-94533900183 [0,1,0,0,0,0|3,0,0]=4 39 B13R1.135 CC[C@@H](O)C(=O)Nc1ccncc1 AIFCHEM-94533898638 [0,1,0,0,0,0|3,0,0]=4 40 B13R1.135 CC[C@H](C)C(=O)Nc1ccncc1 AIFCHEM-94533897972 [0,1,0,0,0,0|3,0,0]=4 41 B13R1.135 CC[C@H](O)C(=O)Nc1ccncc1 AIFCHEM-94533900316 [0,1,0,0,0,0|3,0,0]=4 42 B13R1.135 COC(C)C(=O)Nc1ccccc1 AIFCHEM-94552044371 [0,1,0,0,0,0|3,0,0]=4 43 B13R1.135 CO[C@@H](C)C(=O)Nc1ccccc1 AIFCHEM-94577032985 [0,1,0,0,0,0|3,0,0]=4 44 B13R1.135 CO[C@H](C)C(=O)Nc1ccccc1 AIFCHEM-94577032981 [0,1,0,0,0,0|3,0,0]=4 45 B13R1.348 CC(C)CC(=O)Nc1ccccn1 AIFCHEM-5962320555 [0,1,0,0,0,0|3,0,0]=4 46 B13R1.348 CC(C)NC(=O)Cc1ccncn1 AIFCHEM-94520548109 [0,1,0,0,0,0|3,0,0]=4 47 B13R1.348 CC(C)NC(=O)Cc1cnccn1 AIFCHEM-94520544962 [0,1,0,0,0,0|3,0,0]=4 48 B13R1.348 CC(C)NC(=O)Cc1ncccn1 AIFCHEM-94520550543 [0,1,0,0,0,0|3,0,0]=4 49 B13R1.470 CC#CC(=O)Nc1ccccc1F AIFCHEM-6046075978 [0,1,0,0,0,0|2,0,1]=4 50 B13R1.470 CCCN(C)Cc1ccccc1Cl AIFCHEM-94569024444 [0,1,0,0,0,0|3,0,0]=4 51 B13R1.470 CCCN(C)Cc1ccccc1F AIFCHEM-5878765147 [0,1,0,0,0,0|3,0,0]=4 52 B13R1.470 CCCN(C)Cc1ccccc1O AIFCHEM-94532467853 [0,1,0,0,0,0|3,0,0]=4 53 B13R1.470 CSCC(=O)Nc1ccccc1C AIFCHEM-94578152707 [0,1,0,0,0,0|3,0,0]=4 54 B13R1.470 Cc1ccccc1NC(=O)CCO AIFCHEM-94578154680 [0,1,0,0,0,0|3,0,0]=4 55 B13R2.26 CCNc1cc2ccccc2s1 AIFCHEM-94537421792 [0,0,0,1,0,0|1,1,1]=4 56 B13R2.444 O=C(Nc1cccnc1)C2CC2 AIFCHEM-94531010905 [0,0,0,1,0,0|3,0,0]=4 57 B13R1.42 CC#CC(=O)NCc1ccccn1 AIFCHEM-5687008164 [0,0,0,0,0,1|2,0,1]=4 58 B13R1.42 COCC(=O)NCc1cccnc1 AIFCHEM-6237937685 [0,0,0,0,0,1|3,0,0]=4 59 B13R1.42 COCC(=O)NCc1ccncc1 AIFCHEM-94574678558 [0,0,0,0,0,1|3,0,0]=4 60 B13R1.42 CSCC(=O)NCc1ccccn1 AIFCHEM-5770002698 [0,0,0,0,0,1|3,0,0]=4 61 B10R1.17 CCCNc1ccccc1 AIFCHEM-94552032560 [2,0,0,0,0,0|1,0,1]=4 62 B10R1.17 CCNCc1ccccn1 AIFCHEM-94537420895 [2,0,0,0,0,0|2,0,0]=4 63 B10R1.18 CC(=Cc1ccccc1)C AIFCHEM-6323250098 [2,0,0,0,0,0|1,0,1]=4 64 B10R1.18 CC(=O)Nc1ccncc1 AIFCHEM-94535587956 [2,0,0,0,0,0|2,0,0]=4 65 B12R1.28 CCCC=Cc1cccc(c1)F AIFCHEM-6382549502 [1,1,0,0,0,0|1,0,1]=4 66 B12R1.28 CCCNCc1cccc(c1)O AIFCHEM-94569022018 [1,1,0,0,0,0|2,0,0]=4 67 B12R1.28 CCOC=Cc1cc(ccn1)C AIFCHEM-6256482326 [1,1,0,0,0,0|1,0,1]=4 68 B12R1.28 CCOC=Cc1cc[nH]c(=O)c1 AIFCHEM-94580720950 [1,1,0,0,0,0|1,0,1]=4 69 B12R1.28 CCOC=Cc1cccc(c1)C AIFCHEM-6334722464 [1,1,0,0,0,0|0,0,1]=3 70 B12R1.28 CCOC=Cc1cncc(c1)F AIFCHEM-6287292515 [1,1,0,0,0,0|1,0,1]=4 71 B12R1.267 CCCNCc1ccccc1Cl AIFCHEM-94555005997 [1,1,0,0,0,0|2,0,0]=4 72 B12R1.267 CCCNCc1ccccc1O AIFCHEM-94592060285 [1,1,0,0,0,0|2,0,0]=4 73 B12R1.267 CCOC=Cc1ccc[nH]c1=O AIFCHEM-6368439997 [1,1,0,0,0,0|1,0,1]=4 74 B12R1.267 CCOC=Cc1ccccc1C AIFCHEM-94536265848 [1,1,0,0,0,0|0,0,1]=3 75 B12R1.267 CCOC=Cc1ccncc1F AIFCHEM-94580719021 [1,1,0,0,0,0|1,0,1]=4 76 B12R1.267 CCOC=Cc1cnccc1O AIFCHEM-94580726356 [1,1,0,0,0,0|1,0,1]=4 77 B12R1.267 CCOC=Cc1ncccc1O AIFCHEM-94580723888 [1,1,0,0,0,0|1,0,1]=4 78 B12R1.43 CC(C)C(=O)Nc1ccncc1 AIFCHEM-94545049393 [1,1,0,0,0,0|2,0,0]=4 79 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl AIFCHEM-94526499445 [1,1,0,0,0,0|1,0,0]=3 80 B12R1.49 CCC(=O)Nc1ccc(cn1)Br AIFCHEM-94526499500 [1,1,0,0,0,0|2,0,0]=4 81 B12R1.49 CCC(=O)Nc1ccc(cn1)O AIFCHEM-94526508419 [1,1,0,0,0,0|2,0,0]=4 82 B12R1.49 CCN(C)Cc1ccc(cc1)F AIFCHEM-94537421330 [1,1,0,0,0,0|2,0,0]=4 83 B12R1.49 CCN(C)Cc1ccc(cc1)I AIFCHEM-94563256363 [1,1,0,0,0,0|2,0,0]=4 84 B12R1.49 O=C(CO)Nc1ccc(cc1)I AIFCHEM-94532683447 [1,1,0,0,0,0|2,0,0]=4 85 B12R1.49 O=C(CO)Nc1ccc(cc1)O AIFCHEM-94532676141 [1,1,0,0,0,0|2,0,0]=4 86 B12R1.50 CCC(=O)Nc1cc(ccn1)I AIFCHEM-94526508375 [1,1,0,0,0,0|2,0,0]=4 87 B12R1.50 CCC(=O)Nc1cccc(c1)C AIFCHEM-94526499544 [1,1,0,0,0,0|1,0,0]=3 88 B12R1.50 CCC(=O)Nc1ccnc(c1)O AIFCHEM-94526506964 [1,1,0,0,0,0|2,0,0]=4 89 B12R1.50 CCC(=O)Nc1cncc(c1)C AIFCHEM-94526506478 [1,1,0,0,0,0|2,0,0]=4 90 B12R1.50 CCC(=O)Nc1cncc(c1)I AIFCHEM-94526505527 [1,1,0,0,0,0|2,0,0]=4 91 B12R1.50 CCN(C)Cc1cccc(c1)F AIFCHEM-94563258775 [1,1,0,0,0,0|2,0,0]=4 92 B12R1.50 CCN(C)Cc1cccc(c1)O AIFCHEM-94563254727 [1,1,0,0,0,0|2,0,0]=4 93 B12R1.371 CCC(=O)Nc1cccnc1C AIFCHEM-94526506476 [1,1,0,0,0,0|2,0,0]=4 94 B12R1.371 CCC(=O)Nc1ccncc1Br AIFCHEM-94526501822 [1,1,0,0,0,0|2,0,0]=4 95 B12R1.371 CCC(=O)Nc1ccncc1C AIFCHEM-94526504326 [1,1,0,0,0,0|2,0,0]=4 96 B12R1.371 CCC(=O)Nc1ncccc1C AIFCHEM-94526503053 [1,1,0,0,0,0|2,0,0]=4 