0 B23R2.66077 COc1cc(ccc1c2ccco2)CC(=O)NC(C)C(C)C AIFCHEM-82181858031 [0,0,0,0,0,0|4,0,0]=4 1 B23R2.66077 COc1cc(ccc1c2cncs2)NC(=O)CC(C)C(=O)C AIFCHEM-41350821965 [0,0,0,0,0,0|2,1,1]=4 2 B22R2.54635 CCc1cc(ccc1c2ccoc2)NC(=O)CCC(C)C AIFCHEM-45632008931 [1,0,0,0,0,0|3,0,0]=4 3 B22R2.54635 COc1cc(ccc1C2=CCCC2)NC(=O)CCC(C)C AIFCHEM-45636649639 [1,0,0,0,0,0|2,0,1]=4 4 B22R2.54635 COc1cc(ccc1C2=COCC2)NC(=O)CCC(C)C AIFCHEM-45632730006 [1,0,0,0,0,0|2,0,1]=4 5 B22R2.54635 COc1cc(ccc1c2cc[nH]n2)NC(=O)CCC(C)C AIFCHEM-94779407104 [1,0,0,0,0,0|2,0,1]=4 6 B22R2.54635 COc1cc(ccc1c2ccco2)CC(=O)NCC(C)C AIFCHEM-82181878105 [1,0,0,0,0,0|3,0,0]=4 7 B22R2.54635 COc1cc(ccc1c2ccns2)NC(=O)CCC(C)C AIFCHEM-45636693881 [1,0,0,0,0,0|2,0,0]=3 8 B22R2.54635 COc1cc(ccc1c2ccns2)NC(=O)COC(C)C AIFCHEM-46355411781 [1,0,0,0,0,0|3,0,0]=4 9 B22R2.54635 COc1cc(ccc1c2ccns2)NC(=O)CSC(C)C AIFCHEM-38543788361 [1,0,0,0,0,0|3,0,0]=4 10 B22R2.54635 COc1cc(ccc1c2ccon2)NC(=O)CCC(C)C AIFCHEM-45636785068 [1,0,0,0,0,0|3,0,0]=4 11 B22R2.54635 COc1cc(ccc1c2ccsn2)NC(=O)CCC(C)C AIFCHEM-45636625244 [1,0,0,0,0,0|3,0,0]=4 12 B22R2.54635 COc1cc(ccc1c2cn[nH]c2)NC(=O)COC(C)C AIFCHEM-46355410697 [1,0,0,0,0,0|3,0,0]=4 13 B22R2.54635 COc1cc(ccc1c2cn[nH]c2)NC(=O)CSC(C)C AIFCHEM-38543787277 [1,0,0,0,0,0|3,0,0]=4 14 B22R2.54635 COc1cc(ccc1c2cnco2)NC(=O)CCC(F)F AIFCHEM-5741149636 [1,0,0,0,0,0|2,0,0]=3 15 B22R2.54635 COc1cc(ccc1c2cnco2)NC(=O)COC(=O)C AIFCHEM-5718938071 [1,0,0,0,0,0|2,0,1]=4 16 B22R2.54635 COc1cc(ccc1c2cnco2)NC(=O)COC(F)F AIFCHEM-5718797246 [1,0,0,0,0,0|3,0,0]=4 17 B22R2.54635 COc1cc(ccc1c2cncs2)NC(=O)CCC(F)F AIFCHEM-43572625851 [1,0,0,0,0,0|2,1,0]=4 18 B22R2.54635 COc1cc(ccc1c2cncs2)NC(=O)COC(C)C AIFCHEM-46350777615 [1,0,0,0,0,0|1,1,0]=3 19 B22R2.54635 COc1cc(ccc1c2cncs2)NC(=O)CSC(C)C AIFCHEM-38539590555 [1,0,0,0,0,0|1,1,0]=3 20 B22R2.54635 COc1cc(ccc1c2cnsc2)NC(=O)CCC(C)C AIFCHEM-45632217646 [1,0,0,0,0,0|2,0,0]=3 21 B22R2.54635 COc1cc(ccc1c2cnsc2)NC(=O)COC(C)C AIFCHEM-46350904126 [1,0,0,0,0,0|3,0,0]=4 22 B22R2.54635 COc1cc(ccc1c2cnsc2)NC(=O)CSC(C)C AIFCHEM-38539725486 [1,0,0,0,0,0|3,0,0]=4 23 B22R2.54635 COc1cc(ccc1c2cscn2)NC(=O)CCC(C)C AIFCHEM-90068896402 [1,0,0,0,0,0|2,0,0]=3 24 B22R2.54635 COc1cc(ccc1c2cscn2)NC(=O)COC(C)C AIFCHEM-92131982810 [1,0,0,0,0,0|3,0,0]=4 25 B22R2.54635 COc1cc(ccc1c2cscn2)NC(=O)CSC(C)C AIFCHEM-86212995977 [1,0,0,0,0,0|3,0,0]=4 26 B22R2.54635 COc1cc(ccc1c2nccs2)NC(=O)CCC(C)C AIFCHEM-45633055015 [1,0,0,0,0,0|2,1,0]=4 27 B22R2.54635 COc1cc(ccc1c2ncn[nH]2)NC(=O)CCC(C)C AIFCHEM-90069377491 [1,0,0,0,0,0|2,0,0]=3 28 B22R2.54635 COc1cc(ccc1c2ncn[nH]2)NC(=O)COC(C)C AIFCHEM-92132584819 [1,0,0,0,0,0|3,0,0]=4 29 B22R2.54635 COc1cc(ccc1c2ncn[nH]2)NC(=O)CSC(C)C AIFCHEM-86213231346 [1,0,0,0,0,0|3,0,0]=4 30 B22R2.54635 COc1cc(ccc1c2ncns2)NC(=O)CCC(C)C