0 B14R1.4522 C=C(C)CNc1ccccc1C(=O)N 34a_100000185089_100000748629 [0,0,0,0,0,0|3,0,0]=3 1 B14R1.4522 C=C(C)CNc1cccnc1C(=O)N 27a_100000765925_200012359670 [0,0,0,0,0,0|4,0,0]=4 2 B14R1.4522 C=C(C)CNc1ccncc1C(=O)N 27a_100000765925_100000697804 [0,0,0,0,0,0|4,0,0]=4 3 B14R1.4522 C=C(C)CNc1ncccc1C(=O)N 27a_100000765925_100000162199 [0,0,0,0,0,0|4,0,0]=4 4 B14R1.4522 C=C(C)COc1ccccc1C(=O)C 1458a_100000217157_200000210301 [0,0,0,0,0,0|3,0,0]=3 5 B14R1.4522 C=C(C)COc1ccccc1C(=O)N 34a_100000192804_100000748629 [0,0,0,0,0,0|2,0,0]=2 6 B14R1.4522 C=C(C)COc1ccccc1C(=O)N 7a_100000192804_100000748629 [0,0,0,0,0,0|2,0,0]=2 7 B14R1.4522 C=C(C)COc1ccccc1C(=O)[13CH3] 1458a_100000217157_200025704644 [0,0,0,0,0,0|3,0,0]=3 8 B14R1.4522 C=C(C)COc1ccccc1C(=O)[O-] 7a_100015234032_100000748629 [0,0,0,0,0,0|3,0,0]=3 9 B14R1.4522 C=C(C)COc1ccccc1C(=S)N 7a_100000745089_100000748629 [0,0,0,0,0,0|2,1,0]=3 10 B14R1.4522 C=C(C)COc1ccccc1[C@@H](C)N 34a_100025703389_100000748629 [0,0,0,0,0,0|3,0,1]=4 11 B14R1.4522 C=C(C)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100000748629 [0,0,0,0,0,0|4,0,0]=4 12 B14R1.4522 C=C(C)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100000748629 [0,0,0,0,0,0|4,0,0]=4 13 B14R1.4522 C=C(C)COc1cccnc1C(=O)C 34a_100000087166_100000748629 [0,0,0,0,0,0|4,0,0]=4 14 B14R1.4522 C=C(C)COc1cccnc1C(=O)C 7a_100000087166_100000748629 [0,0,0,0,0,0|4,0,0]=4 15 B14R1.4522 C=C(C)COc1cccnc1C(=O)N 34a_200011215183_100000748629 [0,0,0,0,0,0|3,0,0]=3 16 B14R1.4522 C=C(C)COc1cccnc1C(=O)N 7a_200011215183_100000748629 [0,0,0,0,0,0|3,0,0]=3 17 B14R1.4522 C=C(C)COc1ccncc1C(=O)N 34a_200011998761_100000748629 [0,0,0,0,0,0|3,0,0]=3 18 B14R1.4522 C=C(C)COc1cnccc1C(=O)C 7a_100009872882_100000748629 [0,0,0,0,0,0|4,0,0]=4 19 B14R1.4522 C=C(C)COc1cnccc1C(=O)N 7a_100012022987_100000748629 [0,0,0,0,0,0|3,0,0]=3 20 B14R1.4522 C=C(C)COc1nccnc1C(=O)N 34a_100011830332_100000748629 [0,0,0,0,0,0|4,0,0]=4 21 B14R1.4522 C=C(C)CSc1ccccc1C(=O)C 62a_100000751169_100000211660 [0,0,0,0,0,0|3,1,0]=4 22 B14R1.4522 C=C(C)CSc1ccccc1C(=O)N 62a_100000162227_100000211660 [0,0,0,0,0,0|2,1,0]=3 23 B14R1.4522 C=C(C)CSc1ccccc1C(=O)N 62a_100000748629_100000162227 [0,0,0,0,0,0|2,1,0]=3 24 B14R1.4522 C=C(C)CSc1ccccc1C(=O)O 62a_100000748629_100000734275 [0,0,0,0,0,0|3,1,0]=4 25 B14R1.4522 C=C(C)CSc1ccccc1C(=O)O 62a_202125556159_100000211660 [0,0,0,0,0,0|3,1,0]=4 26 B14R1.4522 C=C(C)CSc1cccnc1C(=O)N 62a_100000748629_200012359670 [0,0,0,0,0,0|3,1,0]=4 27 B14R1.4522 C=C(C)CSc1cccnc1C(=O)N 62a_200012359670_100000211660 [0,0,0,0,0,0|3,1,0]=4 28 B14R1.4522 C=C(C)CSc1ccncc1C(=O)N 62a_100000697804_100000211660 [0,0,0,0,0,0|3,1,0]=4 29 B14R1.4522 C=C(C)CSc1ccncc1C(=O)N 62a_100000748629_100000697804 [0,0,0,0,0,0|3,1,0]=4 30 B14R1.4522 C=C(C)CSc1cnccc1C(=O)N 62a_100000748629_100010205435 [0,0,0,0,0,0|3,1,0]=4 31 B14R1.4522 C=C(C)CSc1cnccc1C(=O)N 62a_100010205435_100000211660 [0,0,0,0,0,0|3,1,0]=4 32 B14R1.4522 C=C(C)CSc1ncccc1C(=O)N 62a_100000162199_100000211660 [0,0,0,0,0,0|3,1,0]=4 33 B14R1.4522 C=C(C)CSc1ncccc1C(=O)N 62a_100000748629_100000162199 [0,0,0,0,0,0|3,1,0]=4 34 B14R1.4522 C=C(C)c1ccccc1CCC(=O)N 271570a_100000694244_100009814947 [0,0,0,0,0,0|4,0,0]=4 35 B14R1.4522 C=C(C)c1ccccc1NCC(=O)N 34a_100000037685_100000187820 [0,0,0,0,0,0|4,0,0]=4 36 B14R1.4522 C=C(C)c1ccccc1NCC(=O)[O-] 34a_100000037685_100020667443 [0,0,0,0,0,0|3,0,1]=4 37 B14R1.4522 C=C(C)c1ccccc1OCC(=O)N 271570a_100000694244_200000148491 [0,0,0,0,0,0|3,0,0]=3 38 B14R1.4522 C=C(F)CNc1ccccc1C(=O)N 34a_100000185089_100009893438 [0,0,0,0,0,0|3,0,0]=3 39 B14R1.4522 C=C(F)COc1ccccc1C(=O)N 34a_100000192804_100009893438 [0,0,0,0,0,0|2,0,0]=2 40 B14R1.4522 C=C(F)COc1ccccc1C(=O)N 7a_100000192804_100000042424 [0,0,0,0,0,0|2,0,0]=2 41 B14R1.4522 C=C(F)COc1ccccc1C(=O)[O-] 7a_100015234032_100000042424 [0,0,0,0,0,0|3,0,0]=3 