0 B14R1.863 CCC(C)CNc1ncccc1OC AIFCHEM-5767357401 [0,0,0,0,0,0|4,0,0]=4 1 B14R1.863 COc1ccccc1CNC(=O)CO AIFCHEM-5640000018 [0,0,0,0,0,0|2,0,2]=4 2 B14R1.863 COc1ccccc1NCC(O)CO AIFCHEM-5686657764 [0,0,0,0,0,0|1,0,0]=1 3 B14R1.863 COc1ccccc1NC[C@H](O)CO AIFCHEM-94546767210 [0,0,0,0,0,0|1,0,0]=1 4 B14R1.863 COc1cnccc1NCC(O)CO AIFCHEM-5814693832 [0,0,0,0,0,0|2,0,0]=2 5 B14R1.863 COc1cnccc1NC[C@H](O)CO AIFCHEM-94590565333 [0,0,0,0,0,0|2,0,0]=2 6 B14R1.863 COc1ncccc1NCC(O)CO AIFCHEM-5841490351 [0,0,0,0,0,0|2,0,0]=2 7 B14R1.863 COc1ncccc1NC[C@H](O)CO AIFCHEM-94590560851 [0,0,0,0,0,0|2,0,0]=2 8 B14R1.863 CSc1ccccc1CNC(C)CO AIFCHEM-6470000593 [0,0,0,0,0,0|3,1,0]=4 9 B14R1.863 CSc1ccccc1CN[C@@H](C)CO AIFCHEM-6438039607 [0,0,0,0,0,0|3,1,0]=4 10 B14R1.863 CSc1ccccc1CN[C@H](C)CO AIFCHEM-6452887365 [0,0,0,0,0,0|3,1,0]=4 11 B14R1.863 N#Cc1ccccc1NCC(O)CO AIFCHEM-6035373853 [0,0,0,0,0,0|3,0,0]=3 12 B14R1.863 OCc1ccccc1NCC(O)CO AIFCHEM-6496272613 [0,0,0,0,0,0|3,0,0]=3 13 B14R1.863 OCc1ccccc1NC[C@H](O)CO AIFCHEM-94590565487 [0,0,0,0,0,0|3,0,0]=3 14 B14R1.863 OCc1ncccc1NCC(O)CO AIFCHEM-6053227603 [0,0,0,0,0,0|4,0,0]=4 15 B14R1.863 OCc1ncccc1NC[C@H](O)CO AIFCHEM-94590565335 [0,0,0,0,0,0|4,0,0]=4 16 B13R1.84 CCCCNc1cccnc1OC AIFCHEM-94523034232 [1,0,0,0,0,0|3,0,0]=4 17 B13R1.84 CCc1ccccc1CNCCO AIFCHEM-94577777688 [1,0,0,0,0,0|3,0,0]=4 18 B13R1.84 COc1ccccc1CNCCO AIFCHEM-6431947357 [1,0,0,0,0,0|2,0,0]=3 19 B13R1.84 COc1cccnc1CNCCO AIFCHEM-94577777147 [1,0,0,0,0,0|3,0,0]=4 20 B13R1.90 CCc1ccccc1NCC(C)C AIFCHEM-94572982446 [1,0,0,0,0,0|3,0,0]=4 21 B13R1.90 COc1ccccc1CNC(C)C AIFCHEM-94520537483 [1,0,0,0,0,0|3,0,0]=4 22 B13R1.90 COc1ccccc1NCC(C)C AIFCHEM-94572986127 [1,0,0,0,0,0|2,0,0]=3 23 B13R1.90 CSc1ccccc1C=CC(C)O AIFCHEM-6341944588 [1,0,0,0,0,0|1,1,1]=4 24 B13R1.90 CSc1ccccc1NCC(C)C AIFCHEM-94572979236 [1,0,0,0,0,0|2,1,0]=4 25 B13R1.528 CC(CO)NCc1ccccc1O AIFCHEM-94532467701 [1,0,0,0,0,0|3,0,0]=4 26 B13R1.528 CCC(C)CNc1ccccc1C AIFCHEM-94578148230 [1,0,0,0,0,0|3,0,0]=4 27 B13R1.528 C[C@@H](CO)NCc1ccccc1O AIFCHEM-94532463697 [1,0,0,0,0,0|3,0,0]=4 28 B13R1.528 C[C@H](CO)NCc1ccccc1O AIFCHEM-94532464764 [1,0,0,0,0,0|3,0,0]=4 29 B13R1.528 Cc1ncccc1NC[C@H](O)CO AIFCHEM-94590563391 [1,0,0,0,0,0|2,0,0]=3 30 B15R1.87 COc1ccccc1CNC(C)C(C)O AIFCHEM-94547074648 [0,1,0,0,0,0|3,0,0]=4 31 B15R1.273 CCOc1ccccc1CNC(C)CO AIFCHEM-6463297465 [0,1,0,0,0,0|3,0,0]=4 32 B15R1.273 CCOc1ccccc1CN[C@@H](C)CO AIFCHEM-6463583392 [0,1,0,0,0,0|3,0,0]=4 33 B15R1.273 CCOc1ccccc1CN[C@H](C)CO AIFCHEM-6395097866 [0,1,0,0,0,0|3,0,0]=4 34 B15R1.273 CCOc1ccccc1NCC(C)CC AIFCHEM-5636667893 [0,1,0,0,0,0|3,0,0]=4 35 B15R1.273 CCOc1ccccc1NCC(O)CO AIFCHEM-94545028663 [0,1,0,0,0,0|1,0,0]=2 36 B15R1.273 CCOc1ccccc1NC[C@H](O)CO AIFCHEM-94590570295 [0,1,0,0,0,0|1,0,0]=2 37 