0 B19R3.5942 CC1CC(C1)NC(=O)c2c[nH]c3c2cccc3 AIFCHEM-6154127745 [0,0,0,0,0,0|3,0,1]=4 1 B19R3.5942 CC1CC(C1)NC(=O)c2csc3c2cccc3 AIFCHEM-6154126173 [0,0,0,0,0,0|2,1,1]=4 2 B18R3.4298 CC1CC(C1)NCc2cnn3c2cccc3 AIFCHEM-6153353828 [1,0,0,0,0,0|3,0,0]=4 3 B18R3.4298 CC1CC(C1)NCc2csc3c2cccc3 AIFCHEM-6153603277 [1,0,0,0,0,0|1,1,0]=3 4 B18R3.4298 CN1CC(C1)NCc2coc3c2cccc3 AIFCHEM-94583226081 [1,0,0,0,0,0|2,0,0]=3 5 B18R3.4298 FC1CC(C1)NCc2csc3c2cccc3 AIFCHEM-6126424855 [1,0,0,0,0,0|1,1,0]=3 6 B18R3.4298 FC1CC(C1)NCc2n[nH]c3c2cccc3 AIFCHEM-6107510759 [1,0,0,0,0,0|3,0,0]=4 7 B18R3.4298 F[C@H]1C[C@@H](C1)NCc2csc3c2cccc3 AIFCHEM-5889019691 [1,0,0,0,0,0|1,1,0]=3 8 B18R3.4298 F[C@H]1C[C@@H](C1)NCc2n[nH]c3c2cccc3 AIFCHEM-5889747313 [1,0,0,0,0,0|3,0,0]=4 9 B18R3.4298 F[C@H]1C[C@H](C1)NCc2csc3c2cccc3 AIFCHEM-5967922480 [1,0,0,0,0,0|1,1,0]=3 10 B18R3.4298 F[C@H]1C[C@H](C1)NCc2n[nH]c3c2cccc3 AIFCHEM-5968002041 [1,0,0,0,0,0|3,0,0]=4 11 B18R3.4298 OC1CC(C1)NCc2csc3c2cccc3 AIFCHEM-5764277975 [1,0,0,0,0,0|0,1,0]=2 12 B18R3.4298 OC1CC(C1)NCc2nnc3n2cccc3 AIFCHEM-94577122820 [1,0,0,0,0,0|3,0,0]=4 13 B18R3.4298 O[C@H]1C[C@@H](C1)NCc2c[nH]c3c2cncn3 AIFCHEM-6493737144 [1,0,0,0,0,0|3,0,0]=4 14 B18R3.4298 O[C@H]1C[C@@H](C1)NCc2csc3c2cccc3 AIFCHEM-6493609128 [1,0,0,0,0,0|0,1,0]=2 15 B18R3.4298 O[C@H]1C[C@H](C1)NCc2c[nH]c3c2cncn3 AIFCHEM-6455079062 [1,0,0,0,0,0|3,0,0]=4 16 B18R3.4298 O[C@H]1C[C@H](C1)NCc2csc3c2cccc3 AIFCHEM-6455036032 [1,0,0,0,0,0|0,1,0]=2 17 B18R3.7585 O=C(NC1CCC1)c2csc3c2cccc3 AIFCHEM-5771381214 [1,0,0,0,0,0|1,1,1]=4 18 B20R3.98849 CC1CC(C1)NC(=O)c2coc3c2ccc(c3)F AIFCHEM-6177634762 [0,1,0,0,0,0|2,0,1]=4 19 B20R3.98849 Cc1ccc2c(coc2c1)C(=O)NC3CC(C3)C AIFCHEM-6153814101 [0,1,0,0,0,0|2,0,1]=4 20 B20R3.3362403 CC1CC(C1)NC(=O)c2coc3c2cc(cc3)O AIFCHEM-6090218558 [0,1,0,0,0,0|2,0,1]=4 21 B20R3.3362403 O=C(NC1CC(C1)F)c2coc3c2cc(cc3)O AIFCHEM-6175732150 [0,1,0,0,0,0|2,0,1]=4 22 B20R3.3362403 O=C(N[C@H]1C[C@@H](C1)F)c2coc3c2cc(cc3)O AIFCHEM-5889649850 [0,1,0,0,0,0|2,0,1]=4 23 B20R3.3362403 O=C(N[C@H]1C[C@H](C1)F)c2coc3c2cc(cc3)O AIFCHEM-5927975880 [0,1,0,0,0,0|2,0,1]=4 24 B20R4.2035184 O=C(c1coc2c1cccc2)N3CC4CC3C4 AIFCHEM-5709337593 [0,0,0,1,0,0|2,0,1]=4 25 B20R3.150391 CC(NC1CN(C1)C)c2cnc3ccccc3n2 AIFCHEM-94533066427 [0,0,0,0,0,1|3,0,0]=4 26 B20R3.150391 