42 B14R1.4522 C=C(F)COc1ccccc1C(=S)N 7a_100000745089_100000042424 [0,0,0,0,0,0|2,1,0]=3 43 B14R1.4522 C=C(F)COc1ccccc1[C@@H](C)N 34a_100025703389_100009893438 [0,0,0,0,0,0|3,0,1]=4 44 B14R1.4522 C=C(F)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100009893438 [0,0,0,0,0,0|4,0,0]=4 45 B14R1.4522 C=C(F)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100000042424 [0,0,0,0,0,0|4,0,0]=4 46 B14R1.4522 C=C(F)COc1cccnc1C(=O)C 34a_100000087166_100009893438 [0,0,0,0,0,0|4,0,0]=4 47 B14R1.4522 C=C(F)COc1cccnc1C(=O)C 7a_100000087166_100000042424 [0,0,0,0,0,0|4,0,0]=4 48 B14R1.4522 C=C(F)COc1cccnc1C(=O)N 34a_200011215183_100009893438 [0,0,0,0,0,0|3,0,0]=3 49 B14R1.4522 C=C(F)COc1cccnc1C(=O)N 7a_200011215183_100000042424 [0,0,0,0,0,0|3,0,0]=3 50 B14R1.4522 C=C(F)COc1ccncc1C(=O)N 34a_200011998761_100009893438 [0,0,0,0,0,0|3,0,0]=3 51 B14R1.4522 C=C(F)COc1cnccc1C(=O)C 7a_100009872882_100000042424 [0,0,0,0,0,0|4,0,0]=4 52 B14R1.4522 C=C(F)COc1cnccc1C(=O)N 7a_100012022987_100000042424 [0,0,0,0,0,0|3,0,0]=3 53 B14R1.4522 C=C(F)COc1nccnc1C(=O)N 34a_100011830332_100009893438 [0,0,0,0,0,0|4,0,0]=4 54 B14R1.4522 C=C(F)CSc1ccccc1C(=O)C 62a_100000751169_100000042424 [0,0,0,0,0,0|3,1,0]=4 55 B14R1.4522 C=C(F)CSc1ccccc1C(=O)N 62a_100000042424_100000162227 [0,0,0,0,0,0|2,1,0]=3 56 B14R1.4522 C=C(F)CSc1ccccc1C(=O)N 62a_100000162227_100000042424 [0,0,0,0,0,0|2,1,0]=3 57 B14R1.4522 C=C(F)CSc1ccccc1C(=O)O 62a_100000042424_100000734275 [0,0,0,0,0,0|3,1,0]=4 58 B14R1.4522 C=C(F)CSc1ccccc1C(=O)O 62a_202125556159_100000042424 [0,0,0,0,0,0|3,1,0]=4 59 B14R1.4522 C=C(F)CSc1cccnc1C(=O)N 62a_100000042424_200012359670 [0,0,0,0,0,0|3,1,0]=4 60 B14R1.4522 C=C(F)CSc1cccnc1C(=O)N 62a_200012359670_100000042424 [0,0,0,0,0,0|3,1,0]=4 61 B14R1.4522 C=C(F)CSc1ccncc1C(=O)N 62a_100000042424_100000697804 [0,0,0,0,0,0|3,1,0]=4 62 B14R1.4522 C=C(F)CSc1ccncc1C(=O)N 62a_100000697804_100000042424 [0,0,0,0,0,0|3,1,0]=4 63 B14R1.4522 C=C(F)CSc1cnccc1C(=O)N 62a_100000042424_100010205435 [0,0,0,0,0,0|3,1,0]=4 64 B14R1.4522 C=C(F)CSc1cnccc1C(=O)N 62a_100010205435_100000042424 [0,0,0,0,0,0|3,1,0]=4 65 B14R1.4522 C=C(F)CSc1ncccc1C(=O)N 62a_100000042424_100000162199 [0,0,0,0,0,0|3,1,0]=4 66 B14R1.4522 C=C(F)CSc1ncccc1C(=O)N 62a_100000162199_100000042424 [0,0,0,0,0,0|3,1,0]=4 67 B14R1.4522 CC(=O)CCc1ccccc1[N+](=O)[O-] 1458a_100000070787_200011934512 [0,0,0,0,0,0|4,0,0]=4 68 B14R1.4522 CC(=O)CCc1ccccc1[N+](=O)[O-] 1458a_100000746016_200000210301 [0,0,0,0,0,0|4,0,0]=4 69 B14R1.4522 CC(=O)COc1ccccc1C(=O)N 1458a_100000182327_200000210301 [0,0,0,0,0,0|1,0,0]=1 70 B14R1.4522 CC(=O)COc1ccccc1C(C)C 1458a_100000183894_200000210301 [0,0,0,0,0,0|3,0,1]=4 71 B14R1.4522 CC(=O)COc1ccccc1[N+](=O)[O-] 1458a_100000182526_200000210301 [0,0,0,0,0,0|3,0,0]=3 72 B14R1.4522 CC(=O)CSc1ccccc1[N+](=O)[O-] 1458a_100000156278_200000210301 [0,0,0,0,0,0|3,1,0]=4 73 B14R1.4522 CC(=O)c1ccccc1SCC(=O)N 1458a_100000180052_200000210301 [0,0,0,0,0,0|2,1,0]=3 74 B14R1.4522 CC(=O)c1ccccc1SCC(=O)N 62a_100000751169_100000747473 [0,0,0,0,0,0|2,1,0]=3 75 B14R1.4522 CC(=O)c1ccccc1SCC(=O)[O-] 62a_100000751169_100020667443 [0,0,0,0,0,0|1,1,1]=3 76 B14R1.4522 CC(=O)c1ccccc1SCC(C)O 62a_100000751169_100011218427 [0,0,0,0,0,0|2,1,1]=4 77 B14R1.4522 CC(=O)c1ccccc1SC[C@@H](C)O 62a_100000751169_100009817552 [0,0,0,0,0,0|2,1,1]=4 78 B14R1.4522 CC(=O)c1ccccc1SC[N+](=O)[O-] 62a_100000751169_100000761209 [0,0,0,0,0,0|2,1,1]=4 79 B14R1.4522 CC(=O)c1cccnc1SCC(=O)N 62a_100000747473_100000753718 [0,0,0,0,0,0|3,1,0]=4 80 B14R1.4522 CC(=O)c1cccnc1SCC(=O)N 62a_100000753718_100000747473 [0,0,0,0,0,0|3,1,0]=4 81 B14R1.4522 CC(=O)c1cccnc1SCC(=O)[O-] 62a_100000753718_100020667443 [0,0,0,0,0,0|2,1,1]=4 82 B14R1.4522 CC(=O)c1cccnc1SCC(=O)[O-] 62a_100020667443_100000753718 [0,0,0,0,0,0|2,1,1]=4 83 B14R1.4522 CC(=O)c1ccncc1OCC(=O)N 