B15R1.273 OCCc1ccccc1NC[C@H](O)CO AIFCHEM-94590565479 [0,1,0,0,0,0|2,0,0]=3 38 B15R1.768 COCC(C)NCc1ccccc1OC AIFCHEM-6054894737 [0,1,0,0,0,0|3,0,0]=4 39 B15R1.768 COC[C@@H](C)NCc1ccccc1OC AIFCHEM-5748588201 [0,1,0,0,0,0|3,0,0]=4 40 B15R1.768 COC[C@H](C)NCc1ccccc1OC AIFCHEM-5603899939 [0,1,0,0,0,0|3,0,0]=4 41 B15R1.768 COc1ccccc1CCN(C)CCO AIFCHEM-6390261121 [0,1,0,0,0,0|3,0,0]=4 42 B15R1.1146 CCC(CO)NCc1ccccc1OC AIFCHEM-6440086826 [0,1,0,0,0,0|3,0,0]=4 43 B15R1.1146 CC[C@@H](CO)NCc1ccccc1OC AIFCHEM-6505572370 [0,1,0,0,0,0|3,0,0]=4 44 B15R1.1146 CC[C@H](CO)NCc1ccccc1OC AIFCHEM-6439261370 [0,1,0,0,0,0|3,0,0]=4 45 B15R1.1146 COc1cnccc1CNC(CO)CO AIFCHEM-6436235013 [0,1,0,0,0,0|3,0,0]=4 46 B15R1.1147 COc1ccccc1NC(=O)C(O)CO AIFCHEM-94546776032 [0,1,0,0,0,0|1,0,1]=3 47 B15R1.1646 COc1cccc(c1CNC(C)CO)F AIFCHEM-94607068821 [0,1,0,0,0,0|3,0,0]=4 48 B15R1.1646 COc1cccc(c1CNC(C)CO)O AIFCHEM-6463306266 [0,1,0,0,0,0|3,0,0]=4 49 B15R1.1646 COc1cccc(c1CN[C@@H](C)CO)F AIFCHEM-6437081189 [0,1,0,0,0,0|3,0,0]=4 50 B15R1.1646 COc1cccc(c1CN[C@@H](C)CO)O AIFCHEM-6433378494 [0,1,0,0,0,0|3,0,0]=4 51 B15R1.1646 COc1cccc(c1CN[C@H](C)CO)F AIFCHEM-6395904901 [0,1,0,0,0,0|3,0,0]=4 52 B15R1.1646 COc1cccc(c1CN[C@H](C)CO)O AIFCHEM-6394927430 [0,1,0,0,0,0|3,0,0]=4 53 B15R1.1646 Cc1cccc(c1NCC(O)CO)CO AIFCHEM-6393859126 [0,1,0,0,0,0|3,0,0]=4 54 B15R1.4545 COc1cccnc1NCC(C)(C)CO AIFCHEM-5722874005 [0,1,0,0,0,0|3,0,0]=4 55 B15R1.4545 COc1ccncc1NCC(C)(C)CO AIFCHEM-5989775836 [0,1,0,0,0,0|3,0,0]=4 56 B15R1.4545 CSc1ccccc1NCC(C)(C)CO AIFCHEM-5838394210 [0,1,0,0,0,0|2,1,0]=4 57 B15R1.4804 CCC(C)CNc1cccc(c1OC)C AIFCHEM-6158682036 [0,1,0,0,0,0|3,0,0]=4 58 B15R1.4804 COc1c(cccc1CNC(C)CO)Br AIFCHEM-6411706193 [0,1,0,0,0,0|3,0,0]=4 59 B15R1.4804 COc1c(cccc1CN[C@@H](C)CO)Br AIFCHEM-6463484158 [0,1,0,0,0,0|3,0,0]=4 60 B15R1.4804 COc1c(cccc1CN[C@H](C)CO)Br AIFCHEM-6452846103 [0,1,0,0,0,0|3,0,0]=4 61 B15R1.4804 COc1c(cccc1NC[C@H](O)CO)F AIFCHEM-94590564588 [0,1,0,0,0,0|1,0,0]=2 62 B15R1.4804 COc1c(ccnc1Cl)NCC(O)CO AIFCHEM-6335939358 [0,1,0,0,0,0|2,0,0]=3 63 B15R1.4804 COc1c(ccnc1Cl)NC[C@H](O)CO AIFCHEM-94590556515 [0,1,0,0,0,0|2,0,0]=3 64 B15R1.4804 COc1c(ccnc1NCC(O)CO)Cl AIFCHEM-5678414474 [0,1,0,0,0,0|2,0,0]=3 65 B15R1.4804 Cc1cccc(c1CO)NCC(O)CO AIFCHEM-6466034927 [0,1,0,0,0,0|3,0,0]=4 66 B15R1.12623 COc1ccccc1C(C)NC(C)CO AIFCHEM-6103531864 [0,1,0,0,0,0|3,0,0]=4 67 B15R1.12623 COc1ccccc1[C@@H](C)NC(C)CO AIFCHEM-94562213624 [0,1,0,0,0,0|3,0,0]=4 68 B15R1.12623 COc1ccccc1[C@H](C)NC(C)CO AIFCHEM-5985263527 [0,1,0,0,0,0|3,0,0]=4 69 B15R1.12847 CCC(C)CNc1cc(ccc1OC)F AIFCHEM-5878997349 [0,1,0,0,0,0|3,0,0]=4 70 B15R1.12847 CCC(C)CNc1cc(ccc1OC)I AIFCHEM-5848309413 [0,1,0,0,0,0|3,0,0]=4 71 B15R1.12847 COc1ccc(cc1CNC(C)CO)C AIFCHEM-6470240462 [0,1,0,0,0,0|3,0,0]=4 