CC(N[C@H]1C[C@@H](C1)F)c2ccc3ccccc3n2 AIFCHEM-5890639750 [0,0,0,0,0,1|2,0,0]=3 27 B20R3.150391 CC(N[C@H]1C[C@H](C1)F)c2ccc3ccccc3n2 AIFCHEM-5968026653 [0,0,0,0,0,1|2,0,0]=3 28 B20R3.150391 CC1CC(C1)NC(C)c2ccc3ccccc3n2 AIFCHEM-6089845040 [0,0,0,0,0,1|2,0,0]=3 29 B20R3.150391 CC1CC(C1)NC(C)c2ccc3ncccc3c2 AIFCHEM-6140392282 [0,0,0,0,0,1|3,0,0]=4 30 B17R2.137 CC(O)CCNCc1coc2c1cccc2 AIFCHEM-94577735941 [1,0,1,0,0,0|0,0,0]=2 31 B17R2.137 C[C@H](O)CCNCc1coc2c1cccc2 AIFCHEM-94544714207 [1,0,1,0,0,0|0,0,0]=2 32 B17R2.2343 CCCCNC(=O)c1coc2c1cccc2 AIFCHEM-5745421437 [1,0,1,0,0,0|1,0,1]=4 33 B17R2.6 CCCC(C)NCc1coc2c1cccc2 AIFCHEM-94560473691 [1,0,1,0,0,0|1,0,0]=3 34 B17R2.6 CCC[C@@H](C)NCc1coc2c1cccc2 AIFCHEM-6010923622 [1,0,1,0,0,0|1,0,0]=3 35 B17R2.6 CCC[C@H](C)NCc1coc2c1cccc2 AIFCHEM-5686491001 [1,0,1,0,0,0|1,0,0]=3 36 B17R2.6 COCC(C)NCc1coc2c1cccc2 AIFCHEM-6036255563 [1,0,1,0,0,0|2,0,0]=4 37 B17R2.6 COC[C@@H](C)NCc1coc2c1cccc2 AIFCHEM-5748516822 [1,0,1,0,0,0|2,0,0]=4 38 B17R2.6 COC[C@H](C)NCc1coc2c1cccc2 AIFCHEM-5684976365 [1,0,1,0,0,0|2,0,0]=4 39 B17R2.6 C[C@@H](CC#N)NCc1coc2c1cccc2 AIFCHEM-6063891950 [1,0,1,0,0,0|1,0,1]=4 40 B17R2.6 C[C@@H](CCO)NCc1c[nH]c2c1nccc2 AIFCHEM-6496211194 [1,0,1,0,0,0|2,0,0]=4 41 B17R2.6 C[C@H](CC#N)NCc1coc2c1cccc2 AIFCHEM-6266929078 [1,0,1,0,0,0|1,0,1]=4 42 B17R3.9620 c1ccc2c(csc2c1)CNC3CCC3 AIFCHEM-94560355446 [2,0,0,0,0,0|0,1,0]=3 43 B17R3.9620 c1ccc2c(csc2c1)CNC3COC3 AIFCHEM-94539433285 [2,0,0,0,0,0|1,1,0]=4 44 B19R3.1036 CO[C@H]1C[C@@H](C1)NCc2c[nH]c3c2cccc3 AIFCHEM-5781027830 [1,1,0,0,0,0|1,0,0]=3 45 B19R3.1036 CO[C@H]1C[C@H](C1)NCc2c[nH]c3c2cccc3 AIFCHEM-6185609836 [1,1,0,0,0,0|1,0,0]=3 46 B19R3.1036 OCC1CC(C1)NCc2csc3c2cccc3 AIFCHEM-6483501306 [1,1,0,0,0,0|0,1,0]=3 47 B19R3.1036 OC[C@H]1C[C@H](C1)NCc2csc3c2cccc3 AIFCHEM-6440577811 [1,1,0,0,0,0|0,1,0]=3 48 B19R3.58648 CC1CC(C1)NCc2c[nH]c3c2ccc(c3)Cl AIFCHEM-6141234364 [1,1,0,0,0,0|2,0,0]=4 49 B19R3.58648 Cc1ccc2c(c[nH]c2c1)CN[C@H]3C[C@@H](C3)O AIFCHEM-6493966124 [1,1,0,0,0,0|1,0,0]=3 50 B19R3.58648 Cc1ccc2c(c[nH]c2c1)CN[C@H]3C[C@H](C3)O AIFCHEM-6399001030 [1,1,0,0,0,0|1,0,0]=3 51 B19R3.58648 F[C@H]1C[C@@H](C1)NCc2c[nH]c3c2ccc(c3)Cl AIFCHEM-5890014756 [1,1,0,0,0,0|2,0,0]=4 52 B19R3.58648 OC1CC(C1)NCc2c[nH]c3c2ncc(c3)Cl AIFCHEM-6450532756 [1,1,0,0,0,0|2,0,0]=4 53 B19R3.58648 OC1CC(C1)NCc2cnc3n2ccc(c3)F AIFCHEM-94597691956 [1,1,0,0,0,0|2,0,0]=4 54 B19R3.58648 O[C@H]1C[C@@H](C1)NCc2c[nH]c3c2ccc(n3)Cl AIFCHEM-6501074521 [1,1,0,0,0,0|2,0,0]=4 55 B19R3.58648 O[C@H]1C[C@@H](C1)NCc2c[nH]c3c2ncc(c3)Cl AIFCHEM-6496110034 [1,1,0,0,0,0|2,0,0]=4 56 B19R3.58648 O[C@H]1C[C@@H](C1)NCc2cnc3n2ccc(c3)F AIFCHEM-6510019920 [1,1,0,0,0,0|2,0,0]=4 57 B19R3.58648 O[C@H]1C[C@H](C1)NCc2c[nH]c3c2ccc(n3)Cl AIFCHEM-6398162143 [1,1,0,0,0,0|2,0,0]=4 58 B19R3.58648 O[C@H]1C[C@H](C1)NCc2c[nH]c3c2ncc(c3)Cl AIFCHEM-6478237861 [1,1,0,0,0,0|2,0,0]=4 59 B19R3.58648 O[C@H]1C[C@H](C1)NCc2cnc3n2ccc(c3)F AIFCHEM-6416999483 [1,1,0,0,0,0|2,0,0]=4 60 B19R3.2246980 CC1(CC(C1)NCc2coc3c2cccc3)C AIFCHEM-5939784804 [1,1,0,0,0,0|1,0,0]=3 61 B19R3.2246980 C[C@@]1(C[C@H](C1)NCc2c[nH]c3c2cccn3)O AIFCHEM-6492436310 [1,1,0,0,0,0|2,0,0]=4 62 B19R3.2246980 C[C@@]1(C[C@H](C1)NCc2c[nH]c3c2ccnc3)O AIFCHEM-6491990611 [1,1,0,0,0,0|2,0,0]=4 63 B19R3.2246980 C[C@@]1(C[C@H](C1)NCc2cnc3n2cccc3)O AIFCHEM-6494630093 [1,1,0,0,0,0|2,0,0]=4 64 B19R3.2470030 Cc1ccc2[nH]cc(c2c1)CN[C@H]3C[C@@H](C3)O AIFCHEM-6493799909 [1,1,0,0,0,0|1,0,0]=3 65 B19R3.2470030 Cc1ccc2[nH]cc(c2c1)CN[C@H]3C[C@H](C3)O AIFCHEM-6417078545 [1,1,0,0,0,0|1,0,0]=3 66 B19R3.2470030 Cc1ccc2[nH]nc(c2c1)CNC3CC(C3)O AIFCHEM-94597694901 [1,1,0,0,0,0|2,0,0]=4 67 B19R3.2470030 Cc1ccc2[nH]nc(c2c1)CN[C@H]3C[C@@H](C3)O AIFCHEM-6493540975 [1,1,0,0,0,0|2,0,0]=4 68 B19R3.2470030 Cc1ccc2[nH]nc(c2c1)CN[C@H]3C[C@H](C3)O AIFCHEM-6478339817 [1,1,0,0,0,0|2,0,0]=4 69 B19R3.2470030 FC1CC(C1)NCc2c[nH]c3c2cc(cc3)Cl AIFCHEM-6127630739 [1,1,0,0,0,0|2,0,0]=4 70 B19R3.2470030 F[C@H]1C[C@@H](C1)NCc2c[nH]c3c2cc(cc3)Cl AIFCHEM-5979096737 [1,1,0,0,0,0|2,0,0]=4 71 B19R3.2470030 F[C@H]1C[C@H](C1)NCc2c[nH]c3c2cc(cc3)Cl AIFCHEM-5927902111 [1,1,0,0,0,0|2,0,0]=4 72 B19R3.2470030 Fc1ccc2[nH]cc(c2c1)CN[C@H]3C[C@@H](C3)F AIFCHEM-5970485587 [1,1,0,0,0,0|2,0,0]=4 73 B19R3.2470030 Fc1ccc2[nH]cc(c2c1)CN[C@H]3C[C@H](C3)F AIFCHEM-5967893943 [1,1,0,0,0,0|2,0,0]=4 74 B19R3.2470030 OC1CC(C1)NCc2n[nH]c3c2cc(cc3)Br AIFCHEM-94597692968 [1,1,0,0,0,0|2,0,0]=4 75 B19R3.2470030 O[C@H]1C[C@@H](C1)NCc2c[nH]c3c2cc(cc3)Cl AIFCHEM-6509997774 [1,1,0,0,0,0|1,0,0]=3 76 B19R3.2470030 O[C@H]1C[C@@H](C1)NCc2c[nH]c3c2cc(cc3)I AIFCHEM-6501144819 [1,1,0,0,0,0|1,0,0]=3 77 B19R3.2470030 O[C@H]1C[C@@H](C1)NCc2n[nH]c3c2cc(cc3)Br AIFCHEM-6500868000 [1,1,0,0,0,0|2,0,0]=4 78 B19R3.2470030 O[C@H]1C[C@H](C1)NCc2c[nH]c3c2cc(cc3)Cl AIFCHEM-6398086691 [1,1,0,0,0,0|1,0,0]=3 79 B19R3.2470030 O[C@H]1C[C@H](C1)NCc2c[nH]c3c2cc(cc3)I AIFCHEM-6455992117 [1,1,0,0,0,0|1,0,0]=3 80 B19R3.2470030 O[C@H]1C[C@H](C1)NCc2n[nH]c3c2cc(cc3)Br AIFCHEM-6462287623 [1,1,0,0,0,0|2,0,0]=4 81 B19R3.2481159 Cn1nc(c2c1cccc2)CNC3CC(C3)O AIFCHEM-94597694392 [1,1,0,0,0,0|2,0,0]=4 82 B19R3.2481159 Cn1nc(c2c1cccc2)CN[C@H]3C[C@@H](C3)O AIFCHEM-6493673698 [1,1,0,0,0,0|2,0,0]=4 83 B19R3.2481159 Cn1nc(c2c1cccc2)CN[C@H]3C[C@H](C3)O AIFCHEM-6399488848 [1,1,0,0,0,0|2,0,0]=4 84 B19R3.2483602 Cc1nc2ccccn2c1CNC3CC(C3)O AIFCHEM-94597693800 [1,1,0,0,0,0|2,0,0]=4 85 B19R3.2483602 Cc1sc2ccccc2c1CNC3CC(C3)O AIFCHEM-6425120674 [1,1,0,0,0,0|0,1,0]=3 86 B19R3.2483602 Cc1sc2ccccc2c1CN[C@H]3C[C@@H](C3)O AIFCHEM-6496520750 [1,1,0,0,0,0|0,1,0]=3 87 B19R3.2483602 Cc1sc2ccccc2c1CN[C@H]3C[C@H](C3)O AIFCHEM-6478387816 [1,1,0,0,0,0|0,1,0]=3 88 B19R3.2483602 O=C1Nc2ccccc2C1CN[C@H]3C[C@@H](C3)O AIFCHEM-6494025538 [1,1,0,0,0,0|1,0,1]=4 89 B19R3.2483602 O=C1Nc2ccccc2C1CN[C@H]3C[C@H](C3)O AIFCHEM-6455176704 [1,1,0,0,0,0|1,0,1]=4 90 B19R3.3008031 Cc1cccc2c1n[nH]c2CN[C@H]3C[C@@H](C3)O AIFCHEM-6510002033 [1,1,0,0,0,0|2,0,0]=4 91 B19R3.3008031 Cc1cccc2c1n[nH]c2CN[C@H]3C[C@H](C3)O AIFCHEM-6398116171 [1,1,0,0,0,0|2,0,0]=4 92 B19R3.3008031 Cc1cccn2c1ncc2CNC3CC(C3)O AIFCHEM-94597692610 [1,1,0,0,0,0|2,0,0]=4 93 B19R3.3008031 Cc1cccn2c1ncc2CN[C@H]3C[C@@H](C3)O AIFCHEM-6493818886 [1,1,0,0,0,0|2,0,0]=4 94 B19R3.3008031 Cc1cccn2c1ncc2CN[C@H]3C[C@H](C3)O AIFCHEM-6462311408 [1,1,0,0,0,0|2,0,0]=4 95 B19R3.3008031 O[C@H]1C[C@@H](C1)NCc2c[nH]c3c2cccc3F AIFCHEM-6509952115 [1,1,0,0,0,0|1,0,0]=3 96 B19R3.3008031 O[C@H]1C[C@H](C1)NCc2c[nH]c3c2cccc3F AIFCHEM-6398114864 [1,1,0,0,0,0|1,0,0]=3 97 B19R3.3013123 O[C@H]1C[C@@H](C1)NCc2c[nH]c3c2c(ccc3)Cl AIFCHEM-6493539913 [1,1,0,0,0,0|1,0,0]=3 98 B19R3.3013123 O[C@H]1C[C@H](C1)NCc2c[nH]c3c2c(ccc3)Cl AIFCHEM-6455297702 [1,1,0,0,0,0|1,0,0]=3 99 B19R3.3013123 O[C@H]1C[C@H](C1)NCc2c[nH]c3c2c(ccc3)F AIFCHEM-6462133316 [1,1,0,0,0,0|1,0,0]=3 100 B19R3.3013123 Oc1cccc2c1c(c[nH]2)CN[C@H]3C[C@H](C3)O AIFCHEM-6399438792 [1,1,0,0,0,0|1,0,0]=3 