7a_100009872882_100000187820 [0,0,0,0,0,0|3,0,0]=3 84 B14R1.4522 CC(=O)c1ccncc1OCC(C)O 7a_100009872882_100011218427 [0,0,0,0,0,0|3,0,1]=4 85 B14R1.4522 CC(=O)c1ccncc1OC[C@@H](C)O 7a_100009872882_100009817552 [0,0,0,0,0,0|3,0,1]=4 86 B14R1.4522 CC(=O)c1ccncc1SCC(=O)N 62a_100000747473_100009993184 [0,0,0,0,0,0|3,1,0]=4 87 B14R1.4522 CC(=O)c1ccncc1SCC(=O)N 62a_100009993184_100000747473 [0,0,0,0,0,0|3,1,0]=4 88 B14R1.4522 CC(=O)c1ccncc1SCC(=O)[O-] 62a_100009993184_100020667443 [0,0,0,0,0,0|2,1,1]=4 89 B14R1.4522 CC(=O)c1ccncc1SCC(=O)[O-] 62a_100020667443_100009993184 [0,0,0,0,0,0|2,1,1]=4 90 B14R1.4522 CC(=O)c1cnccc1SCC(=O)N 62a_100000747473_100160469449 [0,0,0,0,0,0|3,1,0]=4 91 B14R1.4522 CC(=O)c1cnccc1SCC(=O)N 62a_100160469449_100000747473 [0,0,0,0,0,0|3,1,0]=4 92 B14R1.4522 CC(=O)c1cnccc1SCC(=O)[O-] 62a_100020667443_100160469449 [0,0,0,0,0,0|2,1,1]=4 93 B14R1.4522 CC(=O)c1cnccc1SCC(=O)[O-] 62a_100160469449_100020667443 [0,0,0,0,0,0|2,1,1]=4 94 B14R1.4522 CC(=O)c1ncccc1OCC(=O)N 34a_100000087166_100000187820 [0,0,0,0,0,0|3,0,0]=3 95 B14R1.4522 CC(=O)c1ncccc1OCC(=O)N 7a_100000087166_100000187820 [0,0,0,0,0,0|3,0,0]=3 96 B14R1.4522 CC(=O)c1ncccc1OCC(=O)[O-] 34a_100000087166_100020667443 [0,0,0,0,0,0|2,0,1]=3 97 B14R1.4522 CC(=O)c1ncccc1OCC(C)O 34a_100000087166_100011218427 [0,0,0,0,0,0|3,0,1]=4 98 B14R1.4522 CC(=O)c1ncccc1OCC(C)O 7a_100000087166_100011218427 [0,0,0,0,0,0|3,0,1]=4 99 B14R1.4522 CC(=O)c1ncccc1OC[C@@H](C)O 34a_100000087166_100009817552 [0,0,0,0,0,0|3,0,1]=4 100 B14R1.4522 CC(=O)c1ncccc1OC[C@@H](C)O 7a_100000087166_100009817552 [0,0,0,0,0,0|3,0,1]=4 101 B14R1.4522 CC(=O)c1ncccc1OC[N+](=O)[O-] 34a_100000087166_100000761209 [0,0,0,0,0,0|3,0,1]=4 102 B14R1.4522 CC(=O)c1ncccc1SCC(=O)N 62a_100000747473_100012348690 [0,0,0,0,0,0|3,1,0]=4 103 B14R1.4522 CC(=O)c1ncccc1SCC(=O)N 62a_100012348690_100000747473 [0,0,0,0,0,0|3,1,0]=4 104 B14R1.4522 CC(=O)c1ncccc1SCC(=O)[O-] 62a_100012348690_100020667443 [0,0,0,0,0,0|2,1,1]=4 105 B14R1.4522 CC(=O)c1ncccc1SCC(=O)[O-] 62a_100020667443_100012348690 [0,0,0,0,0,0|2,1,1]=4 106 B14R1.4522 CC(C)CNc1ccccc1C(=O)N 34a_100000185089_100000210624 [0,0,0,0,0,0|3,0,1]=4 107 B14R1.4522 CC(C)COc1ccccc1C(=O)N 34a_100000192804_100000210624 [0,0,0,0,0,0|2,0,1]=3 108 B14R1.4522 CC(C)COc1ccccc1C(=O)N 7a_100000192804_100000210760 [0,0,0,0,0,0|2,0,1]=3 109 B14R1.4522 CC(C)COc1ccccc1C(=O)[O-] 7a_100015234032_100000210760 [0,0,0,0,0,0|3,0,1]=4 110 B14R1.4522 CC(C)COc1ccccc1C(=S)N 7a_100000745089_100000210760 [0,0,0,0,0,0|2,1,1]=4 111 B14R1.4522 CC(C)COc1cccnc1C(=O)N 34a_200011215183_100000210624 [0,0,0,0,0,0|3,0,1]=4 112 B14R1.4522 CC(C)COc1cccnc1C(=O)N 7a_200011215183_100000210760 [0,0,0,0,0,0|3,0,1]=4 113 B14R1.4522 CC(C)COc1ccncc1C(=O)N 34a_200011998761_100000210624 [0,0,0,0,0,0|3,0,1]=4 114 B14R1.4522 CC(C)COc1cnccc1C(=O)N 7a_100012022987_100000210760 [0,0,0,0,0,0|3,0,1]=4 115 B14R1.4522 CC(C)CSc1ccccc1C(=O)N 62a_100000162227_100000210760 [0,0,0,0,0,0|2,1,1]=4 116 B14R1.4522 CC(C)CSc1ccccc1C(=O)N 62a_100000210624_100000162227 [0,0,0,0,0,0|2,1,1]=4 117 B14R1.4522 CC(C)c1ccccc1OCC(=O)N 34a_100000211617_100000187820 [0,0,0,0,0,0|3,0,1]=4 118 B14R1.4522 CC(C)c1ccccc1OCC(=O)N 7a_100000211617_100000187820 [0,0,0,0,0,0|3,0,1]=4 119 B14R1.4522 CC(C)c1ccccc1OCC(=O)[13CH3] 1458a_100000183894_200025704644 [0,0,0,0,0,0|3,0,1]=4 120 B14R1.4522 CC(C)c1ccccc1OCC(=O)[O-] 34a_100000211617_100020667443 [0,0,0,0,0,0|2,0,2]=4 121 B14R1.4522 CC(N)c1ccccc1SCC(=O)N 62a_100000181357_100000747473 [0,0,0,0,0,0|2,1,1]=4 122 B14R1.4522 CC(N)c1ccccc1SCC(=O)N 62a_100000747473_100000181357 [0,0,0,0,0,0|2,1,1]=4 123 B14R1.4522 CC(N)c1ccccc1SCC(=O)[O-] 62a_100000181357_100020667443 [0,0,0,0,0,0|1,1,2]=4 124 B14R1.4522 CC(N)c1ccccc1SCC(=O)[O-] 62a_100020667443_100000181357 [0,0,0,0,0,0|1,1,2]=4 125 B14R1.4522 