72 B15R1.12847 COc1ccc(cc1CNC(C)CO)I AIFCHEM-6463163995 [0,1,0,0,0,0|3,0,0]=4 73 B15R1.12847 COc1ccc(cc1CN[C@@H](C)CO)C AIFCHEM-6446577398 [0,1,0,0,0,0|3,0,0]=4 74 B15R1.12847 COc1ccc(cc1CN[C@@H](C)CO)I AIFCHEM-6446443457 [0,1,0,0,0,0|3,0,0]=4 75 B15R1.12847 COc1ccc(cc1CN[C@H](C)CO)C AIFCHEM-6396013245 [0,1,0,0,0,0|3,0,0]=4 76 B15R1.12847 COc1ccc(cc1CN[C@H](C)CO)I AIFCHEM-6477087454 [0,1,0,0,0,0|3,0,0]=4 77 B15R1.12847 COc1cnc(cc1NCC(O)CO)Br AIFCHEM-6334269059 [0,1,0,0,0,0|2,0,0]=3 78 B15R1.12847 COc1cnc(cc1NC[C@H](O)CO)Br AIFCHEM-94590558242 [0,1,0,0,0,0|2,0,0]=3 79 B15R1.13065 COc1cc(ccc1CNC(C)CO)O AIFCHEM-6389560748 [0,1,0,0,0,0|3,0,0]=4 80 B15R1.13065 COc1cc(ccc1CN[C@@H](C)CO)O AIFCHEM-6436584409 [0,1,0,0,0,0|3,0,0]=4 81 B15R1.13065 COc1cc(ccc1CN[C@H](C)CO)O AIFCHEM-6394768187 [0,1,0,0,0,0|3,0,0]=4 82 B15R1.13065 COc1cc(ccc1NCC(O)CO)Cl AIFCHEM-5595143552 [0,1,0,0,0,0|1,0,0]=2 83 B15R1.13065 COc1cc(ccc1NCC(O)CO)O AIFCHEM-5931070569 [0,1,0,0,0,0|1,0,0]=2 84 B15R1.13065 COc1cc(ccc1NC[C@H](O)CO)Cl AIFCHEM-94590569040 [0,1,0,0,0,0|1,0,0]=2 85 B15R1.13065 COc1cc(cnc1NCC(O)CO)F AIFCHEM-6043619536 [0,1,0,0,0,0|2,0,0]=3 86 B15R1.13065 COc1nc(ccc1NCC(O)CO)Cl AIFCHEM-6301583818 [0,1,0,0,0,0|2,0,0]=3 87 B15R1.13065 COc1nc(ccc1NC[C@H](O)CO)Cl AIFCHEM-94590569952 [0,1,0,0,0,0|2,0,0]=3 88 B15R1.13065 COc1nc(ncc1NCC(O)CO)C AIFCHEM-5769179414 [0,1,0,0,0,0|3,0,0]=4 89 B15R1.13065 COc1nc(ncc1NC[C@H](O)CO)C AIFCHEM-94590565426 [0,1,0,0,0,0|3,0,0]=4 90 B15R1.13065 OCc1cc(ccc1NCC(O)CO)Br AIFCHEM-6485088633 [0,1,0,0,0,0|3,0,0]=4 91 B15R1.13065 OCc1cc(ccc1NCC(O)CO)F AIFCHEM-6503813470 [0,1,0,0,0,0|3,0,0]=4 92 B15R1.13065 OCc1cc(ccc1NC[C@H](O)CO)Br AIFCHEM-94590561000 [0,1,0,0,0,0|3,0,0]=4 93 B15R1.13065 OCc1cc(ccc1NC[C@H](O)CO)F AIFCHEM-94590568008 [0,1,0,0,0,0|3,0,0]=4 94 B13R1.91 CCc1ccccc1NC(C)CO AIFCHEM-94590679936 [0,0,0,0,1,0|3,0,0]=4 95 B13R1.91 COc1ncccc1NC(C)CO AIFCHEM-5823866935 [0,0,0,0,1,0|3,0,0]=4 96 B15R1.85 CCC(O)CNCc1cnccc1OC AIFCHEM-6419782884 [0,0,0,0,0,1|3,0,0]=4 97 B15R1.85 CC[C@@H](O)CNCc1cnccc1OC AIFCHEM-6437578796 [0,0,0,0,0,1|3,0,0]=4 98 B15R1.85 CCc1ccccc1CNCC(O)CO AIFCHEM-6480530176 [0,0,0,0,0,1|2,0,0]=3 99 B15R1.85 CCc1ccccc1CNC[C@@H](O)CO AIFCHEM-6392779595 [0,0,0,0,0,1|2,0,0]=3 100 B15R1.85 CCc1ccccc1CNC[C@H](O)CO AIFCHEM-6452748697 [0,0,0,0,0,1|2,0,0]=3 101 B15R1.85 COc1ccccc1CCNC(C)CF AIFCHEM-6128933789 [0,0,0,0,0,1|3,0,0]=4 102 B15R1.85 COc1ccccc1CCN[C@@H](C)CF AIFCHEM-6011669217 [0,0,0,0,0,1|3,0,0]=4 103 B15R1.85 COc1ccccc1CNC[C@@H](F)CO AIFCHEM-6416741961 [0,0,0,0,0,1|2,0,0]=3 104 B15R1.85 COc1ccccc1CNC[C@H](F)CO AIFCHEM-94577436932 [0,0,0,0,0,1|2,0,0]=3 105 B15R1.85 COc1ncccc1CNCC(O)CO AIFCHEM-94589894929 [0,0,0,0,0,1|2,0,0]=3 106 B15R1.85 COc1ncccc1CNC[C@@H](O)CO AIFCHEM-6414461259 [0,0,0,0,0,1|2,0,0]=3 107 B15R1.85 COc1ncccc1CNC[C@H](O)CO AIFCHEM-94590563592 [0,0,0,0,0,1|2,0,0]=3 108 B15R1.85 CSc1ccccc1CNCC(C)CO AIFCHEM-94540295610 [0,0,0,0,0,1|2,1,0]=4 109 B12R1.121 CCCNc1ccccc1SC AIFCHEM-94569016982 [2,0,0,0,0,0|1,1,0]=4 110 B12R1.267 OCCNCc1ccccc1O AIFCHEM-94532459344 [2,0,0,0,0,0|2,0,0]=4 111 B14R1.461 CCCCNc1ccc(cc1OC)Br AIFCHEM-94523039638 [1,1,0,0,0,0|2,0,0]=4 112 B14R1.461 CCCCNc1ccc(cc1OC)O AIFCHEM-94523039889 [1,1,0,0,0,0|2,0,0]=4 113 B14R1.476 CCCCC=Cc1ccccc1OC AIFCHEM-6357744227 [1,1,0,0,0,0|2,0,0]=4 114 B14R1.476 CCc1ccccc1CNCCCO AIFCHEM-6421060687 [1,1,0,0,0,0|2,0,0]=4 115 B14R1.883 CCCCNc1cc(ccc1OC)F AIFCHEM-94523034047 [1,1,0,0,0,0|2,0,0]=4 116 B14R1.904 CCCCNc1ccccc1COC AIFCHEM-94575559696 [1,1,0,0,0,0|2,0,0]=4 117 B14R1.965 COc1ncccc1NC(C)CCO AIFCHEM-5803810722 [1,1,0,0,0,0|2,0,0]=4 118 B14R1.965 CSc1ccccc1NC(C)CCO AIFCHEM-5838080215 [1,1,0,0,0,0|1,1,0]=4 119 B14R1.3381 COc1cccc(c1CNCCO)O AIFCHEM-6432170833 [1,1,0,0,0,0|2,0,0]=4 120 B14R1.118 COc1c(cccc1NCC(C)C)C AIFCHEM-94572976482 [1,1,0,0,0,0|2,0,0]=4 121 B14R1.118 COc1c(cccc1NCC(C)C)Cl AIFCHEM-94572981597 [1,1,0,0,0,0|2,0,0]=4 122 B14R1.482 COCc1ccccc1NCC(C)C AIFCHEM-94575564542 [1,1,0,0,0,0|2,0,0]=4 123 B14R1.1600 COc1cc(ccc1C=CC(C)O)F AIFCHEM-6326931955 [1,1,0,0,0,0|1,0,1]=4 124 B14R1.1600 COc1cc(ccc1NCC(C)C)Br AIFCHEM-94572982662 [1,1,0,0,0,0|2,0,0]=4 125 B14R1.1600 COc1cc(ccc1NCC(C)C)I AIFCHEM-94572979752 [1,1,0,0,0,0|2,0,0]=4 126 B14R1.1600 COc1cc(ccc1NCC(C)C)O AIFCHEM-94572982913 [1,1,0,0,0,0|2,0,0]=4 127 B14R1.1865 COc1ccc(cc1NCC(C)C)Br AIFCHEM-94572983218 [1,1,0,0,0,0|2,0,0]=4 128 B14R1.1865 COc1ccc(cc1NCC(C)C)I AIFCHEM-94572984715 [1,1,0,0,0,0|2,0,0]=4 129 B14R1.3135 COc1ccccc1NC(=O)C(C)O AIFCHEM-94546777123 [1,1,0,0,0,0|1,0,1]=4 130 B14R1.3135 COc1ccccc1NC(=O)[C@@H](C)O AIFCHEM-94546770096 [1,1,0,0,0,0|1,0,1]=4 131 B14R1.3135 COc1ccccc1NC(=O)[C@H](C)O AIFCHEM-94546778120 [1,1,0,0,0,0|1,0,1]=4 132 B14R1.15 Cc1c(cccc1NCC(O)CO)Br AIFCHEM-6159997029 [1,1,0,0,0,0|1,0,0]=3 133 B14R1.15 Cc1c(cccc1NCC(O)CO)I AIFCHEM-5624370550 [1,1,0,0,0,0|1,0,0]=3 134 B14R1.15 Cc1c(cccc1NC[C@H](O)CO)Br AIFCHEM-94585200176 [1,1,0,0,0,0|1,0,0]=3 135 B14R1.15 OCC(O)CNc1cccc(c1O)Cl AIFCHEM-6197439829 [1,1,0,0,0,0|1,0,0]=3 136 B14R1.15 OC[C@@H](O)CNc1cccc(c1O)Cl AIFCHEM-94590563926 [1,1,0,0,0,0|1,0,0]=3 137 B14R1.387 OCC(CO)NCc1ccccc1O AIFCHEM-94543129437 [1,1,0,0,0,0|2,0,0]=4 138 B14R1.587 Cc1ccccc1N(C)CC(O)CO AIFCHEM-94586630193 [1,1,0,0,0,0|1,0,0]=3 139 B14R1.727 Cc1cc(ccc1NCC(O)CO)F AIFCHEM-6199844229 [1,1,0,0,0,0|1,0,0]=3 140 B14R1.727 Cc1cc(ccc1NC[C@H](O)CO)F AIFCHEM-94590566010 [1,1,0,0,0,0|1,0,0]=3 141 B14R1.727 Cc1cc(cnc1NCC(O)CO)Br AIFCHEM-6197642276 [1,1,0,0,0,0|2,0,0]=4 142 B14R1.727 Cc1cc(cnc1NC[C@H](O)CO)Br