97 B12R1.371 CCN(C)Cc1ccccc1O AIFCHEM-94563261019 [1,1,0,0,0,0|2,0,0]=4 98 B12R1.371 O=C(CO)Nc1ccccc1I AIFCHEM-94532684184 [1,1,0,0,0,0|2,0,0]=4 99 B12R1.53 CCCNC(=O)Cc1cccs1 AIFCHEM-5791342008 [0,1,0,0,1,0|2,0,0]=4 100 B12R1.53 O=C(Cc1ccc[nH]1)NCCF AIFCHEM-94593335629 [0,1,0,0,1,0|2,0,0]=4 101 B12R1.108 CCN(C)C(=O)Cc1ccco1 AIFCHEM-94563266169 [0,1,0,0,1,0|2,0,0]=4 102 B12R1.260 CC(C)NC(=O)Cc1ccc[nH]1 AIFCHEM-94520551225 [0,1,0,0,1,0|2,0,0]=4 103 B14R1.32 COCC(=O)NCc1cccc(c1)O AIFCHEM-6127546607 [0,1,0,0,0,1|2,0,0]=4 104 B14R1.156 C/C=C/CC(=O)NCc1ccccc1 AIFCHEM-5834514380 [0,1,0,0,0,1|1,0,1]=4 105 B14R1.156 CCCNC(=O)COc1ccccn1 AIFCHEM-5815026704 [0,1,0,0,0,1|2,0,0]=4 106 B14R1.156 CCCNC(=O)CSc1ccccc1 AIFCHEM-94521372545 [0,1,0,0,0,1|1,0,0]=3 107 B14R1.156 CCOCC(=O)NCc1ccncc1 AIFCHEM-5854853117 [0,1,0,0,0,1|1,0,0]=3 108 B14R1.156 CCSCC(=O)NCc1ccncc1 AIFCHEM-94580219634 [0,1,0,0,0,1|1,1,0]=4 109 B14R1.156 COCCC(=O)NCc1cccnc1 AIFCHEM-6213107461 [0,1,0,0,0,1|2,0,0]=4 110 B14R1.156 CSCCC(=O)NCc1ccccn1 AIFCHEM-5757251982 [0,1,0,0,0,1|2,0,0]=4 111 B14R1.156 O=C(COc1ccccn1)NCCF AIFCHEM-5871206848 [0,1,0,0,0,1|2,0,0]=4 112 B14R1.156 O=C(COc1ccncc1)NCCF AIFCHEM-5871364581 [0,1,0,0,0,1|2,0,0]=4 113 B14R1.502 CC#CC(=O)NCc1ccc(cc1)Br AIFCHEM-5677969542 [0,1,0,0,0,1|1,0,1]=4 114 B14R1.502 CC#CC(=O)NCc1ccc(cc1)Cl AIFCHEM-6052010686 [0,1,0,0,0,1|1,0,1]=4 115 B14R1.502 CC#CC(=O)NCc1ccc(cc1)F AIFCHEM-5805288003 [0,1,0,0,0,1|1,0,1]=4 116 B14R1.502 COCC(=O)NCc1ccc(cc1)Cl AIFCHEM-94554522635 [0,1,0,0,0,1|2,0,0]=4 117 B14R1.502 CSCC(=O)NCc1ccc(cc1)C AIFCHEM-94542350929 [0,1,0,0,0,1|2,0,0]=4 118 B14R1.502 CSCC(=O)NCc1ccc(cc1)F AIFCHEM-94530373886 [0,1,0,0,0,1|2,0,0]=4 119 B14R1.502 CSCC(=O)NCc1ccc(cc1)I AIFCHEM-6131561228 [0,1,0,0,0,1|2,0,0]=4 120 B14R1.502 O=C(CCO)NCc1ccc(cc1)F AIFCHEM-94530375859 [0,1,0,0,0,1|2,0,0]=4 121 B14R1.598 CC#CC(=O)NCc1ccccc1Cl AIFCHEM-94555022821 [0,1,0,0,0,1|1,0,1]=4 122 B14R1.598 CC#CC(=O)NCc1ccccc1F AIFCHEM-94520805111 [0,1,0,0,0,1|1,0,1]=4 123 B14R1.598 CC#CC(=O)NCc1ccccc1O AIFCHEM-94592073209 [0,1,0,0,0,1|1,0,1]=4 124 B14R1.598 COCC(=O)NCc1ccccc1O AIFCHEM-94592073446 [0,1,0,0,0,1|2,0,0]=4 125 B14R1.598 