CC(O)C=Cc1ccccc1C(=O)N 271570a_200011019289_100000162227 [0,0,0,0,0,0|2,0,2]=4 126 B14R1.4522 CC(O)CNc1ccccc1C(=O)N 34a_100000185089_100011218427 [0,0,0,0,0,0|2,0,1]=3 127 B14R1.4522 CC(O)CNc1cccnc1C(=O)N 27a_100000210904_200012359670 [0,0,0,0,0,0|3,0,1]=4 128 B14R1.4522 CC(O)CNc1ccncc1C(=O)N 27a_100000210904_100000697804 [0,0,0,0,0,0|3,0,1]=4 129 B14R1.4522 CC(O)CNc1ncccc1C(=O)N 27a_100000210904_100000162199 [0,0,0,0,0,0|3,0,1]=4 130 B14R1.4522 CC(O)COc1ccccc1C(=O)N 34a_100000192804_100011218427 [0,0,0,0,0,0|1,0,1]=2 131 B14R1.4522 CC(O)COc1ccccc1C(=O)N 7a_100000192804_100011218427 [0,0,0,0,0,0|1,0,1]=2 132 B14R1.4522 CC(O)COc1ccccc1C(=O)[O-] 7a_100015234032_100011218427 [0,0,0,0,0,0|2,0,1]=3 133 B14R1.4522 CC(O)COc1ccccc1C(=S)N 7a_100000745089_100011218427 [0,0,0,0,0,0|1,1,1]=3 134 B14R1.4522 CC(O)COc1ccccc1[C@@H](C)N 34a_100025703389_100011218427 [0,0,0,0,0,0|2,0,2]=4 135 B14R1.4522 CC(O)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100011218427 [0,0,0,0,0,0|3,0,1]=4 136 B14R1.4522 CC(O)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100011218427 [0,0,0,0,0,0|3,0,1]=4 137 B14R1.4522 CC(O)COc1cccnc1C(=O)N 34a_200011215183_100011218427 [0,0,0,0,0,0|2,0,1]=3 138 B14R1.4522 CC(O)COc1cccnc1C(=O)N 7a_200011215183_100011218427 [0,0,0,0,0,0|2,0,1]=3 139 B14R1.4522 CC(O)COc1ccncc1C(=O)N 34a_200011998761_100011218427 [0,0,0,0,0,0|2,0,1]=3 140 B14R1.4522 CC(O)COc1cnccc1C(=O)N 7a_100012022987_100011218427 [0,0,0,0,0,0|2,0,1]=3 141 B14R1.4522 CC(O)COc1nccnc1C(=O)N 34a_100011830332_100011218427 [0,0,0,0,0,0|3,0,1]=4 142 B14R1.4522 CC(O)CSc1ccccc1C(=O)N 62a_100000162227_100011218427 [0,0,0,0,0,0|1,1,1]=3 143 B14R1.4522 CC(O)CSc1ccccc1C(=O)N 62a_100011218427_100000162227 [0,0,0,0,0,0|1,1,1]=3 144 B14R1.4522 CC(O)CSc1ccccc1C(=O)O 62a_100011218427_100000734275 [0,0,0,0,0,0|2,1,1]=4 145 B14R1.4522 CC(O)CSc1ccccc1C(=O)O 62a_202125556159_100011218427 [0,0,0,0,0,0|2,1,1]=4 146 B14R1.4522 CC(O)CSc1cccnc1C(=O)N 62a_100011218427_200012359670 [0,0,0,0,0,0|2,1,1]=4 147 B14R1.4522 CC(O)CSc1cccnc1C(=O)N 62a_200012359670_100011218427 [0,0,0,0,0,0|2,1,1]=4 148 B14R1.4522 CC(O)CSc1ccncc1C(=O)N 62a_100000697804_100011218427 [0,0,0,0,0,0|2,1,1]=4 149 B14R1.4522 CC(O)CSc1ccncc1C(=O)N 62a_100011218427_100000697804 [0,0,0,0,0,0|2,1,1]=4 150 B14R1.4522 CC(O)CSc1cnccc1C(=O)N 62a_100010205435_100011218427 [0,0,0,0,0,0|2,1,1]=4 151 B14R1.4522 CC(O)CSc1cnccc1C(=O)N 62a_100011218427_100010205435 [0,0,0,0,0,0|2,1,1]=4 152 B14R1.4522 CC(O)CSc1ncccc1C(=O)N 62a_100000162199_100011218427 [0,0,0,0,0,0|2,1,1]=4 153 B14R1.4522 CC(O)CSc1ncccc1C(=O)N 62a_100011218427_100000162199 [0,0,0,0,0,0|2,1,1]=4 154 B14R1.4522 CC(O)c1ccccc1OCC(=O)N 34a_200011232679_100000187820 [0,0,0,0,0,0|2,0,2]=4 155 B14R1.4522 CC(O)c1ccccc1OCC(=O)N 7a_200011232679_100000187820 [0,0,0,0,0,0|2,0,2]=4 156 B14R1.4522 CC(O)c1ccccc1OCC(=O)[O-] 34a_200011232679_100020667443 [0,0,0,0,0,0|1,0,3]=4 157 B14R1.4522 CS(=O)c1ccccc1SCC(=O)N 62a_100000734199_100000747473 [0,0,0,0,0,0|3,1,0]=4 158 B14R1.4522 CS(=O)c1ccccc1SCC(=O)[O-] 62a_100000734199_100020667443 [0,0,0,0,0,0|2,1,1]=4 159 B14R1.4522 C[C@@H](N)c1ccccc1OCC(=O)N 34a_100025703389_100000187820 [0,0,0,0,0,0|2,0,1]=3 160 B14R1.4522 C[C@@H](N)c1ccccc1OCC(=O)[O-] 34a_100025703389_100020667443 [0,0,0,0,0,0|1,0,2]=3 161 B14R1.4522 C[C@@H](N)c1ccccc1OC[N+](=O)[O-] 34a_100025703389_100000761209 [0,0,0,0,0,0|2,0,2]=4 162 B14R1.4522 C[C@@H](O)CNc1ccccc1C(=O)N 34a_100000185089_100009817552 [0,0,0,0,0,0|2,0,1]=3 163 B14R1.4522 C[C@@H](O)COc1ccccc1C(=O)N 34a_100000192804_100009817552 [0,0,0,0,0,0|1,0,1]=2 164 B14R1.4522 C[C@@H](O)COc1ccccc1C(=O)N 7a_100000192804_100009817552 [0,0,0,0,0,0|1,0,1]=2 165 B14R1.4522 C[C@@H](O)COc1ccccc1C(=O)[O-] 7a_100015234032_100009817552 [0,0,0,0,0,0|2,0,1]=3 166 B14R1.4522 C[C@@H](O)COc1ccccc1C(=S)N 