101 B19R3.54015 CN(C(=O)c1coc2c1cccc2)C3CCC3 AIFCHEM-5756498812 [1,1,0,0,0,0|1,0,1]=4 102 B19R3.58650 O=C(NC1CCC1)c2coc3c2ccc(c3)F AIFCHEM-94537770763 [1,1,0,0,0,0|1,0,1]=4 103 B21R3.4794638 CC(NC[C@H]1C[C@H](C1)O)c2cnc3n2cc(cc3)Br AIFCHEM-94587194904 [0,1,0,0,0,1|2,0,0]=4 104 B21R3.4794638 CC(NC[C@H]1C[C@H](C1)O)c2n[nH]c3c2cc(cc3)Br AIFCHEM-94587197882 [0,1,0,0,0,1|2,0,0]=4 105 B21R3.2568530 CC(Cc1c[nH]c2c1cccc2)NC3CC(C3)(C)C AIFCHEM-94550351418 [0,1,0,0,0,1|2,0,0]=4 106 B21R3.240009 CC(N[C@H]1C[C@@H](C1)F)c2ccc3ccccc3c2O AIFCHEM-94552137348 [0,1,0,0,0,1|2,0,0]=4 107 B21R3.240009 CC(N[C@H]1C[C@@H](C1)O)c2ccc3ccccc3c2O AIFCHEM-94552135313 [0,1,0,0,0,1|1,0,0]=3 108 B21R3.240009 CC(N[C@H]1C[C@H](C1)F)c2ccc3ccccc3c2O AIFCHEM-94552137347 [0,1,0,0,0,1|2,0,0]=4 109 B21R3.240009 CC(N[C@H]1C[C@H](C1)O)c2ccc3ccccc3c2O AIFCHEM-94552135615 [0,1,0,0,0,1|1,0,0]=3 110 B21R3.824267 CC(N[C@H]1C[C@H](C1)CO)c2cnc3ccccc3c2 AIFCHEM-6442184617 [0,1,0,0,0,1|1,0,0]=3 111 B21R3.3839484 CC1CC(C1)NC(C)c2ccc3cc(ccc3c2)Br AIFCHEM-6153634189 [0,1,0,0,0,1|2,0,0]=4 112 B21R3.7997554 CC(NC1CC(C1)(C)C)c2ccc3ccccc3c2 AIFCHEM-94566880103 [0,1,0,0,0,1|2,0,0]=4 113 B21R3.7997554 CC(N[C@H]1C[C@@](C1)(C)O)c2ccc3cccnc3c2 AIFCHEM-6495029492 [0,1,0,0,0,1|2,0,0]=4 114 B21R3.7997554 C[C@@H](NC1CC(C1)(C)C)c2ccc3ccccc3c2 AIFCHEM-94566888048 [0,1,0,0,0,1|2,0,0]=4 115 B21R3.7997554 C[C@H](NC1CC(C1)(C)C)c2ccc3ccccc3c2 AIFCHEM-94566887011 [0,1,0,0,0,1|2,0,0]=4 116 B21R3.7116781 CC(N[C@H]1C[C@H](C1)O)c2ccc(c3c2cccc3)Br AIFCHEM-6417110534 [0,1,0,0,0,1|1,0,0]=3 117 B21R3.824268 COC1CC(C1)NC(=O)c2coc3c2cccc3Cl AIFCHEM-6031060662 [0,2,0,0,0,0|1,0,1]=4 118 B21R3.824268 COC1CC(C1)NC(=O)c2coc3c2cccc3F AIFCHEM-6030881890 [0,2,0,0,0,0|1,0,1]=4 119 B21R3.824268 CO[C@H]1C[C@@H](C1)NC(=O)c2coc3c2cccc3Cl AIFCHEM-5716890310 [0,2,0,0,0,0|1,0,1]=4 120 B21R3.824268 CO[C@H]1C[C@@H](C1)NC(=O)c2coc3c2cccc3F AIFCHEM-5733579166 [0,2,0,0,0,0|1,0,1]=4 121 B21R3.824268 CO[C@H]1C[C@H](C1)NC(=O)c2coc3c2cccc3Cl AIFCHEM-6185720227 [0,2,0,0,0,0|1,0,1]=4 122 B21R3.824268 CO[C@H]1C[C@H](C1)NC(=O)c2coc3c2cccc3F AIFCHEM-6106794413 [0,2,0,0,0,0|1,0,1]=4 123 B21R3.1285993 CC(N[C@H]1C[C@H](C1)CO)c2n[nH]c3c2cc(cc3)Br AIFCHEM-6466265038 [0,2,0,0,0,0|2,0,0]=4 124 B21R3.1285993 CO[C@H]1C[C@@H](C1)NC(C)c2csc3c2cc(cc3)Br