AIFCHEM-94590563394 [1,1,0,0,0,0|2,0,0]=4 143 B14R1.727 Cc1nc(ccc1NCC(O)CO)Br AIFCHEM-6289488961 [1,1,0,0,0,0|2,0,0]=4 144 B14R1.727 Cc1nc(ccc1NC[C@H](O)CO)Br AIFCHEM-94590557001 [1,1,0,0,0,0|2,0,0]=4 145 B14R1.727 OCC(O)CNc1ccc(cc1Br)O AIFCHEM-5950799257 [1,1,0,0,0,0|2,0,0]=4 146 B14R1.727 OCC(O)CNc1ccc(cc1Cl)Cl AIFCHEM-94582903328 [1,1,0,0,0,0|2,0,0]=4 147 B14R1.727 OCC(O)CNc1ccc(cc1Cl)I AIFCHEM-5645036996 [1,1,0,0,0,0|2,0,0]=4 148 B14R1.727 OCC(O)CNc1ccc(cc1Cl)O AIFCHEM-5979323815 [1,1,0,0,0,0|2,0,0]=4 149 B14R1.727 OCC(O)CNc1ccc(cc1I)Br AIFCHEM-6042333410 [1,1,0,0,0,0|2,0,0]=4 150 B14R1.727 OCC(O)CNc1ncc(cc1O)Br AIFCHEM-6276456259 [1,1,0,0,0,0|2,0,0]=4 151 B14R1.727 OC[C@@H](O)CNc1ccc(cc1Cl)Cl AIFCHEM-94590565763 [1,1,0,0,0,0|2,0,0]=4 152 B14R1.727 OC[C@@H](O)CNc1ccc(cc1I)Br AIFCHEM-94590567137 [1,1,0,0,0,0|2,0,0]=4 153 B14R1.727 OC[C@@H](O)CNc1ncc(cc1O)Br AIFCHEM-94590564141 [1,1,0,0,0,0|2,0,0]=4 154 B14R1.820 Cc1ccc(cc1NCC(O)CO)O AIFCHEM-5951729528 [1,1,0,0,0,0|1,0,0]=3 155 B14R1.820 Cc1cnc(cc1NCC(O)CO)Br AIFCHEM-6192277886 [1,1,0,0,0,0|2,0,0]=4 156 B14R1.820 Cc1cnc(cc1NCC(O)CO)Cl AIFCHEM-6437894100 [1,1,0,0,0,0|2,0,0]=4 157 B14R1.820 Cc1cnc(cc1NC[C@H](O)CO)Cl AIFCHEM-94590568416 [1,1,0,0,0,0|2,0,0]=4 158 B14R1.820 OCC(O)CNc1cc(ccc1F)F AIFCHEM-5726649407 [1,1,0,0,0,0|2,0,0]=4 159 B14R1.820 OCC(O)CNc1cc(ccc1F)O AIFCHEM-6143672429 [1,1,0,0,0,0|2,0,0]=4 160 B14R1.820 OCC(O)CNc1cc(ncc1O)Br AIFCHEM-6387144232 [1,1,0,0,0,0|2,0,0]=4 161 B14R1.19598 Cc1cccc(c1NCC(O)CO)O AIFCHEM-5669164939 [1,1,0,0,0,0|1,0,0]=3 162 B14R1.3136 CCc1ccccc1NC(CO)CO AIFCHEM-94590685987 [0,1,0,0,1,0|2,0,0]=4 163 B14R1.3417 COc1cc(ccc1NC(C)CO)O AIFCHEM-5942297535 [0,1,0,0,1,0|2,0,0]=4 164 B16R1.1368 COc1ncccc1NC[C@H](O)[C@H](O)CO AIFCHEM-5841660512 [0,1,0,0,0,1|2,0,0]=4 165 B16R1.1368 CSc1ccccc1NC[C@H](O)[C@H](O)CO AIFCHEM-5833464573 [0,1,0,0,0,1|1,1,0]=4 166 B16R1.4324 CCC(O)CNCc1cc(ccc1OC)F AIFCHEM-6479480964 [0,1,0,0,0,1|2,0,0]=4 167 B16R1.4324 CC[C@@H](O)CNCc1cc(ccc1OC)F AIFCHEM-6417111322 [0,1,0,0,0,1|2,0,0]=4 168 B16R1.4324 COc1ccc(cc1CNCC(C)CO)Br AIFCHEM-94540293084 [0,1,0,0,0,1|2,0,0]=4 169 B16R1.4324 COc1ccc(cc1CNC[C@@H](F)CO)Br AIFCHEM-6483533043 [0,1,0,0,0,1|2,0,0]=4 170 B16R1.4324 COc1ccc(cc1CNC[C@@H](F)CO)I AIFCHEM-6395012450 [0,1,0,0,0,1|2,0,0]=4 171 B16R1.4324 COc1ccc(cc1CNC[C@H](F)CO)Br AIFCHEM-94577438572 [0,1,0,0,0,1|2,0,0]=4 172 B16R1.4324 COc1ccc(cc1CNC[C@H](F)CO)I AIFCHEM-94577439638 [0,1,0,0,0,1|2,0,0]=4 173 B16R1.4324 COc1ncc(cc1CNCC(O)CO)C AIFCHEM-6404706094 [0,1,0,0,0,1|2,0,0]=4 174 B16R1.4324 COc1ncc(cc1CNC[C@@H](O)CO)C AIFCHEM-6414456643 [0,1,0,0,0,1|2,0,0]=4 175 B16R1.4324 COc1ncc(cc1CNC[C@H](O)CO)C AIFCHEM-6444433323 [0,1,0,0,0,1|2,0,0]=4 176 B16R1.4780 CCC(O)CNCc1ccc(cc1OC)F AIFCHEM-6401047411 [0,1,0,0,0,1|2,0,0]=4 