CSCC(=O)NCc1ccccc1F AIFCHEM-94520802424 [0,1,0,0,0,1|2,0,0]=4 126 B14R1.598 CSCC(=O)NCc1ccccc1I AIFCHEM-94574483416 [0,1,0,0,0,1|2,0,0]=4 127 B14R1.598 CSCC(=O)NCc1ccccc1O AIFCHEM-94592070522 [0,1,0,0,0,1|2,0,0]=4 128 B14R1.598 Cc1ccccc1CNC(=O)CCO AIFCHEM-6159109346 [0,1,0,0,0,1|2,0,0]=4 129 B14R1.598 O=C(CCO)NCc1ccccc1O AIFCHEM-94592072495 [0,1,0,0,0,1|2,0,0]=4 130 B14R1.756 CCC(C)C(=O)NCc1cccnc1 AIFCHEM-6213184276 [0,1,0,0,0,1|2,0,0]=4 131 B14R1.756 CCN(C)C(=O)C#Cc1ccccc1 AIFCHEM-94563268852 [0,1,0,0,0,1|1,0,1]=4 132 B14R1.756 CCN(C)C(=O)COc1cccnc1 AIFCHEM-94563270058 [0,1,0,0,0,1|2,0,0]=4 133 B14R1.756 CC[C@@H](C)C(=O)NCc1cccnc1 AIFCHEM-6263710997 [0,1,0,0,0,1|2,0,0]=4 134 B14R1.756 CC[C@H](C)C(=O)NCc1cccnc1 AIFCHEM-6277259016 [0,1,0,0,0,1|2,0,0]=4 135 B14R1.818 CC(C)CC(=O)NCc1cccnc1 AIFCHEM-6239813416 [0,1,0,0,0,1|2,0,0]=4 136 B14R1.818 CC(C)NC(=O)C#Cc1ccccc1 AIFCHEM-94520550380 [0,1,0,0,0,1|1,0,1]=4 137 B14R1.818 CC(C)NC(=O)CSc1ccncc1 AIFCHEM-94591216978 [0,1,0,0,0,1|2,0,0]=4 138 B14R1.818 CC(O)CC(=O)NCc1ccccc1 AIFCHEM-94554639641 [0,1,0,0,0,1|1,0,0]=3 139 B14R1.818 C[C@@H](O)CC(=O)NCc1ccccc1 AIFCHEM-94539158680 [0,1,0,0,0,1|1,0,0]=3 140 B14R1.818 C[C@H](O)CC(=O)NCc1ccccc1 AIFCHEM-94539158619 [0,1,0,0,0,1|1,0,0]=3 141 B14R1.818 O=C(CC(F)F)NCc1ccccc1 AIFCHEM-5794680680 [0,1,0,0,0,1|2,0,0]=4 142 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)I AIFCHEM-6220999204 [0,2,0,0,0,0|1,0,1]=4 143 B14R1.33 CCC#CC(=O)Nc1ccc(cc1)Cl AIFCHEM-5990437984 [0,2,0,0,0,0|2,0,0]=4 144 B14R1.33 CCCCC(=O)Nc1ccc(cc1)Br AIFCHEM-94608720893 [0,2,0,0,0,0|2,0,0]=4 145 B14R1.33 CCCCC(=O)Nc1ccc(cc1)I AIFCHEM-94534108884 [0,2,0,0,0,0|2,0,0]=4 146 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Br AIFCHEM-94521375627 [0,2,0,0,0,0|1,0,0]=3 147 B14R1.33 CCCNC(=O)Cc1ccc(cc1)C AIFCHEM-94521379642 [0,2,0,0,0,0|1,0,0]=3 148 B14R1.33 CCCNC(=O)Cc1ccc(cc1)O AIFCHEM-94521374824 [0,2,0,0,0,0|1,0,0]=3 149 B14R1.33 CCCNC(=O)Cc1ccc(nc1)Cl AIFCHEM-94521378090 [0,2,0,0,0,0|2,0,0]=4 150 B14R1.33 CCOCC(=O)Nc1ccc(=O)[nH]c1 AIFCHEM-5999762998 [0,2,0,0,0,0|2,0,0]=4 151 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Br AIFCHEM-94580209754 [0,2,0,0,0,0|1,1,0]=4 