AIFCHEM-5702803788 [0,2,0,0,0,0|0,1,0]=3 125 B21R3.1285993 CO[C@H]1C[C@@H](C1)NC(C)c2n[nH]c3c2cc(cc3)Br AIFCHEM-5764579330 [0,2,0,0,0,0|2,0,0]=4 126 B21R3.1285993 CO[C@H]1C[C@H](C1)NC(C)c2csc3c2cc(cc3)Br AIFCHEM-6143223903 [0,2,0,0,0,0|0,1,0]=3 127 B21R3.1285993 CO[C@H]1C[C@H](C1)NC(C)c2n[nH]c3c2cc(cc3)Br AIFCHEM-6130243297 [0,2,0,0,0,0|2,0,0]=4 128 B21R3.60691528 COC1CC(C1)NC(=O)c2coc3c2ccc(c3)C AIFCHEM-6051954653 [0,2,0,0,0,0|1,0,1]=4 129 B21R3.60691528 CO[C@H]1C[C@@H](C1)NC(=O)c2coc3c2ccc(c3)C AIFCHEM-5781125429 [0,2,0,0,0,0|1,0,1]=4 130 B21R3.60691528 CO[C@H]1C[C@H](C1)NC(=O)c2coc3c2ccc(c3)C AIFCHEM-6185624929 [0,2,0,0,0,0|1,0,1]=4 131 B21R3.28389215 CC(N[C@H]1C[C@@](C1)(C)O)c2n[nH]c3c2cc(cc3)Br AIFCHEM-6492350539 [0,2,0,0,0,0|2,0,0]=4 132 B17R2.5233 CC(COc1ccccc1)NC2CC(C2)F AIFCHEM-94604158947 [0,0,1,0,1,0|1,0,1]=4 133 B17R2.5233 CC(COc1ccccc1)N[C@H]2C[C@@H](C2)F AIFCHEM-94604159936 [0,0,1,0,1,0|1,0,1]=4 134 B17R2.5233 CC(COc1ccccc1)N[C@H]2C[C@H](C2)F AIFCHEM-94604159935 [0,0,1,0,1,0|1,0,1]=4 135 B17R2.5233 CC(CSc1ccccc1)NC2CC(C2)O AIFCHEM-94597694827 [0,0,1,0,1,0|0,1,1]=4 136 B17R2.5233 CC(CSc1ccccc1)N[C@H]2C[C@@H](C2)O AIFCHEM-94575230665 [0,0,1,0,1,0|0,1,1]=4 137 B17R2.5233 CC(CSc1ccccc1)N[C@H]2C[C@H](C2)O AIFCHEM-94575230967 [0,0,1,0,1,0|0,1,1]=4 138 B17R3.117 C[C@@H]1C[C@H]1NCc2coc3c2cccc3 AIFCHEM-94559009363 [1,0,0,0,1,0|1,0,0]=3 139 B17R3.117 FC1CC1NCc2coc3c2cccc3 AIFCHEM-94597361291 [1,0,0,0,1,0|1,0,0]=3 140 B17R3.117 F[C@@H]1C[C@H]1NCc2coc3c2cccc3 AIFCHEM-5880908672 [1,0,0,0,1,0|1,0,0]=3 141 B17R3.117 F[C@H]1C[C@@H]1NCc2coc3c2cccc3 AIFCHEM-94589283399 [1,0,0,0,1,0|1,0,0]=3 142 B17R3.117 F[C@H]1C[C@H]1NCc2coc3c2cccc3 AIFCHEM-6010836042 [1,0,0,0,1,0|1,0,0]=3 143 B17R3.3334 OC1CC(C1)Nc2csc3c2nccc3 AIFCHEM-6115540387 [1,0,0,0,1,0|1,1,0]=4 144 B17R3.3334 OC1CN(C1)Cc2c[nH]c3c2cccc3 AIFCHEM-94597188955 [1,0,0,0,1,0|2,0,0]=4 145 B17R3.3334 OC1CN(C1)Cc2coc3c2cccc3 AIFCHEM-6445262859 [1,0,0,0,1,0|1,0,0]=3 146 B17R3.9637 O=C(NC1CC1)c2coc3c2cccc3 AIFCHEM-6145371273 [1,0,0,0,1,0|1,0,1]=4 147 B19R2.197 CC(C)CCNC(C)Cc1c[nH]c2c1cccc2 AIFCHEM-94550359849 [0,0,1,0,0,1|2,0,0]=4 148 B19R2.112185 CC(NCC[C@H](C)O)c1ccc2ncccc2c1 AIFCHEM-94544715642 [0,0,1,0,0,1|2,0,0]=4 149 B19R2.112185 CC(O)CCNC(C)c1ccc2ncccc2c1 AIFCHEM-94577737376 [0,0,1,0,0,1|2,0,0]=4 150 B19R2.6045422 CC(NCC[C@H](C)O)c1nccc2c1cccc2 AIFCHEM-94544714839 [0,0,1,0,0,1|1,0,0]=3 151 B19R2.6045422 CC(O)CCNC(C)c1nccc2c1cccc2 AIFCHEM-94577736573 [0,0,1,0,0,1|1,0,0]=3 152 B19R2.183701 COc1ccccc1CC(C)NC[C@H]2C[C@H](C2)O AIFCHEM-94587196007 [0,0,1,0,0,1|0,0,2]=4 153 B19R3.5939 FC1CC(C1)NCc2cccc3c2cccc3 AIFCHEM-6175558165 [1,0,0,0,0,1|2,0,0]=4 154 B19R3.5939 FC1CC(C1)NCc2ccnc3c2cccc3 AIFCHEM-6175747832 [1,0,0,0,0,1|2,0,0]=4 155 B19R3.5939 F[C@H]1C[C@@H](C1)NCc2cccc3c2cccc3 AIFCHEM-5979109519 [1,0,0,0,0,1|2,0,0]=4 156 B19R3.5939 F[C@H]1C[C@@H](C1)NCc2ccnc3c2cccc3 AIFCHEM-5889207623 [1,0,0,0,0,1|2,0,0]=4 157 B19R3.5939 F[C@H]1C[C@H](C1)NCc2cccc3c2cccc3 AIFCHEM-5939852335 [1,0,0,0,0,1|2,0,0]=4 158 B19R3.5939 F[C@H]1C[C@H](C1)NCc2ccnc3c2cccc3 AIFCHEM-5947472906 [1,0,0,0,0,1|2,0,0]=4 159 B19R3.5939 OC1CC(C1)NCc2ccnc3c2cccc3 AIFCHEM-6466416609 [1,0,0,0,0,1|1,0,0]=3 160 B19R3.5939 O[C@H]1C[C@@H](C1)NCc2ccnc3c2cccc3 AIFCHEM-6493404271 [1,0,0,0,0,1|1,0,0]=3 161 B19R3.5939 O[C@H]1C[C@H](C1)NCc2ccnc3c2cccc3 AIFCHEM-6478329157 [1,0,0,0,0,1|1,0,0]=3 162 B19R3.5948 O[C@H]1C[C@H](C1)CNCc2c[nH]c3c2cccc3 AIFCHEM-94587195838 [1,0,0,0,0,1|1,0,0]=3 163 B19R3.5948 O[C@H]1C[C@H](C1)CNCc2c[nH]c3c2cccn3 AIFCHEM-94587195767 [1,0,0,0,0,1|2,0,0]=4 164 B19R3.5948 O[C@H]1C[C@H](C1)CNCc2c[nH]c3c2nccc3 AIFCHEM-94587194730 [1,0,0,0,0,1|2,0,0]=4 165 B19R3.92158 CC1CC(C1)NCc2ccc3ccccc3n2 AIFCHEM-6177416299 [1,0,0,0,0,1|2,0,0]=4 166 B19R3.92158 FC1CC(C1)NCc2cnc3ccccc3c2 AIFCHEM-6175631002 [1,0,0,0,0,1|2,0,0]=4 167 B19R3.92158 F[C@H]1C[C@@H](C1)NCc2cnc3ccccc3c2 AIFCHEM-5913184902 [1,0,0,0,0,1|2,0,0]=4 168 B19R3.92158 F[C@H]1C[C@H](C1)NCc2cnc3ccccc3c2 AIFCHEM-5947241585 [1,0,0,0,0,1|2,0,0]=4 169 B19R3.92158 OC1CC(C1)NCC2COc3ccccc3C2 AIFCHEM-5986763479 [1,0,0,0,0,1|0,0,2]=4 170 B19R3.48688 O=C(NCC1CCC1)c2coc3c2cccc3 AIFCHEM-5777933156 [1,0,0,0,0,1|1,0,1]=4 171 B19R3.202552 CC(NC1CCC1)c2cc3ccccc3cn2 AIFCHEM-94537768491 [1,0,0,0,0,1|2,0,0]=4 172 B19R3.202552 CC(NC1CCC1)c2cnc3ccccc3c2 AIFCHEM-94537765461 [1,0,0,0,0,1|1,0,0]=3 173 B19R3.202574 O=C(Cc1coc2c1cccc2)NC3CCC3 AIFCHEM-5766511712 [1,0,0,0,0,1|1,0,1]=4 174 B19R3.5202 CC(Cc1c[nH]c2c1cccc2)NC3CC3F AIFCHEM-94550351617 [0,0,0,0,1,1|2,0,0]=4 175 B19R3.5202 CC(Cc1c[nH]c2c1cccc2)N[C@@H]3C[C@@H]3F