177 B16R1.4780 CCC(O)CNCc1ccc(cc1OC)O AIFCHEM-6456886832 [0,1,0,0,0,1|2,0,0]=4 178 B16R1.4780 CC[C@@H](O)CNCc1ccc(cc1OC)F AIFCHEM-6435765464 [0,1,0,0,0,1|2,0,0]=4 179 B16R1.4780 CC[C@@H](O)CNCc1ccc(cc1OC)O AIFCHEM-6462445774 [0,1,0,0,0,1|2,0,0]=4 180 B16R1.4780 CCc1cc(ccc1CNCC(O)CO)Br AIFCHEM-6406044113 [0,1,0,0,0,1|2,0,0]=4 181 B16R1.4780 CCc1cc(ccc1CNC[C@@H](O)CO)Br AIFCHEM-6465013471 [0,1,0,0,0,1|2,0,0]=4 182 B16R1.4780 CCc1cc(ccc1CNC[C@H](O)CO)Br AIFCHEM-6468033350 [0,1,0,0,0,1|2,0,0]=4 183 B16R1.4780 COc1cc(ccc1CNCC(C)CO)Br AIFCHEM-94540294194 [0,1,0,0,0,1|2,0,0]=4 184 B16R1.4780 COc1cc(ccc1CNCC(C)CO)Cl AIFCHEM-94540294642 [0,1,0,0,0,1|2,0,0]=4 185 B16R1.4780 COc1cc(ccc1CNCC(O)CO)O AIFCHEM-6466383186 [0,1,0,0,0,1|1,0,0]=3 186 B16R1.4780 COc1cc(ccc1CNC[C@@H](F)CO)Cl AIFCHEM-6472363313 [0,1,0,0,0,1|2,0,0]=4 187 B16R1.4780 COc1cc(ccc1CNC[C@@H](F)CO)O AIFCHEM-6395369392 [0,1,0,0,0,1|2,0,0]=4 188 B16R1.4780 COc1cc(ccc1CNC[C@@H](O)CO)O AIFCHEM-6464804767 [0,1,0,0,0,1|1,0,0]=3 189 B16R1.4780 COc1cc(ccc1CNC[C@H](F)CO)Cl AIFCHEM-94577440130 [0,1,0,0,0,1|2,0,0]=4 190 B16R1.4780 COc1cc(ccc1CNC[C@H](F)CO)O AIFCHEM-94577437830 [0,1,0,0,0,1|2,0,0]=4 191 B16R1.4780 COc1cc(ccc1CNC[C@H](O)CO)O AIFCHEM-6427194500 [0,1,0,0,0,1|1,0,0]=3 192 B16R1.4780 COc1cc(ncc1CNCC(O)CO)Br AIFCHEM-6404948194 [0,1,0,0,0,1|2,0,0]=4 193 B16R1.4780 COc1cc(ncc1CNC[C@@H](O)CO)Br AIFCHEM-6392698047 [0,1,0,0,0,1|2,0,0]=4 194 B16R1.4780 COc1cc(ncc1CNC[C@H](O)CO)Br AIFCHEM-6444417344 [0,1,0,0,0,1|2,0,0]=4 195 B16R1.6227 CCC(O)CNCc1cccc(c1OC)Br AIFCHEM-6457042250 [0,1,0,0,0,1|2,0,0]=4 196 B16R1.6227 CCC(O)CNCc1cccc(c1OC)C AIFCHEM-6479566445 [0,1,0,0,0,1|2,0,0]=4 197 B16R1.6227 CCC(O)CNCc1cccc(c1OC)F AIFCHEM-6456843479 [0,1,0,0,0,1|2,0,0]=4 198 B16R1.6227 CC[C@@H](O)CNCc1cccc(c1OC)Br AIFCHEM-6417323634 [0,1,0,0,0,1|2,0,0]=4 199 B16R1.6227 CC[C@@H](O)CNCc1cccc(c1OC)C AIFCHEM-6435720069 [0,1,0,0,0,1|2,0,0]=4 200 B16R1.6227 CC[C@@H](O)CNCc1cccc(c1OC)F AIFCHEM-6437115924 [0,1,0,0,0,1|2,0,0]=4 201 B16R1.6227 COc1c(cccc1CNCC(O)CO)Br AIFCHEM-6480481460 [0,1,0,0,0,1|1,0,0]=3 202 B16R1.6227 COc1c(cccc1CNC[C@@H](F)CO)O AIFCHEM-6472433462 [0,1,0,0,0,1|2,0,0]=4 203 B16R1.6227 COc1c(cccc1CNC[C@@H](O)CO)Br AIFCHEM-6465025808 [0,1,0,0,0,1|1,0,0]=3 204 B16R1.6227 COc1c(cccc1CNC[C@H](F)CO)O AIFCHEM-94577440924 [0,1,0,0,0,1|2,0,0]=4 205 B16R1.6227 COc1c(cccc1CNC[C@H](O)CO)Br AIFCHEM-6467677665 [0,1,0,0,0,1|1,0,0]=3 206 B16R1.18660 COc1ccccc1CNCC(CO)OC AIFCHEM-6452408209 [0,1,0,0,0,1|1,0,0]=3 207 B16R1.19772 CCC(O)CNCc1c(cccc1OC)C AIFCHEM-6456826027 [0,1,0,0,0,1|2,0,0]=4 208 B16R1.19772 CCC(O)CNCc1c(cccc1OC)O AIFCHEM-6401123478 [0,1,0,0,0,1|2,0,0]=4 209 B16R1.19772 CC[C@@H](O)CNCc1c(cccc1OC)C AIFCHEM-6431419112 [0,1,0,0,0,1|2,0,0]=4 210 B16R1.19772 