152 B14R1.33 CCSCC(=O)Nc1ccc(cc1)F AIFCHEM-94580217129 [0,2,0,0,0,0|1,1,0]=4 153 B14R1.33 COCCC(=O)Nc1ccc(cc1)Br AIFCHEM-94608724963 [0,2,0,0,0,0|2,0,0]=4 154 B14R1.33 COCCC(=O)Nc1ccc(cc1)C AIFCHEM-94584235681 [0,2,0,0,0,0|2,0,0]=4 155 B14R1.33 COCCC(=O)Nc1ccc(cc1)F AIFCHEM-94552026651 [0,2,0,0,0,0|2,0,0]=4 156 B14R1.33 CSCCC(=O)Nc1ccc(cc1)F AIFCHEM-94552029593 [0,2,0,0,0,0|2,0,0]=4 157 B14R1.33 O=C(Cc1ccc(cn1)Cl)NCCF AIFCHEM-5801827820 [0,2,0,0,0,0|2,0,0]=4 158 B14R1.134 CCC(C)C(=O)Nc1ccc(cc1)F AIFCHEM-94540067837 [0,2,0,0,0,0|2,0,0]=4 159 B14R1.134 CCC(C)C(=O)Nc1ccc(cc1)O AIFCHEM-94574883980 [0,2,0,0,0,0|2,0,0]=4 160 B14R1.134 CCN(C)C(=O)Cc1ccc(cc1)I AIFCHEM-94563264498 [0,2,0,0,0,0|1,0,0]=3 161 B14R1.134 CCN(C)C(=O)Cc1ccc(cn1)C AIFCHEM-94563262385 [0,2,0,0,0,0|2,0,0]=4 162 B14R1.134 CC[C@@H](C)C(=O)Nc1ccc(cc1)F AIFCHEM-94540072237 [0,2,0,0,0,0|2,0,0]=4 163 B14R1.134 CC[C@@H](C)C(=O)Nc1ccc(cc1)O AIFCHEM-94596163516 [0,2,0,0,0,0|2,0,0]=4 164 B14R1.134 CC[C@H](C)C(=O)Nc1ccc(cc1)F AIFCHEM-5952947106 [0,2,0,0,0,0|2,0,0]=4 165 B14R1.134 CC[C@H](C)C(=O)Nc1ccc(cc1)O AIFCHEM-94574886169 [0,2,0,0,0,0|2,0,0]=4 166 B14R1.698 CC(C)NC(=O)Cc1ccc(cc1)F AIFCHEM-94520548779 [0,2,0,0,0,0|1,0,0]=3 167 B14R1.698 CC(C)NC(=O)Cc1ccc(cc1)O AIFCHEM-94520545439 [0,2,0,0,0,0|1,0,0]=3 168 B14R1.698 CC(C)NC(=O)Cc1ccc(cn1)Cl AIFCHEM-94520542951 [0,2,0,0,0,0|2,0,0]=4 169 B14R1.698 CC(C)NC(=O)Cn1ccc(=O)cc1 AIFCHEM-94520549058 [0,2,0,0,0,0|2,0,0]=4 170 B14R1.698 Cc1ccc(cc1)CC(=O)NC(C)C AIFCHEM-94520550257 [0,2,0,0,0,0|1,0,0]=3 171 B14R1.34 C#CCNC(=O)Cc1cccc(c1)Br AIFCHEM-94588316219 [0,2,0,0,0,0|1,0,1]=4 172 B14R1.34 C#CCNC(=O)Cc1cccc(c1)F AIFCHEM-94588318137 [0,2,0,0,0,0|1,0,1]=4 173 B14R1.34 CCCNC(=O)Cc1cccc(n1)Cl AIFCHEM-94521381156 [0,2,0,0,0,0|2,0,0]=4 174 B14R1.34 CCOCC(=O)Nc1cc(ccn1)Cl AIFCHEM-5905705750 [0,2,0,0,0,0|2,0,0]=4 175 B14R1.34 CCOCC(=O)Nc1cccc(c1)O AIFCHEM-94552460189 [0,2,0,0,0,0|1,0,0]=3 176 B14R1.34 CCOCC(=O)Nc1cccc(n1)O AIFCHEM-94555801401 [0,2,0,0,0,0|2,0,0]=4 177 B14R1.34 CCOCC(=O)Nc1ccnc(c1)O AIFCHEM-94552273035 [0,2,0,0,0,0|2,0,0]=4 178 B14R1.34 CCSCC(=O)Nc1cccc(c1)Br AIFCHEM-94580219059 [0,2,0,0,0,0|1,1,0]=4 179 B14R1.34 