AIFCHEM-94550352417 [0,0,0,0,1,1|2,0,0]=4 176 B19R3.5202 CC(Cc1c[nH]c2c1cccc2)N[C@@H]3C[C@H]3C AIFCHEM-94550364874 [0,0,0,0,1,1|2,0,0]=4 177 B19R3.5202 CC(Cc1c[nH]c2c1cccc2)N[C@@H]3C[C@H]3F AIFCHEM-94550349585 [0,0,0,0,1,1|2,0,0]=4 178 B19R3.5202 CC(Cc1c[nH]c2c1cccc2)N[C@H]3C[C@@H]3F AIFCHEM-94589280044 [0,0,0,0,1,1|2,0,0]=4 179 B19R3.5202 CC(Cc1c[nH]c2c1cccc2)N[C@H]3C[C@H]3F AIFCHEM-94550352416 [0,0,0,0,1,1|2,0,0]=4 180 B19R3.72077 CC(N[C@@H]1C[C@H]1C)c2cnc3ccccc3c2 AIFCHEM-94559008642 [0,0,0,0,1,1|2,0,0]=4 181 B21R3.7509 CC(Cc1c[nH]c2c1cccc2)N[C@@H]3CC[C@@H](C3)O AIFCHEM-94550351172 [0,0,0,0,0,2|1,0,0]=3 182 B21R3.7509 CC(Cc1c[nH]c2c1cccc2)N[C@@H]3CC[C@H](C3)O AIFCHEM-94571551997 [0,0,0,0,0,2|1,0,0]=3 183 B21R3.7509 CC(Cc1c[nH]c2c1cccc2)N[C@H]3CC[C@@H](C3)O AIFCHEM-94579663164 [0,0,0,0,0,2|1,0,0]=3 184 B21R3.7509 CC(Cc1c[nH]c2c1cccc2)N[C@H]3CC[C@H](C3)O AIFCHEM-94550349406 [0,0,0,0,0,2|1,0,0]=3 185 B21R3.144107 CC(N[C@@H]1CC[C@H](C1)O)c2cccc3c2nccc3 AIFCHEM-94571555865 [0,0,0,0,0,2|2,0,0]=4 186 B21R3.144107 CC(N[C@H]1CC[C@@H](C1)O)c2cccc3c2nccc3 AIFCHEM-94579667032 [0,0,0,0,0,2|2,0,0]=4 187 B21R3.144107 CC(N[C@H]1CC[C@H](C1)O)c2cccc3c2nccc3 AIFCHEM-94590353253 [0,0,0,0,0,2|2,0,0]=4 188 B21R3.144107 CC1CCC(C1)NC(C)c2cccc3c2cccc3 AIFCHEM-94545924316 [0,0,0,0,0,2|2,0,0]=4 189 B21R3.144107 CC1CCC(C1)N[C@@H](C)c2cccc3c2cccc3 AIFCHEM-94572222842 [0,0,0,0,0,2|2,0,0]=4 190 B21R3.144107 CC1CCC(C1)N[C@H](C)c2cccc3c2cccc3 AIFCHEM-94545923774 [0,0,0,0,0,2|2,0,0]=4 191 B21R3.238909 CC(NC[C@H]1C[C@H](C1)O)c2ccc3ccccc3c2 AIFCHEM-94587198158 [0,0,0,0,0,2|1,0,0]=3 192 B21R3.238909 CC(NC[C@H]1C[C@H](C1)O)c2cnc3ccccc3n2 AIFCHEM-6445228502 [0,0,0,0,0,2|1,0,0]=3 193 B21R3.239882 CC(CCc1c[nH]c2c1cccc2)NC3CC(C3)F AIFCHEM-6105336632 [0,0,0,0,0,2|2,0,0]=4 194 B21R3.239882 CC(CCc1c[nH]c2c1cccc2)NC3CC(C3)O AIFCHEM-6451012806 [0,0,0,0,0,2|1,0,0]=3 195 B21R3.239882 CC(CCc1c[nH]c2c1cccc2)N[C@H]3C[C@@H](C3)F AIFCHEM-5891106045 [0,0,0,0,0,2|2,0,0]=4 196 B21R3.239882 CC(CCc1c[nH]c2c1cccc2)N[C@H]3C[C@@H](C3)O AIFCHEM-6493719016 [0,0,0,0,0,2|1,0,0]=3 197 B21R3.239882 CC(CCc1c[nH]c2c1cccc2)N[C@H]3C[C@H](C3)F AIFCHEM-5960289403 [0,0,0,0,0,2|2,0,0]=4 198 B21R3.239882 CC(CCc1c[nH]c2c1cccc2)N[C@H]3C[C@H](C3)O AIFCHEM-6462949770 [0,0,0,0,0,2|1,0,0]=3