7a_100000745089_100009817552 [0,0,0,0,0,0|1,1,1]=3 167 B14R1.4522 C[C@@H](O)COc1ccccc1[C@@H](C)N 34a_100025703389_100009817552 [0,0,0,0,0,0|2,0,2]=4 168 B14R1.4522 C[C@@H](O)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100009817552 [0,0,0,0,0,0|3,0,1]=4 169 B14R1.4522 C[C@@H](O)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100009817552 [0,0,0,0,0,0|3,0,1]=4 170 B14R1.4522 C[C@@H](O)COc1cccnc1C(=O)N 34a_200011215183_100009817552 [0,0,0,0,0,0|2,0,1]=3 171 B14R1.4522 C[C@@H](O)COc1cccnc1C(=O)N 7a_200011215183_100009817552 [0,0,0,0,0,0|2,0,1]=3 172 B14R1.4522 C[C@@H](O)COc1ccncc1C(=O)N 34a_200011998761_100009817552 [0,0,0,0,0,0|2,0,1]=3 173 B14R1.4522 C[C@@H](O)COc1cnccc1C(=O)N 7a_100012022987_100009817552 [0,0,0,0,0,0|2,0,1]=3 174 B14R1.4522 C[C@@H](O)COc1nccnc1C(=O)N 34a_100011830332_100009817552 [0,0,0,0,0,0|3,0,1]=4 175 B14R1.4522 C[C@@H](O)CSc1ccccc1C(=O)N 62a_100000162227_100009817552 [0,0,0,0,0,0|1,1,1]=3 176 B14R1.4522 C[C@@H](O)CSc1ccccc1C(=O)N 62a_100009817552_100000162227 [0,0,0,0,0,0|1,1,1]=3 177 B14R1.4522 C[C@@H](O)CSc1ccccc1C(=O)O 62a_100009817552_100000734275 [0,0,0,0,0,0|2,1,1]=4 178 B14R1.4522 C[C@@H](O)CSc1ccccc1C(=O)O 62a_202125556159_100009817552 [0,0,0,0,0,0|2,1,1]=4 179 B14R1.4522 C[C@@H](O)CSc1cccnc1C(=O)N 62a_100009817552_200012359670 [0,0,0,0,0,0|2,1,1]=4 180 B14R1.4522 C[C@@H](O)CSc1cccnc1C(=O)N 62a_200012359670_100009817552 [0,0,0,0,0,0|2,1,1]=4 181 B14R1.4522 C[C@@H](O)CSc1ccncc1C(=O)N 62a_100000697804_100009817552 [0,0,0,0,0,0|2,1,1]=4 182 B14R1.4522 C[C@@H](O)CSc1ccncc1C(=O)N 62a_100009817552_100000697804 [0,0,0,0,0,0|2,1,1]=4 183 B14R1.4522 C[C@@H](O)CSc1cnccc1C(=O)N 62a_100009817552_100010205435 [0,0,0,0,0,0|2,1,1]=4 184 B14R1.4522 C[C@@H](O)CSc1cnccc1C(=O)N 62a_100010205435_100009817552 [0,0,0,0,0,0|2,1,1]=4 185 B14R1.4522 C[C@@H](O)CSc1ncccc1C(=O)N 62a_100000162199_100009817552 [0,0,0,0,0,0|2,1,1]=4 186 B14R1.4522 C[C@@H](O)CSc1ncccc1C(=O)N 62a_100009817552_100000162199 [0,0,0,0,0,0|2,1,1]=4 187 B14R1.4522 NC(=O)CNc1ccccc1C(=O)N 34a_100000185089_100000187820 [0,0,0,0,0,0|2,0,0]=2 188 B14R1.4522 NC(=O)COc1ccccc1C(=O)N 34a_100000192804_100000187820 [0,0,0,0,0,0|1,0,0]=1 189 B14R1.4522 NC(=O)COc1ccccc1C(=O)N 7a_100000192804_100000187820 [0,0,0,0,0,0|1,0,0]=1 190 B14R1.4522 NC(=O)COc1ccccc1C(=O)[O-] 7a_100015234032_100000187820 [0,0,0,0,0,0|2,0,0]=2 191 B14R1.4522 NC(=O)COc1ccccc1C(=S)N 7a_100000745089_100000187820 [0,0,0,0,0,0|1,1,0]=2 192 B14R1.4522 NC(=O)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100000187820 [0,0,0,0,0,0|3,0,0]=3 193 B14R1.4522 NC(=O)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100000187820 [0,0,0,0,0,0|3,0,0]=3 194 B14R1.4522 NC(=O)COc1cccnc1C(=O)N 34a_200011215183_100000187820 [0,0,0,0,0,0|2,0,0]=2 195 B14R1.4522 NC(=O)COc1cccnc1C(=O)N 7a_200011215183_100000187820 [0,0,0,0,0,0|2,0,0]=2 196 B14R1.4522 NC(=O)COc1cccnc1[N+](=O)[O-] 7a_100000183951_100000187820 [0,0,0,0,0,0|4,0,0]=4 197 B14R1.4522 NC(=O)COc1ccncc1C(=O)N 34a_200011998761_100000187820 [0,0,0,0,0,0|2,0,0]=2 198 B14R1.4522 NC(=O)COc1cnccc1C(=O)N 7a_100012022987_100000187820 [0,0,0,0,0,0|2,0,0]=2 199 B14R1.4522 NC(=O)COc1nccnc1C(=O)N 34a_100011830332_100000187820 [0,0,0,0,0,0|3,0,0]=3 200 B14R1.4522 NC(=O)CSc1ccccc1C(=O)N 62a_100000162227_100000747473 [0,0,0,0,0,0|1,1,0]=2 201 B14R1.4522 NC(=O)CSc1ccccc1C(=O)N 62a_100000747473_100000162227 [0,0,0,0,0,0|1,1,0]=2 202 B14R1.4522 NC(=O)CSc1ccccc1C(=O)O 62a_100000747473_100000734275 [0,0,0,0,0,0|2,1,0]=3 203 B14R1.4522 NC(=O)CSc1ccccc1C(=O)O 62a_202125556159_100000747473 [0,0,0,0,0,0|2,1,0]=3 204 B14R1.4522 NC(=O)CSc1cccnc1C(=O)N 62a_100000747473_200012359670 [0,0,0,0,0,0|2,1,0]=3 205 B14R1.4522 NC(=O)CSc1cccnc1C(=O)N 62a_200012359670_100000747473 [0,0,0,0,0,0|2,1,0]=3 206 B14R1.4522 NC(=O)CSc1ccncc1C(=O)N 62a_100000697804_100000747473 [0,0,0,0,0,0|2,1,0]=3 207 B14R1.4522 NC(=O)CSc1ccncc1C(=O)N 62a_100000747473_100000697804 [0,0,0,0,0,0|2,1,0]=3 208 B14R1.4522 NC(=O)CSc1cnccc1C(=O)N 62a_100000747473_100010205435 [0,0,0,0,0,0|2,1,0]=3 209 B14R1.4522 NC(=O)CSc1cnccc1C(=O)N 62a_100010205435_100000747473 [0,0,0,0,0,0|2,1,0]=3 210 B14R1.4522 NC(=O)CSc1ncccc1C(=O)N 62a_100000162199_100000747473 [0,0,0,0,0,0|2,1,0]=3 211 B14R1.4522 NC(=O)CSc1ncccc1C(=O)N 62a_100000747473_100000162199 [0,0,0,0,0,0|2,1,0]=3 212 B14R1.4522 NC(=O)CSc1nccnc1C(=O)N 62a_100000094861_100000747473 [0,0,0,0,0,0|3,1,0]=4 213 B14R1.4522 NC(=O)CSc1nccnc1C(=O)N 62a_100000747473_100000094861 [0,0,0,0,0,0|3,1,0]=4 214 B14R1.4522 NC(=O)c1ccccc1NCC(=O)[O-] 34a_100000185089_100020667443 [0,0,0,0,0,0|1,0,1]=2 215 B14R1.4522 NC(=O)c1ccccc1NCC(F)F 34a_100000185089_100011934356 [0,0,0,0,0,0|3,0,1]=4 216 B14R1.4522 NC(=O)c1ccccc1NC[N+](=O)[O-] 34a_100000185089_100000761209 [0,0,0,0,0,0|2,0,1]=3 217 B14R1.4522 NC(=O)c1ccccc1OCC(=O)[O-] 34a_100000192804_100020667443 [0,0,0,0,0,0|0,0,1]=1 218 B14R1.4522 NC(=O)c1ccccc1OCC(F)F 34a_100000192804_100011934356 [0,0,0,0,0,0|2,0,1]=3 219 B14R1.4522 NC(=O)c1ccccc1OCC(F)F 7a_100000192804_100011934356 [0,0,0,0,0,0|2,0,1]=3 220 B14R1.4522 NC(=O)c1ccccc1OC[N+](=O)[O-] 34a_100000192804_100000761209 [0,0,0,0,0,0|1,0,1]=2 221 B14R1.4522 NC(=O)c1ccccc1SCC(=O)[O-] 62a_100000162227_100020667443 [0,0,0,0,0,0|0,1,1]=2 222 B14R1.4522 NC(=O)c1ccccc1SCC(=O)[O-] 62a_100020667443_100000162227 [0,0,0,0,0,0|0,1,1]=2 223 B14R1.4522 NC(=O)c1ccccc1SCC(F)F 62a_100000162227_100011934356 [0,0,0,0,0,0|2,1,1]=4 224 B14R1.4522 NC(=O)c1ccccc1SCC(F)F 62a_100011934356_100000162227 [0,0,0,0,0,0|2,1,1]=4 225 B14R1.4522 NC(=O)c1ccccc1SC[N+](=O)[O-] 62a_100000162227_100000761209 [0,0,0,0,0,0|1,1,1]=3 226 B14R1.4522 NC(=O)c1cccnc1SCC(=O)[O-] 62a_100000162199_100020667443 [0,0,0,0,0,0|1,1,1]=3 227 B14R1.4522 NC(=O)c1cccnc1SCC(=O)[O-] 62a_100020667443_100000162199 [0,0,0,0,0,0|1,1,1]=3 228 B14R1.4522 NC(=O)c1cccnc1SC[N+](=O)[O-] 62a_100000162199_100000761209 [0,0,0,0,0,0|2,1,1]=4 229 B14R1.4522 NC(=O)c1ccncc1OCC(F)F 7a_100012022987_100011934356 [0,0,0,0,0,0|3,0,1]=4 230 B14R1.4522 NC(=O)c1ccncc1SCC(=O)[O-] 62a_100010205435_100020667443 [0,0,0,0,0,0|1,1,1]=3 231 B14R1.4522 NC(=O)c1ccncc1SCC(=O)[O-] 62a_100020667443_100010205435 [0,0,0,0,0,0|1,1,1]=3 232 B14R1.4522 NC(=O)c1ccncc1SC[N+](=O)[O-] 62a_100010205435_100000761209 [0,0,0,0,0,0|2,1,1]=4 233 B14R1.4522 NC(=O)c1cnccc1OCC(=O)[O-] 34a_200011998761_100020667443 [0,0,0,0,0,0|1,0,1]=2 234 B14R1.4522 NC(=O)c1cnccc1OCC(F)F 34a_200011998761_100011934356 [0,0,0,0,0,0|3,0,1]=4 235 B14R1.4522 NC(=O)c1cnccc1OC[N+](=O)[O-] 34a_200011998761_100000761209 [0,0,0,0,0,0|2,0,1]=3 236 B14R1.4522 NC(=O)c1cnccc1SCC(=O)[O-] 62a_100000697804_100020667443 [0,0,0,0,0,0|1,1,1]=3 237 B14R1.4522 NC(=O)c1cnccc1SCC(=O)[O-] 62a_100020667443_100000697804 [0,0,0,0,0,0|1,1,1]=3 238 B14R1.4522 NC(=O)c1cnccc1SC[N+](=O)[O-] 62a_100000697804_100000761209 [0,0,0,0,0,0|2,1,1]=4 239 B14R1.4522 NC(=O)c1ncccc1OCC(=O)[O-] 34a_200011215183_100020667443 [0,0,0,0,0,0|1,0,1]=2 240 B14R1.4522 NC(=O)c1ncccc1OCC(F)F 34a_200011215183_100011934356 [0,0,0,0,0,0|3,0,1]=4 241 B14R1.4522 NC(=O)c1ncccc1OCC(F)F 7a_200011215183_100011934356 [0,0,0,0,0,0|3,0,1]=4 242 B14R1.4522 NC(=O)c1ncccc1OC[N+](=O)[O-] 34a_200011215183_100000761209 [0,0,0,0,0,0|2,0,1]=3 243 B14R1.4522 NC(=O)c1ncccc1SCC(=O)[O-] 62a_100020667443_200012359670 [0,0,0,0,0,0|1,1,1]=3 244 B14R1.4522 NC(=O)c1ncccc1SCC(=O)[O-] 62a_200012359670_100020667443 [0,0,0,0,0,0|1,1,1]=3 245 B14R1.4522 NC(=O)c1ncccc1SC[N+](=O)[O-] 62a_200012359670_100000761209 [0,0,0,0,0,0|2,1,1]=4 246 B14R1.4522 NC(=O)c1nccnc1OCC(=O)[O-] 34a_100011830332_100020667443 [0,0,0,0,0,0|2,0,1]=3 247 B14R1.4522 NC(=O)c1nccnc1OC[N+](=O)[O-] 34a_100011830332_100000761209 [0,0,0,0,0,0|3,0,1]=4 248 B14R1.4522 NC(=O)c1nccnc1SCC(=O)[O-] 62a_100000094861_100020667443 [0,0,0,0,0,0|2,1,1]=4 249 B14R1.4522 NC(=O)c1nccnc1SCC(=O)[O-] 62a_100020667443_100000094861 [0,0,0,0,0,0|2,1,1]=4 250 B14R1.4522 NC(=S)c1ccccc1OCC(F)F 7a_100000745089_100011934356 [0,0,0,0,0,0|2,1,1]=4 251 B14R1.4522 O=C(O)c1ccccc1SC[N+](=O)[O-] 62a_202125556159_100000761209 [0,0,0,0,0,0|2,1,1]=4 252 B14R1.4522 O=C([O-])COc1ccccc1[N+](=O)[O-] 34a_100000186319_100020667443 [0,0,0,0,0,0|2,0,1]=3 253 B14R1.4522 O=C([O-])CSc1ccccc1C(=O)O 62a_100020667443_100000734275 [0,0,0,0,0,0|1,1,1]=3 254 B14R1.4522 O=C([O-])CSc1ccccc1C(=O)O 62a_202125556159_100020667443 [0,0,0,0,0,0|1,1,1]=3 255 B14R1.4522 O=C([O-])c1ccccc1OCC(F)F 7a_100015234032_100011934356 [0,0,0,0,0,0|3,0,1]=4 256 B14R1.4522 O=[N+]([O-])COc1ccccc1[N+](=O)[O-] 34a_100000186319_100000761209 [0,0,0,0,0,0|3,0,1]=4 257 B14R1.4522 [13CH3]C(=O)CCc1ccccc1[N+](=O)[O-] 1458a_100000746016_200025704644 [0,0,0,0,0,0|4,0,0]=4 258 B14R1.4522 [13CH3]C(=O)COc1ccccc1C(=O)N 1458a_100000182327_200025704644 [0,0,0,0,0,0|1,0,0]=1 259 B14R1.4522 [13CH3]C(=O)COc1ccccc1[N+](=O)[O-] 1458a_100000182526_200025704644 [0,0,0,0,0,0|3,0,0]=3 260 B14R1.4522 [13CH3]C(=O)CSc1ccccc1[N+](=O)[O-] 1458a_100000156278_200025704644 [0,0,0,0,0,0|3,1,0]=4 261 B14R1.4522 [13CH3]C(=O)c1ccccc1SCC(=O)N 1458a_100000180052_200025704644 [0,0,0,0,0,0|2,1,0]=3 262 B13R1.90 C#Cc1ccccc1OCC(=O)N 34a_200011470546_100000187820 [1,0,0,0,0,0|2,0,1]=4 263 B13R1.90 C#Cc1ccccc1OCC(=O)N 7a_200011470546_100000187820 [1,0,0,0,0,0|2,0,1]=4 264 B13R1.90 C#Cc1ccccc1OCC(=O)[O-] 34a_200011470546_100020667443 [1,0,0,0,0,0|1,0,2]=4 265 B13R1.90 C=C(C)COc1ccccc1CN 34a_100000185550_100000748629 [1,0,0,0,0,0|2,0,1]=4 266 B13R1.90 C=C(C)CSc1ccccc1C=O 62a_100000210073_100000211660 [1,0,0,0,0,0|2,1,0]=4 267 B13R1.90 C=C(C)CSc1ccccc1C=O 62a_100000748629_100000210073 [1,0,0,0,0,0|2,1,0]=4 268 B13R1.90 C=C(F)COc1ccccc1CN 34a_100000185550_100009893438 [1,0,0,0,0,0|2,0,1]=4 269 B13R1.90 C=C(F)CSc1ccccc1C=O 62a_100000042424_100000210073 [1,0,0,0,0,0|2,1,0]=4 270 B13R1.90 C=C(F)CSc1ccccc1C=O 62a_100000210073_100000042424 [1,0,0,0,0,0|2,1,0]=4 271 B13R1.90 C=Cc1ccccc1CCC(=O)N 271570a_100011290941_100009814947 [1,0,0,0,0,0|3,0,0]=4 272 B13R1.90 C=Cc1ccccc1NCC(=O)N 34a_100012022501_100000187820 [1,0,0,0,0,0|3,0,0]=4 273 B13R1.90 C=Cc1ccccc1NCC(=O)[O-] 34a_100012022501_100020667443 [1,0,0,0,0,0|2,0,1]=4 274 B13R1.90 C=Cc1ccccc1OCC(=O)N 271570a_100011290941_200000148491 [1,0,0,0,0,0|2,0,0]=3 275 B13R1.90 C=Cc1ccccc1SCC(=O)N 62a_100000747473_100011218376 [1,0,0,0,0,0|2,1,0]=4 276 B13R1.90 C=Cc1ccccc1SCC(=O)N 62a_100011218376_100000747473 [1,0,0,0,0,0|2,1,0]=4 277 B13R1.90 C=Cc1ccccc1SCC(=O)[O-] 62a_100011218376_100020667443 [1,0,0,0,0,0|1,1,1]=4 278 B13R1.90 C=Cc1ccccc1SCC(=O)[O-] 62a_100020667443_100011218376 [1,0,0,0,0,0|1,1,1]=4 279 B13R1.90 CC(=O)CCc1ccccc1C=O 1458a_100000070787_100010186698 [1,0,0,0,0,0|2,0,0]=3 280 B13R1.90 CC(=O)COc1ccccc1C#N 1458a_100000182527_200000210301 [1,0,0,0,0,0|1,0,2]=4 281 B13R1.90 CC(=O)COc1ccccc1CO 1458a_200011894254_200000210301 [1,0,0,0,0,0|1,0,2]=4 282 B13R1.90 CC(O)COc1ccccc1CN 34a_100000185550_100011218427 [1,0,0,0,0,0|1,0,2]=4 283 B13R1.90 CC(O)CSc1ccccc1C=O 62a_100000210073_100011218427 [1,0,0,0,0,0|1,1,1]=4 284 B13R1.90 CC(O)CSc1ccccc1C=O 62a_100011218427_100000210073 [1,0,0,0,0,0|1,1,1]=4 285 B13R1.90 CCc1ccccc1OCC(=O)C 1458a_100000182566_200000210301 [1,0,0,0,0,0|2,0,1]=4 286 B13R1.90 CCc1ccccc1OCC(=O)N 34a_100000210936_100000187820 [1,0,0,0,0,0|2,0,1]=4 287 B13R1.90 CCc1ccccc1OCC(=O)N 7a_100000210936_100000187820 [1,0,0,0,0,0|2,0,1]=4 288 B13R1.90 CCc1ccccc1OCC(=O)[13CH3] 1458a_100000182566_200025704644 [1,0,0,0,0,0|2,0,1]=4 289 B13R1.90 CCc1ccccc1OCC(=O)[O-] 34a_100000210936_100020667443 [1,0,0,0,0,0|1,0,2]=4 