AIFCHEM-45632800227 [1,0,0,0,0,0|2,0,0]=3 31 B22R2.54635 COc1cc(ccc1c2ncns2)NC(=O)COC(C)C AIFCHEM-46351124707 [1,0,0,0,0,0|3,0,0]=4 32 B22R2.54635 COc1cc(ccc1c2ncns2)NC(=O)CSC(C)C AIFCHEM-38540120227 [1,0,0,0,0,0|3,0,0]=4 33 B22R2.54635 COc1cc(ccc1c2nncs2)NC(=O)CCC(C)C AIFCHEM-90088320486 [1,0,0,0,0,0|1,1,0]=3 34 B22R2.54635 COc1cc(ccc1c2nncs2)NC(=O)COC(C)C AIFCHEM-92151111663 [1,0,0,0,0,0|2,1,0]=4 35 B22R2.54635 COc1cc(ccc1c2nncs2)NC(=O)CSC(C)C AIFCHEM-86228956510 [1,0,0,0,0,0|2,1,0]=4 36 B22R2.54693 CCC(C)CC(=O)Nc1ccc(c(c1)OC)c2ccns2 AIFCHEM-41000855119 [1,0,0,0,0,0|3,0,0]=4 37 B22R2.54693 CCC(C)CC(=O)Nc1ccc(c(c1)OC)c2cnsc2 AIFCHEM-40998783824 [1,0,0,0,0,0|3,0,0]=4 38 B22R2.54693 CCC(C)CC(=O)Nc1ccc(c(c1)OC)c2cscn2 AIFCHEM-79483460853 [1,0,0,0,0,0|3,0,0]=4 39 B22R2.54693 CCC(C)CC(=O)Nc1ccc(c(c1)OC)c2ncn[nH]2 AIFCHEM-79483666582 [1,0,0,0,0,0|3,0,0]=4 40 B22R2.54693 CCC(C)CC(=O)Nc1ccc(c(c1)OC)c2ncns2 AIFCHEM-40999004405 [1,0,0,0,0,0|3,0,0]=4 41 B22R2.54693 CCC(C)CC(=O)Nc1ccc(c(c1)OC)c2nncs2 AIFCHEM-79490481806 [1,0,0,0,0,0|2,1,0]=4 42 B22R2.54693 CC[C@H](C)CC(=O)Nc1ccc(c(c1)OC)c2ccns2 AIFCHEM-41216681216 [1,0,0,0,0,0|3,0,0]=4 43 B22R2.54693 CC[C@H](C)CC(=O)Nc1ccc(c(c1)OC)c2cncs2 AIFCHEM-41213483410 [1,0,0,0,0,0|1,1,0]=3 44 B22R2.54693 CC[C@H](C)CC(=O)Nc1ccc(c(c1)OC)c2cnsc2 AIFCHEM-41213609921 [1,0,0,0,0,0|3,0,0]=4 45 B22R2.54693 CC[C@H](C)CC(=O)Nc1ccc(c(c1)OC)c2cscn2 AIFCHEM-91615979410 [1,0,0,0,0,0|3,0,0]=4 46 B22R2.54693 CC[C@H](C)CC(=O)Nc1ccc(c(c1)OC)c2ncn[nH]2 AIFCHEM-91616544159 [1,0,0,0,0,0|3,0,0]=4 47 B22R2.54693 CC[C@H](C)CC(=O)Nc1ccc(c(c1)OC)c2ncns2 AIFCHEM-41213841042 [1,0,0,0,0,0|3,0,0]=4 48 B22R2.54693 CC[C@H](C)CC(=O)Nc1ccc(c(c1)OC)c2nncs2 AIFCHEM-91635829643 [1,0,0,0,0,0|2,1,0]=4 49 B22R2.54693 COC(=O)CC(=O)Nc1ccc(c(c1)OC)c2cnco2 AIFCHEM-94549709106 [1,0,0,0,0,0|2,0,1]=4 50 B24R2.3961909 COc1cc(ccc1c2cnco2)NC(=O)CC(O)C(F)(F)F AIFCHEM-94599093117 [0,1,0,0,0,0|3,0,0]=4 51 B24R2.3961909 COc1cc(ccc1c2cnco2)NC(=O)C[C@@H](O)C(F)(F)F AIFCHEM-94542832012 [0,1,0,0,0,0|3,0,0]=4 52 B22R2.54611 COc1cc(ccc1c2ccco2)C(=O)NC(C)C(C)C AIFCHEM-93954415909 [0,0,0,0,1,0|3,0,0]=4 53 B22R2.54611 COc1cc(ccc1c2cncs2)C(=O)NC(C)C(C)C AIFCHEM-38108056365 [0,0,0,0,1,0|2,1,0]=4 54 B22R2.54686 COc1cc(ccc1c2ccns2)NC(=O)C(C)C(C)C AIFCHEM-46445860884 [0,0,0,0,1,0|3,0,0]=4 55 B22R2.54686 COc1cc(ccc1c2cncs2)NC(=O)C(C)C(C)C AIFCHEM-46443131678 [0,0,0,0,1,0|1,1,0]=3 56 B22R2.54686 COc1cc(ccc1c2cnsc2)NC(=O)C(C)C(C)C AIFCHEM-46443349029 [0,0,0,0,1,0|3,0,0]=4 57 B22R2.54686 COc1cc(ccc1c2cscn2)NC(=O)C(C)C(C)C AIFCHEM-87854124214 [0,0,0,0,1,0|3,0,0]=4 58 B22R2.54686 COc1cc(ccc1c2cscn2)NC(=O)[C@H](O)C(C)C AIFCHEM-84245656954 [0,0,0,0,1,0|3,0,0]=4 59 B22R2.54686 COc1cc(ccc1c2ncns2)NC(=O)C(C)C(C)C AIFCHEM-46443633070 [0,0,0,0,1,0|3,0,0]=4 60 B22R2.54686 