COc1cccc(c1CNCC(C)CO)O AIFCHEM-94540295599 [0,1,0,0,0,1|2,0,0]=4 211 B16R1.19772 COc1cccc(c1CNCC(O)CO)C AIFCHEM-6422109942 [0,1,0,0,0,1|1,0,0]=3 212 B16R1.19772 COc1cccc(c1CNCC(O)CO)F AIFCHEM-6105619431 [0,1,0,0,0,1|1,0,0]=3 213 B16R1.19772 COc1cccc(c1CNCC(O)CO)O AIFCHEM-6405667281 [0,1,0,0,0,1|1,0,0]=3 214 B16R1.19772 COc1cccc(c1CNC[C@@H](F)CO)O AIFCHEM-6466279121 [0,1,0,0,0,1|2,0,0]=4 215 B16R1.19772 COc1cccc(c1CNC[C@@H](O)CO)C AIFCHEM-6482422727 [0,1,0,0,0,1|1,0,0]=3 216 B16R1.19772 COc1cccc(c1CNC[C@@H](O)CO)F AIFCHEM-6464988171 [0,1,0,0,0,1|1,0,0]=3 217 B16R1.19772 COc1cccc(c1CNC[C@@H](O)CO)O AIFCHEM-6434257148 [0,1,0,0,0,1|1,0,0]=3 218 B16R1.19772 COc1cccc(c1CNC[C@H](F)CO)O AIFCHEM-94577441087 [0,1,0,0,0,1|2,0,0]=4 219 B16R1.19772 COc1cccc(c1CNC[C@H](O)CO)C AIFCHEM-6444433450 [0,1,0,0,0,1|1,0,0]=3 220 B16R1.19772 COc1cccc(c1CNC[C@H](O)CO)F AIFCHEM-6444377258 [0,1,0,0,0,1|1,0,0]=3 221 B16R1.19772 COc1cccc(c1CNC[C@H](O)CO)O AIFCHEM-6443362983 [0,1,0,0,0,1|1,0,0]=3 222 B16R1.30983 COc1ccccc1CNCC(F)(F)CO AIFCHEM-6468745612 [0,1,0,0,0,1|2,0,0]=4 223 B16R1.295 CCOc1ccccc1NC(=O)C(O)CO AIFCHEM-94545036928 [0,2,0,0,0,0|1,0,1]=4 224 B16R1.295 COCc1ccccc1NC(=O)C(O)CO AIFCHEM-94575571699 [0,2,0,0,0,0|1,0,1]=4 225 B16R1.994 CCCOc1ccccc1NCC(O)CO AIFCHEM-94593602477 [0,2,0,0,0,0|1,0,0]=3 226 B16R1.994 CCCOc1ccccc1NC[C@H](O)CO AIFCHEM-94590564688 [0,2,0,0,0,0|1,0,0]=3 227 B16R1.994 COCOc1ccccc1NCC(O)CO AIFCHEM-6113821607 [0,2,0,0,0,0|1,0,0]=3 228 B16R1.994 COCOc1ccccc1NC[C@H](O)CO AIFCHEM-94590569534 [0,2,0,0,0,0|1,0,0]=3 229 B16R1.9045 CCOc1cc(ccc1NCC(O)CO)Br AIFCHEM-5770677797 [0,2,0,0,0,0|1,0,0]=3 230 B16R1.9045 CCOc1cc(ccc1NC[C@H](O)CO)Br AIFCHEM-94590565976 [0,2,0,0,0,0|1,0,0]=3 231 B16R1.9373 CCOc1ccc(cc1NCC(O)CO)Cl AIFCHEM-5865705914 [0,2,0,0,0,0|1,0,0]=3 232 B16R1.9373 CCOc1ccc(cc1NC[C@H](O)CO)Cl AIFCHEM-94590559054 [0,2,0,0,0,0|1,0,0]=3 233 B16R1.9373 CCOc1ncc(cc1NCC(O)CO)Br AIFCHEM-6033275807 [0,2,0,0,0,0|2,0,0]=4 234 B16R1.9373 CCOc1ncc(cc1NC[C@H](O)CO)Br AIFCHEM-94590569502 [0,2,0,0,0,0|2,0,0]=4 235 B16R1.1454 CCNCC(O)COc1ccccc1OC AIFCHEM-94587708032 [0,2,0,0,0,0|1,0,0]=3 236 B16R1.1302 CC(C)c1ccc(cc1NCC(O)CO)Br AIFCHEM-94528575031 [0,2,0,0,0,0|2,0,0]=4 237 B16R1.1302 CC(C)c1ccc(cc1NC[C@H](O)CO)Br AIFCHEM-94590570074 [0,2,0,0,0,0|2,0,0]=4 238 B16R1.1331 CS(=O)(=O)c1ccccc1NCC(O)CO AIFCHEM-94585265773 [0,2,0,0,0,0|1,1,0]=4 239 B16R1.4325 COc1ccc(cc1CNC(CO)CO)Br AIFCHEM-6439686622 [0,2,0,0,0,0|2,0,0]=4 240 B16R1.4743 COc1cc(ccc1CNC(CO)CO)F AIFCHEM-6449429019 [0,2,0,0,0,0|2,0,0]=4 241 B16R1.4743 COc1cc(ccc1CNC(CO)CO)I AIFCHEM-6449179189 [0,2,0,0,0,0|2,0,0]=4 242 B16R1.6230 COc1c(cccc1CNC(CO)CO)Br AIFCHEM-6423458921 [0,2,0,0,0,0|2,0,0]=4 243 B16R1.6230 COc1c(cccc1CNC(CO)CO)O AIFCHEM-6439757618 [0,2,0,0,0,0|2,0,0]=4 