COCCC(=O)Nc1cccc(c1)F AIFCHEM-94579359770 [0,2,0,0,0,0|2,0,0]=4 180 B14R1.34 COCCC(=O)Nc1cccc(c1)O AIFCHEM-94552457389 [0,2,0,0,0,0|2,0,0]=4 181 B14R1.34 CSCCC(=O)Nc1cccc(c1)Cl AIFCHEM-94523501307 [0,2,0,0,0,0|2,0,0]=4 182 B14R1.34 CSCCC(=O)Nc1cccc(c1)I AIFCHEM-5650934977 [0,2,0,0,0,0|2,0,0]=4 183 B14R1.135 CCC(O)C(=O)Nc1cccc(c1)Cl AIFCHEM-94523500978 [0,2,0,0,0,0|2,0,0]=4 184 B14R1.135 CCC(O)C(=O)Nc1cccc(c1)F AIFCHEM-94579362383 [0,2,0,0,0,0|2,0,0]=4 185 B14R1.135 CCN(C)C(=O)Cc1cccc(c1)Cl AIFCHEM-94563264711 [0,2,0,0,0,0|1,0,0]=3 186 B14R1.135 CC[C@@H](O)C(=O)Nc1cccc(c1)Cl AIFCHEM-94552611520 [0,2,0,0,0,0|2,0,0]=4 187 B14R1.135 CC[C@@H](O)C(=O)Nc1cccc(c1)F AIFCHEM-94579358827 [0,2,0,0,0,0|2,0,0]=4 188 B14R1.135 CC[C@H](O)C(=O)Nc1cccc(c1)Cl AIFCHEM-94523499100 [0,2,0,0,0,0|2,0,0]=4 189 B14R1.135 CC[C@H](O)C(=O)Nc1cccc(c1)F AIFCHEM-94579360505 [0,2,0,0,0,0|2,0,0]=4 190 B14R1.5978 CC(C)CC(=O)Nc1cccc(c1)O AIFCHEM-94542290054 [0,2,0,0,0,0|2,0,0]=4 191 B14R1.5978 CC(C)NC(=O)Cc1cccc(c1)Br AIFCHEM-94520546241 [0,2,0,0,0,0|1,0,0]=3 192 B14R1.5978 CC(C)NC(=O)Cc1ccnc(c1)Cl AIFCHEM-94520551855 [0,2,0,0,0,0|2,0,0]=4 193 B14R1.5978 CC(O)CC(=O)Nc1cccc(c1)F AIFCHEM-94579360197 [0,2,0,0,0,0|2,0,0]=4 194 B14R1.5978 C[C@@H](O)CC(=O)Nc1cccc(c1)F AIFCHEM-94579362559 [0,2,0,0,0,0|2,0,0]=4 195 B14R1.5978 C[C@H](O)CC(=O)Nc1cccc(c1)F AIFCHEM-94579362498 [0,2,0,0,0,0|2,0,0]=4 196 B14R1.5978 Cc1cccc(c1)NC(=O)CC(C)O AIFCHEM-94565754498 [0,2,0,0,0,0|2,0,0]=4 197 B14R1.5978 Cc1cccc(c1)NC(=O)C[C@@H](C)O AIFCHEM-94565756860 [0,2,0,0,0,0|2,0,0]=4 198 B14R1.5978 Cc1cccc(c1)NC(=O)C[C@H](C)O AIFCHEM-94565756799 [0,2,0,0,0,0|2,0,0]=4 199 B14R1.158 COCCNC(=O)Cc1ccncc1 AIFCHEM-94603098759 [0,2,0,0,0,0|2,0,0]=4 200 B14R1.158 CSCCNC(=O)Cc1cccnc1 AIFCHEM-94598931452 [0,2,0,0,0,0|2,0,0]=4 201 B14R1.158 N#CCCCC(=O)Nc1ccccc1 AIFCHEM-94552044110 [0,2,0,0,0,0|2,0,0]=4 202 B14R1.166 CCCCC(=O)N(C)c1ccccc1 AIFCHEM-94534075227 [0,2,0,0,0,0|2,0,0]=4 203 B14R1.166 CCCNC(=O)C(O)c1ccccc1 AIFCHEM-5875709630 [0,2,0,0,0,0|1,0,0]=3 204 B14R1.166 CCCNC(=O)[C@@H](O)c1ccccc1 AIFCHEM-94521375229 [0,2,0,0,0,0|1,0,0]=3 205 B14R1.166 CCCNC(=O)[C@H](O)c1ccccc1 AIFCHEM-94521379556 [0,2,0,0,0,0|1,0,0]=3 206 B14R1.166 COCCC(=O)N(C)c1ccccc1 AIFCHEM-94545186435 [0,2,0,0,0,0|2,0,0]=4 207 B14R1.166 CSCCC(=O)N(C)c1ccccc1 AIFCHEM-94545189377 [0,2,0,0,0,0|2,0,0]=4 208 B14R1.423 CC(C)CCC(=O)Nc1ccccc1 AIFCHEM-94552045876 [0,2,0,0,0,0|2,0,0]=4 209 B14R1.423 CC(C)CNC(=O)Cc1ccccn1 AIFCHEM-94576235871 [0,2,0,0,0,0|2,0,0]=4 210 B14R1.423 O=C(Cc1ccccn1)NCC(F)F AIFCHEM-94576238556 [0,2,0,0,0,0|2,0,0]=4 211 B14R1.743 C#CC(C)NC(=O)Cc1ccncc1 AIFCHEM-5770178074 [0,2,0,0,0,0|2,0,0]=4 212 B14R1.743 C#C[C@H](C)NC(=O)Cc1ccncc1 AIFCHEM-94603101427 [0,2,0,0,0,0|2,0,0]=4 213 B14R1.743 CC(CF)NC(=O)Cc1cccnc1 AIFCHEM-6129471111 [0,2,0,0,0,0|2,0,0]=4 214 B14R1.743 C[C@@H](CF)NC(=O)Cc1cccnc1 AIFCHEM-94529325677 [0,2,0,0,0,0|2,0,0]=4 215 B14R1.743 C[C@H](CF)NC(=O)Cc1cccnc1 AIFCHEM-6111679756 [0,2,0,0,0,0|2,0,0]=4 216 B14R1.946 C#CCNC(=O)Cc1ccccc1Cl AIFCHEM-6196139340 [0,2,0,0,0,0|1,0,1]=4 217 B14R1.946 CCC#CC(=O)Nc1ccccc1Br AIFCHEM-94569947622 [0,2,0,0,0,0|2,0,0]=4 218 B14R1.946 CCCCC(=O)Nc1ccccc1O AIFCHEM-94534110253 [0,2,0,0,0,0|2,0,0]=4 219 B14R1.946 CCCNC(=O)Cc1ccccc1Br AIFCHEM-94521375596 [0,2,0,0,0,0|1,0,0]=3 220 B14R1.946 CCCNC(=O)Cc1ccccc1I AIFCHEM-94521375595 [0,2,0,0,0,0|1,0,0]=3 221 B14R1.946 CCCNC(=O)Cn1ccccc1=O AIFCHEM-5815202370 [0,2,0,0,0,0|2,0,0]=4 222 B14R1.946 CCOCC(=O)Nc1ccc[nH]c1=O AIFCHEM-94549278063 [0,2,0,0,0,0|2,0,0]=4 223 B14R1.946 CCOCC(=O)Nc1ccncc1I AIFCHEM-5797273563 [0,2,0,0,0,0|2,0,0]=4 224 B14R1.946 CCSCC(=O)Nc1ccccc1O AIFCHEM-94525234348 [0,2,0,0,0,0|1,1,0]=4 225 B14R1.946 COCCC(=O)Nc1ccccc1C AIFCHEM-94578152843 [0,2,0,0,0,0|2,0,0]=4 226 B14R1.946 CSCCC(=O)Nc1ccccc1C AIFCHEM-5920745122 [0,2,0,0,0,0|2,0,0]=4 227 B14R1.946 O=C(Cc1ccccc1O)NCCF AIFCHEM-5802585226 [0,2,0,0,0,0|1,0,0]=3 228 B14R1.946 O=C(Cc1ncccc1Br)NCCF AIFCHEM-5802211296 [0,2,0,0,0,0|2,0,0]=4 229 B14R1.85 CCN(C)C(=O)C(O)c1ccccc1 AIFCHEM-6099672372 [0,2,0,0,0,0|1,0,0]=3 230 B14R1.85 CCN(C)C(=O)[C@@H](O)c1ccccc1 AIFCHEM-94563264316 [0,2,0,0,0,0|1,0,0]=3 231 B14R1.85 CCN(C)C(=O)[C@H](O)c1ccccc1 AIFCHEM-94563268643 [0,2,0,0,0,0|1,0,0]=3 232 B14R1.425 CC(C)N(C)C(=O)Cc1ccncc1 AIFCHEM-94547946722 [0,2,0,0,0,0|2,0,0]=4 233 B14R1.1007 CCC(O)C(=O)Nc1ccccc1O