COc1cc(ccc1c2nncs2)NC(=O)C(C)C(C)C AIFCHEM-87869062027 [0,0,0,0,1,0|2,1,0]=4 61 B24R2.3961294 COc1cc(ccc1c2cnco2)NC(C)CC(C)CC(C)C AIFCHEM-94554617951 [0,0,0,0,0,1|2,0,1]=4 62 B24R2.3961295 COc1cc(ccc1c2cncs2)NC(=O)CNC(=O)C(C)C AIFCHEM-41936630851 [0,0,0,0,0,1|1,1,1]=4 63 B21R2.39120 C#CCCC(=O)Nc1ccc(c(c1)OC)c2cnco2 AIFCHEM-5757834340 [2,0,0,0,0,0|0,0,2]=4 64 B21R2.39120 CCCCC(=O)Nc1ccc(c(c1)CC)c2ccco2 AIFCHEM-95434896596 [2,0,0,0,0,0|2,0,0]=4 65 B21R2.39120 CCCCC(=O)Nc1ccc(c(c1)OC)c2cc[nH]c2 AIFCHEM-95288081728 [2,0,0,0,0,0|1,0,1]=4 66 B21R2.39120 CCCCC(=O)Nc1ccc(c(c1)OC)c2ccco2 AIFCHEM-98043485995 [2,0,0,0,0,0|1,0,0]=3 67 B21R2.39120 CCCCC(=O)Nc1ccc(c(c1)OC)c2ccoc2 AIFCHEM-99700686315 [2,0,0,0,0,0|2,0,0]=4 68 B21R2.39120 CCCCC(=O)Nc1ccc(c(c1)OC)c2ccsc2 AIFCHEM-95095166427 [2,0,0,0,0,0|2,0,0]=4 69 B21R2.39120 CCCCC(=O)Nc1ccc(c(c1)OC)c2cn[nH]c2 AIFCHEM-97715467565 [2,0,0,0,0,0|2,0,0]=4 70 B21R2.39120 CCCCC(=O)Nc1ccc(c(c1)OC)c2cnoc2 AIFCHEM-97448035421 [2,0,0,0,0,0|2,0,0]=4 71 B21R2.39120 CCCCC(=O)Nc1ccc(c(c1)OC)c2cscn2 AIFCHEM-79420777078 [2,0,0,0,0,0|2,0,0]=4 72 B21R2.39120 CCCCC(=O)Nc1ccc(c(c1)OC)c2ncn[nH]2 AIFCHEM-79421109587 [2,0,0,0,0,0|2,0,0]=4 73 B21R2.39120 CCCCC(=O)Nc1ccc(c(c1)OC)c2nncs2 AIFCHEM-79432381291 [2,0,0,0,0,0|1,1,0]=4 74 B21R2.39120 COCCC(=O)Nc1ccc(c(c1)OC)c2cncs2 AIFCHEM-39156358381 [2,0,0,0,0,0|1,1,0]=4 75 B21R2.39120 COc1cc(ccc1c2cncs2)NC(=O)CCSC AIFCHEM-39220892095 [2,0,0,0,0,0|1,1,0]=4 76 B21R2.93311 Cc1cc(ccc1c2cc[nH]c2)NC(=O)CCC(C)C AIFCHEM-95288083950 [2,0,0,0,0,0|1,0,1]=4 77 B21R2.93311 Cc1cc(ccc1c2ccco2)NC(=O)COC(C)C AIFCHEM-95434895311 [2,0,0,0,0,0|2,0,0]=4 78 B21R2.93311 Cc1cc(ccc1c2ccns2)NC(=O)CCC(C)C AIFCHEM-45632723776 [2,0,0,0,0,0|2,0,0]=4 79 B21R2.93311 Cc1cc(ccc1c2ccoc2)NC(=O)CCC(C)C AIFCHEM-99700687737 [2,0,0,0,0,0|2,0,0]=4 80 B21R2.93311 Cc1cc(ccc1c2cn[nH]c2)NC(=O)CCC(C)C AIFCHEM-97715468327 [2,0,0,0,0,0|2,0,0]=4 81 B21R2.93311 Cc1cc(ccc1c2cncs2)NC(=O)COC(C)C AIFCHEM-46355141168 [2,0,0,0,0,0|1,1,0]=4 82 B21R2.93311 Cc1cc(ccc1c2cncs2)NC(=O)CSC(C)C AIFCHEM-10216439033 [2,0,0,0,0,0|1,1,0]=4 83 B21R2.93311 Cc1cc(ccc1c2cnoc2)NC(=O)CCC(C)C AIFCHEM-97448036183 [2,0,0,0,0,0|2,0,0]=4 84 B21R2.93311 Cc1cc(ccc1c2cscn2)NC(=O)CCC(C)C AIFCHEM-90083512521 [2,0,0,0,0,0|2,0,0]=4 85 B21R2.42008 COc1cc(ccc1c2cnco2)NC(=O)CC(C)C AIFCHEM-5692189841 [2,0,0,0,0,0|1,0,0]=3 86 B21R2.42008 COc1cc(ccc1c2cncs2)NC(=O)CC(C)C AIFCHEM-46703053941 [2,0,0,0,0,0|1,1,0]=4 87 B21R2.42008 COc1cc(ccc1c2cncs2)NC(=O)CC(C)O AIFCHEM-44351523761 [2,0,0,0,0,0|1,1,0]=4 88 B21R2.42008 COc1cc(ccc1c2cncs2)NC(=O)C[C@@H](C)O AIFCHEM-38729565690 [2,0,0,0,0,0|1,1,0]=4 89 B21R2.42008 COc1cc(ccc1c2cncs2)NC(=O)C[C@H](C)O AIFCHEM-42404865539 [2,0,0,0,0,0|1,1,0]=4 90 B21R2.379360 CC[C@H](C)CC(=O)Nc1ccc(c(c1)C)c2ccco2 AIFCHEM-95434912122 [2,0,0,0,0,0|2,0,0]=4 91 B21R2.379360 CC[C@H](C)CC(=O)Nc1ccc(c(c1)C)c2cncs2 AIFCHEM-41216557103 [2,0,0,0,0,0|1,1,0]=4 92 B23R2.65989 COc1cc(ccc1c2cncn2C)NC(=O)CCC(C)C AIFCHEM-90083364268 [1,1,0,0,0,0|1,0,0]=3 93 B23R2.65989 COc1cc(ccc1c2cncn2C)NC(=O)COC(C)C AIFCHEM-92146280485 [1,1,0,0,0,0|2,0,0]=4 94 B23R2.65989 COc1cc(ccc1c2cncn2C)NC(=O)CSC(C)C AIFCHEM-86224532852 [1,1,0,0,0,0|2,0,0]=4 95 B23R2.65989 COc1cc(ccc1c2cnoc2C)NC(=O)CCC(C)C AIFCHEM-90083734443 [1,1,0,0,0,0|2,0,0]=4 96 B23R2.65989 COc1cc(ccc1c2ncnn2C)NC(=O)CCC(C)C AIFCHEM-75740550166 [1,1,0,0,0,0|2,0,0]=4 97 B23R2.65989 COc1cc(ccc1c2scnc2C)NC(=O)CCC(C)C AIFCHEM-45632182009 [1,1,0,0,0,0|0,1,0]=3 98 B23R2.65989 COc1cc(ccc1c2scnc2C)NC(=O)COC(C)C AIFCHEM-46350885349 [1,1,0,0,0,0|1,1,0]=4 99 B23R2.65989 COc1cc(ccc1c2scnc2C)NC(=O)CSC(C)C AIFCHEM-38539698289 [1,1,0,0,0,0|1,1,0]=4 100 B23R2.66076 COc1cc(ccc1c2cnco2)NC(=O)[C@@H](O)CC(C)C AIFCHEM-94591602309 [1,1,0,0,0,0|0,0,0]=2 101 B23R2.66079 CCC(C)CCC(=O)Nc1ccc(c(c1)OC)c2cscn2 AIFCHEM-90776444524 [1,1,0,0,0,0|2,0,0]=4 102 B23R2.66079 CCC(C)CCC(=O)Nc1ccc(c(c1)OC)c2ncn[nH]2 AIFCHEM-90776834073 [1,1,0,0,0,0|2,0,0]=4 103 B23R2.66079 CCC(C)CCC(=O)Nc1ccc(c(c1)OC)c2nncs2 AIFCHEM-90794905637 [1,1,0,0,0,0|1,1,0]=4 104 B23R2.68013 COc1cc(ccc1c2c[nH]c(n2)C)NC(=O)CCC(C)C AIFCHEM-75740543359 [1,1,0,0,0,0|1,0,1]=4 105 B23R2.68013 COc1cc(ccc1c2cc(ns2)C)NC(=O)CCC(C)C AIFCHEM-45636760291 [1,1,0,0,0,0|2,0,0]=4 106 B23R2.68013 COc1cc(ccc1c2ccn(c2)C)NC(=O)CCC(C)C AIFCHEM-45632345906 [1,1,0,0,0,0|1,0,1]=4 107 B23R2.68013 COc1cc(ccc1c2cnc([nH]2)C)NC(=O)COC(C)C AIFCHEM-46355564098 [1,1,0,0,0,0|2,0,0]=4 108 B23R2.68013 COc1cc(ccc1c2cnc([nH]2)C)NC(=O)CSC(C)C AIFCHEM-38543940678 [1,1,0,0,0,0|2,0,0]=4 109 B23R2.68013 COc1cc(ccc1c2cnc(s2)C)NC(=O)COC(C)C AIFCHEM-46351120874 [1,1,0,0,0,0|1,1,0]=4 110 B23R2.68013 COc1cc(ccc1c2cnc(s2)C)NC(=O)CSC(C)C AIFCHEM-38540113374 [1,1,0,0,0,0|1,1,0]=4 111 B23R2.68013 COc1cc(ccc1c2csc(n2)C)NC(=O)CCC(C)C AIFCHEM-45632372108 [1,1,0,0,0,0|2,0,0]=4 112 B23R2.68013 COc1cc(ccc1c2nc(ns2)C)NC(=O)CCC(C)C AIFCHEM-45632300470 [1,1,0,0,0,0|2,0,0]=4 113 B23R2.68013 COc1cc(ccc1c2nnc([nH]2)C)NC(=O)CCC(C)C AIFCHEM-45636614056 [1,1,0,0,0,0|2,0,0]=4 114 B23R2.68013 COc1cc(ccc1c2nnc(o2)C)NC(=O)CCC(C)C AIFCHEM-94779222953 [1,1,0,0,0,0|1,0,0]=3 115 B23R2.68013 COc1cc(ccc1c2nnc(o2)C)NC(=O)CCN(C)C AIFCHEM-98258146763 [1,1,0,0,0,0|2,0,0]=4 116 B23R2.68013 COc1cc(ccc1c2nnc(o2)C)NC(=O)COC(C)C AIFCHEM-98832426368 [1,1,0,0,0,0|2,0,0]=4 117 B23R2.68013 COc1cc(ccc1c2nnc(o2)C)NC(=O)CSC(C)C AIFCHEM-99973528464 [1,1,0,0,0,0|2,0,0]=4 118 B23R2.68013 COc1cc(ccc1c2nnc(s2)C)NC(=O)CCC(C)C AIFCHEM-45632407038 [1,1,0,0,0,0|1,1,0]=4 119 B23R2.68013 COc1cc(cnc1c2ccc(o2)C)NC(=O)CCC(C)C AIFCHEM-45636727641 [1,1,0,0,0,0|2,0,0]=4 120 B23R2.915000 