244 B16R1.19773 COc1cccc(c1CNC(CO)CO)C AIFCHEM-6435944378 [0,2,0,0,0,0|2,0,0]=4 245 B16R1.19773 COc1cccc(c1CNC(CO)CO)O AIFCHEM-6448894349 [0,2,0,0,0,0|2,0,0]=4 246 B16R1.85802 COc1cc(ccc1NCC(C)(C)CO)Br AIFCHEM-6064732818 [0,2,0,0,0,0|2,0,0]=4 247 B16R1.85802 COc1cc(ccc1NCC(C)(C)CO)Cl AIFCHEM-5683350873 [0,2,0,0,0,0|2,0,0]=4 248 B16R1.85802 COc1cc(ccc1NCC(C)(C)CO)I AIFCHEM-5750846630 [0,2,0,0,0,0|2,0,0]=4 249 B16R1.20059 COc1cc(c(cc1NCC(O)CO)Br)F AIFCHEM-6164595391 [0,2,0,0,0,0|1,0,0]=3 250 B16R1.20059 COc1cc(c(cc1NCC(O)CO)Cl)F AIFCHEM-5902772091 [0,2,0,0,0,0|1,0,0]=3 251 B16R1.20059 COc1cc(c(cc1NCC(O)CO)F)Cl AIFCHEM-5610156467 [0,2,0,0,0,0|1,0,0]=3 252 B16R1.20059 COc1cc(c(cc1NC[C@H](O)CO)Br)F AIFCHEM-94590558072 [0,2,0,0,0,0|1,0,0]=3 253 B16R1.20059 COc1cc(c(cc1NC[C@H](O)CO)Cl)F AIFCHEM-94590558062 [0,2,0,0,0,0|1,0,0]=3 254 B16R1.20059 COc1cc(c(cc1NC[C@H](O)CO)F)Cl AIFCHEM-94590557042 [0,2,0,0,0,0|1,0,0]=3 255 B16R1.20197 COc1cc(ccc1NCC(O)CO)SC AIFCHEM-6271845289 [0,2,0,0,0,0|1,0,0]=3 256 B16R1.20197 COc1cc(ccc1NC[C@H](O)CO)SC AIFCHEM-94590559447 [0,2,0,0,0,0|1,0,0]=3 257 B16R1.20197 COc1ccc(c(c1)OC)NC[C@H](O)CO AIFCHEM-94590562481 [0,2,0,0,0,0|1,0,0]=3 258 B16R1.20197 COc1ccc(c(n1)OC)NCC(O)CO AIFCHEM-5797083594 [0,2,0,0,0,0|2,0,0]=4 259 B16R1.20197 COc1ccc(c(n1)OC)NC[C@H](O)CO AIFCHEM-94590568537 [0,2,0,0,0,0|2,0,0]=4 260 B16R2.33562 CC1Cc2ccccc2N1CC(O)CO AIFCHEM-5887649193 [0,1,0,1,0,0|2,0,0]=4 261 B16R2.33562 CC1Cc2ccccc2N1C[C@H](O)CO AIFCHEM-94590567356 [0,1,0,1,0,0|2,0,0]=4 262 B16R2.33648 OCC(O)CNc1cccc2c1occ2 AIFCHEM-94544546959 [0,1,0,1,0,0|1,0,1]=4 263 B16R2.33648 OC[C@@H](O)CNc1cccc2c1occ2 AIFCHEM-94590567270 [0,1,0,1,0,0|1,0,1]=4 264 B16R2.170412 OCC(O)CN1CCCc2c1cccc2 AIFCHEM-5867924167 [0,1,0,1,0,0|2,0,0]=4 265 B16R2.170412 OC[C@@H](O)CN1CCCc2c1cccc2 AIFCHEM-94590566804 [0,1,0,1,0,0|2,0,0]=4 266 B16R2.4 OCC(CO)NC1COc2c1cccc2 AIFCHEM-94606754494 [0,1,0,1,0,0|2,0,0]=4 267 B16R2.176317 Cc1cccc2c1N(CC2)C[C@H](O)CO AIFCHEM-94590567051 [0,1,0,1,0,0|2,0,0]=4 268 B16R2.176359 OCC(O)CN1CCc2c1cc(cc2)Cl AIFCHEM-94519639631 [0,1,0,1,0,0|2,0,0]=4 269 B16R2.176359 OC[C@@H](O)CN1CCc2c1cc(cc2)Cl AIFCHEM-94590569715 [0,1,0,1,0,0|2,0,0]=4 270 B16R2.34357 Cc1ccc2c(c1)CCN2CC(O)CO AIFCHEM-6155426599 [0,1,0,1,0,0|2,0,0]=4 271 B16R2.34357 Cc1ccc2c(c1)CCN2C[C@H](O)CO AIFCHEM-94590567069 [0,1,0,1,0,0|2,0,0]=4 272 B16R2.34357 OCC(O)CN1CCc2c1ccc(c2)Cl AIFCHEM-94580619316 [0,1,0,1,0,0|2,0,0]=4 273 B16R2.34357 OC[C@@H](O)CN1CCc2c1ccc(c2)Cl AIFCHEM-94590562213 [0,1,0,1,0,0|2,0,0]=4 274 B12R1.371 CC(CO)Nc1ccccc1O AIFCHEM-94521333642 [1,0,0,0,1,0|2,0,0]=4 275 B16R1.3910 COc1ccccc1CCNC[C@@H](F)CO AIFCHEM-6466234795 [0,0,0,0,0,2|2,0,0]=4 276 B16R1.3910 COc1ccccc1CCNC[C@H](F)CO AIFCHEM-94577439104 [0,0,0,0,0,2|2,0,0]=4