AIFCHEM-94525234160 [0,2,0,0,0,0|2,0,0]=4 234 B14R1.1007 CCN(C)C(=O)Cc1cccnc1Cl AIFCHEM-6099678393 [0,2,0,0,0,0|2,0,0]=4 235 B14R1.1007 CC[C@@H](O)C(=O)Nc1ccccc1O AIFCHEM-94521343361 [0,2,0,0,0,0|2,0,0]=4 236 B14R1.1007 CC[C@H](O)C(=O)Nc1ccccc1O AIFCHEM-94591828659 [0,2,0,0,0,0|2,0,0]=4 237 B14R1.337 CC(C)NC(=O)Cc1cccnc1Cl AIFCHEM-94520550204 [0,2,0,0,0,0|2,0,0]=4 238 B14R1.337 CC(C)NC(=O)Cc1ncccc1Br AIFCHEM-94520550716 [0,2,0,0,0,0|2,0,0]=4 239 B14R1.337 CC(C)NC(=O)Cc1ncccc1Cl AIFCHEM-94520551768 [0,2,0,0,0,0|2,0,0]=4 240 B14R1.337 Cc1ccccc1CC(=O)NC(C)C AIFCHEM-94520550415 [0,2,0,0,0,0|1,0,0]=3 241 B14R1.337 Cc1ccccc1NC(=O)CC(C)C AIFCHEM-5892461333 [0,2,0,0,0,0|2,0,0]=4 242 B14R1.433 CC(C)(Cl)CC(=O)Nc1ccccc1 AIFCHEM-94604515586 [0,2,0,0,0,0|2,0,0]=4 243 B12R2.2 C1=C(CCC1)c2ccccc2 AIFCHEM-94590916958 [1,0,0,1,0,0|1,0,1]=4 244 B12R2.2058 C(=C1CCC1)c2ccccc2 AIFCHEM-6322825111 [1,0,0,1,0,0|1,0,1]=4 245 B14R2.21 O=C1C=C(CCC1)c2ccccc2 AIFCHEM-94590915155 [0,0,0,1,0,1|1,0,1]=4 246 B14R2.949 O=C(Nc1ccc(cc1)Br)C2CC2 AIFCHEM-94608723418 [0,1,0,1,0,0|2,0,0]=4 247 B14R2.9059 O=C(Nc1cccc(c1)I)C2CC2 AIFCHEM-5676085861 [0,1,0,1,0,0|2,0,0]=4 248 B14R2.9059 O=C(Nc1cccc(c1)O)C2CC2 AIFCHEM-94542286671 [0,1,0,1,0,0|2,0,0]=4 249 B14R2.343 CC1CC1C(=O)Nc2ccccc2 AIFCHEM-94577033582 [0,1,0,1,0,0|2,0,0]=4 250 B14R2.343 C[C@@H]1C[C@H]1C(=O)Nc2ccccc2 AIFCHEM-94552045696 [0,1,0,1,0,0|2,0,0]=4 251 B14R2.343 C[C@H]1C[C@@H]1C(=O)Nc2ccccc2 AIFCHEM-94577030883 [0,1,0,1,0,0|2,0,0]=4 252 B14R2.9589 O=C(Cc1cccnc1)N2CCC2 AIFCHEM-6079217797 [0,1,0,1,0,0|2,0,0]=4 253 B14R2.15694 CN(C(=O)C1CC1)c2ccccc2 AIFCHEM-94545184890 [0,1,0,1,0,0|2,0,0]=4 254 B14R2.9592 CC1(CC1)C(=O)Nc2ccccc2 AIFCHEM-94552046122 [0,1,0,1,0,0|2,0,0]=4 255 B14R2.4621 O=C(Nc1ccccc1Br)C2CC2 AIFCHEM-5613656789 [0,1,0,1,0,0|2,0,0]=4 256 B10R1.21 CCOC=Cc1cccs1 AIFCHEM-6452818854 [1,0,0,0,1,0|1,0,1]=4 257 B10R1.21 CCOC=Cc1ccoc1 AIFCHEM-6193370521 [1,0,0,0,1,0|1,0,1]=4 258 B14R1.520 CCOC(=O)CNCc1ccncn1 AIFCHEM-5643676024 [0,0,0,0,0,2|2,0,0]=4 259 B14R1.520 CCOC(=O)CNCc1cnccn1 AIFCHEM-5593319234 [0,0,0,0,0,2|2,0,0]=4 260 B14R1.520 CCOC(=O)CNCc1ncccn1 AIFCHEM-5593123893 [0,0,0,0,0,2|2,0,0]=4