COc1cc(c(cc1c2ccoc2)F)NC(=O)CCC(C)C AIFCHEM-45633147136 [1,1,0,0,0,0|2,0,0]=4 121 B23R2.3381557 COc1cc(ccc1c2cnco2)NC(=O)CCS(=O)(=O)C AIFCHEM-5692097766 [1,1,0,0,0,0|2,0,0]=4 122 B23R2.3381557 COc1cc(ccc1c2cncs2)NC(=O)CCC(C)(F)F AIFCHEM-39483873649 [1,1,0,0,0,0|1,1,0]=4 123 B23R2.65984 CCC(C)CC(=O)Nc1ccc(c(c1)OC)c2cncn2C AIFCHEM-79488218548 [1,1,0,0,0,0|2,0,0]=4 124 B23R2.65984 CCC(C)CC(=O)Nc1ccc(c(c1)OC)c2scnc2C AIFCHEM-40998765047 [1,1,0,0,0,0|1,1,0]=4 125 B23R2.65984 CC[C@H](C)CC(=O)Nc1ccc(c(c1)OC)c2cncn2C AIFCHEM-91630556365 [1,1,0,0,0,0|2,0,0]=4 126 B23R2.65984 CC[C@H](C)CC(=O)Nc1ccc(c(c1)OC)c2scnc2C AIFCHEM-41213591144 [1,1,0,0,0,0|1,1,0]=4 127 B23R2.68069 CCC(C)CC(=O)Nc1ccc(c(c1)OC)c2cnc([nH]2)C AIFCHEM-41001040356 [1,1,0,0,0,0|2,0,0]=4 128 B23R2.68069 CCC(C)CC(=O)Nc1ccc(c(c1)OC)c2nnc(o2)C AIFCHEM-95876604924 [1,1,0,0,0,0|2,0,0]=4 129 B23R2.68069 CC[C@H](C)CC(=O)Nc1ccc(c(c1)OC)c2cnc(s2)C AIFCHEM-41213835209 [1,1,0,0,0,0|1,1,0]=4 130 B23R2.68069 CC[C@H](C)CC(=O)Nc1ccc(c(c1)OC)c2nnc(o2)C AIFCHEM-94947376404 [1,1,0,0,0,0|2,0,0]=4 131 B23R2.640694 CCSC(C)CC(=O)Nc1ccc(c(c1)OC)c2cncs2 AIFCHEM-40365452051 [1,1,0,0,0,0|1,1,0]=4 132 B23R2.65981 COc1cc(ccc1c2cncn2C)NC(=O)C(C)C(C)C AIFCHEM-87864176369 [0,1,0,0,1,0|2,0,0]=4 133 B23R2.65981 COc1cc(ccc1c2scnc2C)NC(=O)C(C)C(C)C AIFCHEM-46443318472 [0,1,0,0,1,0|1,1,0]=4 134 B23R2.68064 COc1cc(ccc1c2cnc([nH]2)C)NC(=O)C(C)C(C)C AIFCHEM-46446137461 [0,1,0,0,1,0|2,0,0]=4 135 B23R2.68064 COc1cc(ccc1c2cnc(s2)C)NC(=O)C(C)C(C)C AIFCHEM-46443629237 [0,1,0,0,1,0|1,1,0]=4 136 B23R2.68064 COc1cc(ccc1c2nnc(o2)C)NC(=O)C(C)C(C)C AIFCHEM-96460792878 [0,1,0,0,1,0|2,0,0]=4 137 B23R2.68064 COc1cc(ccc1c2nnc(o2)C)NC(=O)C(O)C(C)C AIFCHEM-95314551671 [0,1,0,0,1,0|2,0,0]=4 138 B23R2.68064 COc1cc(ccc1c2nnc(o2)C)NC(=O)[C@@H](O)C(C)C AIFCHEM-95614327141 [0,1,0,0,1,0|2,0,0]=4 139 B23R2.68064 COc1cc(ccc1c2nnc(o2)C)NC(=O)[C@H](O)C(C)C AIFCHEM-97968256724 [0,1,0,0,1,0|2,0,0]=4 140 B23R2.3381831 COc1cc(ccc1c2cnco2)NC(=O)C(C)C(C)(C)C AIFCHEM-94589832123 [0,1,0,0,1,0|1,0,0]=3 141 B23R3.2000075 COc1cc(ccc1c2ccns2)NC(=O)C3CC(C3)C AIFCHEM-40636267911 [1,0,0,1,0,0|2,0,0]=4 142 B23R3.2000075 COc1cc(ccc1c2cn[nH]c2)NC(=O)C3CC(C3)C AIFCHEM-40636266827 [1,0,0,1,0,0|2,0,0]=4 143 B23R3.2000075 COc1cc(ccc1c2cnco2)NC(=O)C3CC(C3)F AIFCHEM-5767402769 [1,0,0,1,0,0|1,0,0]=3 144 B23R3.2000075 COc1cc(ccc1c2cncs2)NC(=O)C3CC(C3)F AIFCHEM-41660422965 [1,0,0,1,0,0|1,1,0]=4 145 B23R3.2000075 COc1cc(ccc1c2cncs2)NC(=O)C3CC(C3)O AIFCHEM-41467017575 [1,0,0,1,0,0|1,1,0]=4 146 B23R3.2000075 COc1cc(ccc1c2cncs2)NC(=O)[C@H]3C[C@@H](C3)O AIFCHEM-42068912159 [1,0,0,1,0,0|1,1,0]=4 147 B23R3.2000075 COc1cc(ccc1c2cncs2)NC(=O)[C@H]3C[C@H](C3)O AIFCHEM-39257285243 [1,0,0,1,0,0|1,1,0]=4 148 B23R3.2000075 COc1cc(ccc1c2cnsc2)NC(=O)C3CC(C3)C AIFCHEM-40633336096 [1,0,0,1,0,0|2,0,0]=4 149 B23R3.2000075 COc1cc(ccc1c2cscn2)NC(=O)C3CC(C3)C AIFCHEM-90609539812 [1,0,0,1,0,0|2,0,0]=4 150 B23R3.2000075 COc1cc(ccc1c2ncn[nH]2)NC(=O)C3CC(C3)C AIFCHEM-90610103421 [1,0,0,1,0,0|2,0,0]=4 151 B23R3.2000075 COc1cc(ccc1c2ncns2)NC(=O)C3CC(C3)C AIFCHEM-40633732677 [1,0,0,1,0,0|2,0,0]=4 152 B23R3.2000075 COc1cc(ccc1c2nncs2)NC(=O)C3CC(C3)C AIFCHEM-90629011445 [1,0,0,1,0,0|1,1,0]=4 153 B23R3.2000076 COc1cc(ccc1c2ccns2)NC(=O)CCC3CC3 AIFCHEM-43727805517 [1,0,0,1,0,0|2,0,0]=4 154 B23R3.2000076 COc1cc(ccc1c2cn[nH]c2)NC(=O)CCC3CC3 AIFCHEM-43727804433 [1,0,0,1,0,0|2,0,0]=4 155 B23R3.2000076 COc1cc(ccc1c2cncs2)NC(=O)CCC3CC3 AIFCHEM-43724798951 [1,0,0,1,0,0|0,1,0]=3 156 B23R3.2000076 COc1cc(ccc1c2cnsc2)NC(=O)CCC3CC3 AIFCHEM-43724925462 [1,0,0,1,0,0|2,0,0]=4 157 B23R3.2000076 COc1cc(ccc1c2cscn2)NC(=O)CCC3CC3 AIFCHEM-85281050098 [1,0,0,1,0,0|2,0,0]=4 158 B23R3.2000076 COc1cc(ccc1c2ncn[nH]2)NC(=O)CCC3CC3 AIFCHEM-85281366407 [1,0,0,1,0,0|2,0,0]=4 159 B23R3.2000076 COc1cc(ccc1c2ncns2)NC(=O)CCC3CC3 AIFCHEM-43725146043 [1,0,0,1,0,0|2,0,0]=4 160 B23R3.2000076 COc1cc(ccc1c2nncs2)NC(=O)CCC3CC3 AIFCHEM-85299151931 [1,0,0,1,0,0|1,1,0]=4 161 B23R3.4399590 COc1cc(ccc1c2ccns2)NC(=O)C3CC3(C)C AIFCHEM-38293753387 [1,0,0,1,0,0|2,0,0]=4 162 B23R3.4399590 COc1cc(ccc1c2ccns2)NC(=O)[C@H]3CC3(C)C AIFCHEM-43772012281 [1,0,0,1,0,0|2,0,0]=4 163 B23R3.4399590 COc1cc(ccc1c2cnco2)NC(=O)[C@@H]3CC3(F)F AIFCHEM-5718499101 [1,0,0,1,0,0|2,0,0]=4 164 B23R3.4399590 COc1cc(ccc1c2cnco2)NC(=O)[C@H]3CC3(F)F AIFCHEM-5718946122 [1,0,0,1,0,0|2,0,0]=4 165 B23R3.4399590 COc1cc(ccc1c2cncs2)NC(=O)C3CC3(C)C AIFCHEM-38289683181 [1,0,0,1,0,0|0,1,0]=3 166 B23R3.4399590 COc1cc(ccc1c2cncs2)NC(=O)[C@H]3CC3(C)C AIFCHEM-43768517435 [1,0,0,1,0,0|0,1,0]=3 167 B23R3.4399590 COc1cc(ccc1c2cnsc2)NC(=O)C3CC3(C)C AIFCHEM-38289809692 [1,0,0,1,0,0|2,0,0]=4 168 B23R3.4399590 COc1cc(ccc1c2cnsc2)NC(=O)[C@H]3CC3(C)C AIFCHEM-43768769006 [1,0,0,1,0,0|2,0,0]=4 169 B23R3.4399590 COc1cc(ccc1c2cscn2)NC(=O)C3CC3(C)C AIFCHEM-83867046924 [1,0,0,1,0,0|2,0,0]=4 170 B23R3.4399590 COc1cc(ccc1c2cscn2)NC(=O)[C@H]3CC3(C)C AIFCHEM-93714467147 [1,0,0,1,0,0|2,0,0]=4 171 B23R3.4399590 COc1cc(ccc1c2ncn[nH]2)NC(=O)C3CC3(C)C AIFCHEM-83867318793 [1,0,0,1,0,0|2,0,0]=4 172 B23R3.4399590 COc1cc(ccc1c2ncn[nH]2)NC(=O)[C@H]3CC3(C)C AIFCHEM-93714946296 [1,0,0,1,0,0|2,0,0]=4 173 B23R3.4399590 COc1cc(ccc1c2ncns2)NC(=O)C3CC3(C)C AIFCHEM-38290030273 [1,0,0,1,0,0|2,0,0]=4 174 B23R3.4399590 COc1cc(ccc1c2ncns2)NC(=O)[C@H]3CC3(C)C AIFCHEM-43769164927 [1,0,0,1,0,0|2,0,0]=4 175 B23R3.4399590 COc1cc(ccc1c2nncs2)NC(=O)C3CC3(C)C AIFCHEM-83880396457 [1,0,0,1,0,0|1,1,0]=4 176 B23R3.4399590 COc1cc(ccc1c2nncs2)NC(=O)[C@H]3CC3(C)C AIFCHEM-93733041180 [1,0,0,1,0,0|1,1,0]=4 177 B23R3.2000073 COc1cc(ccc1c2cncs2)NC(=O)CC3CCC3 AIFCHEM-44798497133 [1,0,0,1,0,0|1,1,0]=4 178 B23R3.4399592 COc1cc(ccc1c2cncs2)NC(=O)[C@H]3[C@@H]([C@@H]3C)C AIFCHEM-39193675547 [1,0,0,1,0,0|1,1,0]=4 179 B23R3.4399593 COc1cc(ccc1c2cncs2)NC(=O)CC3(CC3)C AIFCHEM-40367891759 [1,0,0,1,0,0|1,1,0]=4 180 B25R3.7132163 COc1cc(ccc1c2cncs2)NC(=O)COC(C)C3CC3 AIFCHEM-44396713501 [0,0,0,1,0,1|1,1,0]=4 181 B21R2.41947 COc1cc(ccc1c2ccco2)C(=O)NCC(C)C AIFCHEM-82181923627 [1,0,0,0,1,0|2,0,0]=4 182 B21R2.41947 COc1cc(ccc1c2cncs2)C(=O)NCC(C)C AIFCHEM-37951930076 [1,0,0,0,1,0|1,1,0]=4 183 B21R2.41976 CCC(C)C(=O)Nc1ccc(c(c1)OC)c2cnco2 AIFCHEM-5718279575 [1,0,0,0,1,0|1,0,0]=3 184 B21R2.41976 CC[C@@H](C)C(=O)Nc1ccc(c(c1)OC)c2cnco2 AIFCHEM-5758159386 [1,0,0,0,1,0|1,0,0]=3 185 B21R2.41976 CC[C@@H](C)C(=O)Nc1ccc(c(c1)OC)c2cncs2 AIFCHEM-45158461535 [1,0,0,0,1,0|1,1,0]=4 186 B21R2.41976 CC[C@H](C)C(=O)Nc1ccc(c(c1)OC)c2cnco2 AIFCHEM-5692031475 [1,0,0,0,1,0|1,0,0]=3 187 B21R2.41976 CC[C@H](C)C(=O)Nc1ccc(c(c1)OC)c2cncs2 AIFCHEM-43178653358 [1,0,0,0,1,0|1,1,0]=4 188 B21R2.93307 Cc1cc(ccc1c2cnco2)C(=O)NC(C)C(C)C AIFCHEM-38108012074 [1,0,0,0,1,0|2,0,0]=4 189 B21R2.93330 Cc1cc(ccc1c2ccco2)NC(=O)C(C)C(C)C AIFCHEM-95434896621 [1,0,0,0,1,0|2,0,0]=4 190 B21R2.93330 Cc1cc(ccc1c2ccco2)NC(=O)C(O)C(C)C AIFCHEM-98043481362 [1,0,0,0,1,0|2,0,0]=4 191 B21R2.93330 Cc1cc(ccc1c2ccco2)NC(=O)[C@@H](O)C(C)C AIFCHEM-95434904614 [1,0,0,0,1,0|2,0,0]=4 192 B21R2.93330 Cc1cc(ccc1c2ccco2)NC(=O)[C@H](O)C(C)C AIFCHEM-95434904613 [1,0,0,0,1,0|2,0,0]=4 193 B21R2.93330 Cc1cc(ccc1c2cncs2)NC(=O)C(C)C(C)C AIFCHEM-46445613951 [1,0,0,0,1,0|1,1,0]=4 194 B23R2.2840 CCc1cc(ccc1c2cccnc2)NC(=O)CCC(C)C AIFCHEM-94779623843 [1,0,0,0,0,1|2,0,0]=4 195 B23R2.2840 COc1cc(ccc1C2=CCCCO2)NC(=O)CCC(C)C AIFCHEM-90068801339 [1,0,0,0,0,1|1,0,1]=4 196 B23R2.2840 COc1cc(ccc1C2=COCCO2)NC(=O)CCC(C)C AIFCHEM-90068779382 [1,0,0,0,0,1|1,0,1]=4 197 B23R2.2840 COc1cc(ccc1c2ccccn2)NC(=O)CCC(C)C AIFCHEM-14785078685 [1,0,0,0,0,1|2,0,0]=4 198 B23R2.2840 COc1cc(ccc1c2cccnc2)NC(=O)COC(C)C AIFCHEM-46355516520 [1,0,0,0,0,1|2,0,0]=4 199 B23R2.2840 COc1cc(ccc1c2cccnc2)NC(=O)CSC(C)C AIFCHEM-38543893100 [1,0,0,0,0,1|2,0,0]=4 200 B23R2.2840 COc1cc(ccc1c2ccncn2)NC(=O)CCC(C)C AIFCHEM-45636865886 [1,0,0,0,0,1|1,0,0]=3 201 B23R2.2840 COc1cc(ccc1c2ccncn2)NC(=O)COC(C)C AIFCHEM-46355583786 [1,0,0,0,0,1|2,0,0]=4 202 B23R2.2840 COc1cc(ccc1c2ccncn2)NC(=O)CSC(C)C AIFCHEM-38543960366 [1,0,0,0,0,1|2,0,0]=4 203 B23R2.2840 COc1cc(ccc1c2cnccn2)NC(=O)CCC(C)C AIFCHEM-90083290256 [1,0,0,0,0,1|1,0,0]=3 204 B23R2.2840 COc1cc(ccc1c2cnccn2)NC(=O)COC(C)C AIFCHEM-92146254113 [1,0,0,0,0,1|2,0,0]=4 205 B23R2.2840 COc1cc(ccc1c2cnccn2)NC(=O)CSC(C)C AIFCHEM-86224483200 [1,0,0,0,0,1|2,0,0]=4 206 B23R2.2840 COc1cc(ccc1c2ncccn2)NC(=O)CCC(C)C AIFCHEM-45632433832 [1,0,0,0,0,1|2,0,0]=4 207 B23R2.2840 COc1cc(cnc1c2cccnc2)NC(=O)CCC(C)C AIFCHEM-36804991554 [1,0,0,0,0,1|2,0,0]=4 208 B23R2.66061 COc1cc(ccc1c2cc[nH]c2)CNC(=O)CCC(C)C AIFCHEM-45636691401 [1,0,0,0,0,1|1,0,1]=4 209 B23R2.66061 COc1cc(ccc1c2ccco2)CNC(=O)CCC(C)C AIFCHEM-82181931084 [1,0,0,0,0,1|1,0,0]=3 210 B23R2.66061 COc1cc(ccc1c2ccco2)CNC(=O)COC(C)C AIFCHEM-82182208002 [1,0,0,0,0,1|2,0,0]=4 211 B23R2.66061 COc1cc(ccc1c2ccoc2)CNC(=O)CCC(C)C AIFCHEM-45636760516 [1,0,0,0,0,1|2,0,0]=4 212 B23R2.66061 COc1cc(ccc1c2ccsc2)CNC(=O)CCC(C)C AIFCHEM-83017727844 [1,0,0,0,0,1|2,0,0]=4 213 B23R2.66061 COc1cc(ccc1c2cn[nH]c2)CNC(=O)CCC(C)C AIFCHEM-87203199817 [1,0,0,0,0,1|2,0,0]=4 214 B23R2.66061 COc1cc(ccc1c2cnoc2)CNC(=O)CCC(C)C AIFCHEM-90036538465 [1,0,0,0,0,1|2,0,0]=4 215 B23R2.66078 COc1cc(ccc1c2ccns2)NC(=O)CCCC(C)C AIFCHEM-45527077685 [1,0,0,0,0,1|2,0,0]=4 216 B23R2.66078 COc1cc(ccc1c2ccns2)NC(=O)COCC(C)C AIFCHEM-38695138821 [1,0,0,0,0,1|2,0,0]=4 217 B23R2.66078 COc1cc(ccc1c2cnco2)NC(=O)CCSC(=O)C AIFCHEM-5741067581 [1,0,0,0,0,1|1,0,1]=4 218 B23R2.66078 COc1cc(ccc1c2cncs2)NC(=O)CCCC(C)C AIFCHEM-45523898319 [1,0,0,0,0,1|0,1,0]=3 219 B23R2.66078 COc1cc(ccc1c2cncs2)NC(=O)COCC(C)C AIFCHEM-38692316775 [1,0,0,0,0,1|0,1,0]=3 220 B23R2.66078 COc1cc(ccc1c2cnsc2)NC(=O)CCCC(C)C AIFCHEM-45524078830 [1,0,0,0,0,1|2,0,0]=4 221 B23R2.66078 COc1cc(ccc1c2cnsc2)NC(=O)COCC(C)C AIFCHEM-38692443286 [1,0,0,0,0,1|2,0,0]=4 222 B23R2.66078 COc1cc(ccc1c2cscn2)NC(=O)COCC(C)C AIFCHEM-94157552607 [1,0,0,0,0,1|2,0,0]=4 223 B23R2.66078 COc1cc(ccc1c2ncn[nH]2)NC(=O)COCC(C)C AIFCHEM-94157983996 [1,0,0,0,0,1|2,0,0]=4 224 B23R2.66078 COc1cc(ccc1c2ncns2)NC(=O)CCCC(C)C AIFCHEM-45524299411 [1,0,0,0,0,1|2,0,0]=4 225 B23R2.66078 COc1cc(ccc1c2ncns2)NC(=O)COCC(C)C AIFCHEM-38692663867 [1,0,0,0,0,1|2,0,0]=4 226 B23R2.66078 COc1cc(ccc1c2nncs2)NC(=O)COCC(C)C AIFCHEM-94179650800 [1,0,0,0,0,1|1,1,0]=4 227 B23R2.66003 CCC(C)CC(=O)NCc1ccc(c(c1)OC)c2ccco2 AIFCHEM-93954387340 [1,0,0,0,0,1|2,0,0]=4 228 B23R2.66003 CC[C@H](C)CC(=O)NCc1ccc(c(c1)OC)c2ccco2 AIFCHEM-82182095802 [1,0,0,0,0,1|2,0,0]=4 229 B23R2.66380 CCC(C)CC(=O)Nc1ccc(c(c1)OC)c2ccncn2 AIFCHEM-41001079364 [1,0,0,0,0,1|2,0,0]=4 230 B23R2.66380 CCC(C)CC(=O)Nc1ccc(c(c1)OC)c2cnccn2 AIFCHEM-79488192176 [1,0,0,0,0,1|2,0,0]=4 231 B23R2.66380 CC[C@H](C)CC(=O)Nc1ccc(c(c1)OC)c2cccnc2 AIFCHEM-41216785955 [1,0,0,0,0,1|2,0,0]=4 232 B23R2.66380 CC[C@H](C)CC(=O)Nc1ccc(c(c1)OC)c2ccncn2 AIFCHEM-41216853221 [1,0,0,0,0,1|2,0,0]=4 233 B23R2.66380 CC[C@H](C)CC(=O)Nc1ccc(c(c1)OC)c2cnccn2 AIFCHEM-91630529993 [1,0,0,0,0,1|2,0,0]=4 234 B23R2.66373 COc1cc(ccc1c2cccnc2)NC(=O)C(C)C(C)C AIFCHEM-46446049483 [0,0,0,0,1,1|2,0,0]=4 235 B23R2.66373 COc1cc(ccc1c2ccncn2)NC(=O)C(C)C(C)C AIFCHEM-46446178649 [0,0,0,0,1,1|2,0,0]=4 236 B23R2.66373 COc1cc(ccc1c2cnccn2)NC(=O)C(C)C(C)C AIFCHEM-87864149997 [0,0,0,0,1,1|2,0,0]=4