290 B13R1.90 CNc1ccccc1OCC(=O)N 34a_100000033821_100000187820 [1,0,0,0,0,0|3,0,0]=4 291 B13R1.90 CNc1ccccc1OCC(=O)[O-] 34a_100000033821_100020667443 [1,0,0,0,0,0|2,0,1]=4 292 B13R1.90 COc1ccccc1OCC(=O)C 1458a_100000182946_200000210301 [1,0,0,0,0,0|3,0,0]=4 293 B13R1.90 COc1ccccc1OCC(=O)N 34a_100000210385_100000187820 [1,0,0,0,0,0|3,0,0]=4 294 B13R1.90 COc1ccccc1OCC(=O)N 7a_100000162348_200000210301 [1,0,0,0,0,0|3,0,0]=4 295 B13R1.90 COc1ccccc1OCC(=O)[13CH3] 1458a_100000182946_200025704644 [1,0,0,0,0,0|3,0,0]=4 296 B13R1.90 COc1ccccc1OCC(=O)[O-] 34a_100000210385_100020667443 [1,0,0,0,0,0|2,0,1]=4 297 B13R1.90 CSc1ccccc1OCC(=O)N 34a_100011216402_100000187820 [1,0,0,0,0,0|3,0,0]=4 298 B13R1.90 CSc1ccccc1OCC(=O)N 62a_200000148491_200000210301 [1,0,0,0,0,0|3,0,0]=4 299 B13R1.90 CSc1ccccc1OCC(=O)[O-] 34a_100011216402_100020667443 [1,0,0,0,0,0|2,0,1]=4 300 B13R1.90 C[C@@H](O)COc1ccccc1CN 34a_100000185550_100009817552 [1,0,0,0,0,0|1,0,2]=4 301 B13R1.90 C[C@@H](O)CSc1ccccc1C=O 62a_100000210073_100009817552 [1,0,0,0,0,0|1,1,1]=4 302 B13R1.90 C[C@@H](O)CSc1ccccc1C=O 62a_100009817552_100000210073 [1,0,0,0,0,0|1,1,1]=4 303 B13R1.90 N#Cc1ccccc1OCC(=O)N 34a_100000211048_100000187820 [1,0,0,0,0,0|1,0,2]=4 304 B13R1.90 N#Cc1ccccc1OCC(=O)N 7a_100000211048_100000187820 [1,0,0,0,0,0|1,0,2]=4 305 B13R1.90 N#Cc1ccccc1OCC(=O)[O-] 34a_100000211048_100020667443 [1,0,0,0,0,0|0,0,3]=4 306 B13R1.90 NC(=O)COc1ccccc1CO 34a_100011216872_100000187820 [1,0,0,0,0,0|1,0,2]=4 307 B13R1.90 NC(=O)CSc1ccccc1C=O 62a_100000210073_100000747473 [1,0,0,0,0,0|1,1,0]=3 308 B13R1.90 NC(=O)CSc1ccccc1C=O 62a_100000747473_100000210073 [1,0,0,0,0,0|1,1,0]=3 309 B13R1.90 NC(=O)CSc1cccnc1C=O 62a_100000747473_100011934733 [1,0,0,0,0,0|2,1,0]=4 310 B13R1.90 NC(=O)CSc1cccnc1C=O 62a_100011934733_100000747473 [1,0,0,0,0,0|2,1,0]=4 311 B13R1.90 NC(=O)CSc1ccncc1C=O 62a_100000050567_100000747473 [1,0,0,0,0,0|2,1,0]=4 312 B13R1.90 NC(=O)CSc1ccncc1C=O 62a_100000747473_100000050567 [1,0,0,0,0,0|2,1,0]=4 313 B13R1.90 NC(=O)CSc1cnccc1C=O 62a_100000747473_100011934409 [1,0,0,0,0,0|2,1,0]=4 314 B13R1.90 NC(=O)CSc1cnccc1C=O 62a_100011934409_100000747473 [1,0,0,0,0,0|2,1,0]=4 315 B13R1.90 NC(=O)CSc1ncccc1C=O 62a_100000747473_100009816751 [1,0,0,0,0,0|2,1,0]=4 316 B13R1.90 NC(=O)CSc1ncccc1C=O 62a_100009816751_100000747473 [1,0,0,0,0,0|2,1,0]=4 317 B13R1.90 NCc1ccccc1OCC(=O)N 34a_100000185550_100000187820 [1,0,0,0,0,0|1,0,1]=3 318 B13R1.90 NCc1ccccc1OCC(=O)[O-] 34a_100000185550_100020667443 [1,0,0,0,0,0|0,0,2]=3 319 B13R1.90 NCc1ccccc1OC[N+](=O)[O-] 34a_100000185550_100000761209 [1,0,0,0,0,0|1,0,2]=4 320 B13R1.90 NCc1ccccc1SCC(=O)N 62a_100000689332_100000747473 [1,0,0,0,0,0|1,1,1]=4 321 B13R1.90 NCc1ccccc1SCC(=O)N 62a_100000747473_100000689332 [1,0,0,0,0,0|1,1,1]=4 322 B13R1.90 NCc1ccccc1SCC(=O)[O-] 62a_100000689332_100020667443 [1,0,0,0,0,0|0,1,2]=4 323 B13R1.90 NCc1ccccc1SCC(=O)[O-] 62a_100020667443_100000689332 [1,0,0,0,0,0|0,1,2]=4 324 B13R1.90 NNc1ccccc1SCC(=O)N 62a_100000241748_100000747473 [1,0,0,0,0,0|2,1,0]=4 325 B13R1.90 NNc1ccccc1SCC(=O)N 62a_100000747473_100000241748 [1,0,0,0,0,0|2,1,0]=4 326 B13R1.90 NNc1ccccc1SCC(=O)[O-] 62a_100000241748_100020667443 [1,0,0,0,0,0|1,1,1]=4 327 B13R1.90 NNc1ccccc1SCC(=O)[O-] 62a_100020667443_100000241748 [1,0,0,0,0,0|1,1,1]=4 328 B13R1.90 O=C([O-])COc1ccccc1CO 34a_100011216872_100020667443 [1,0,0,0,0,0|0,0,3]=4 329 B13R1.90 O=Cc1ccccc1SCC(=O)[O-] 62a_100000210073_100020667443 [1,0,0,0,0,0|0,1,1]=3 330 B13R1.90 O=Cc1ccccc1SCC(=O)[O-] 62a_100020667443_100000210073 [1,0,0,0,0,0|0,1,1]=3 331 B13R1.90 O=Cc1ccccc1SC[N+](=O)[O-] 62a_100000210073_100000761209 [1,0,0,0,0,0|1,1,1]=4 332 B13R1.90 O=Cc1cccnc1SCC(=O)[O-] 62a_100009816751_100020667443 [1,0,0,0,0,0|1,1,1]=4 333 B13R1.90 O=Cc1cccnc1SCC(=O)[O-] 62a_100020667443_100009816751 [1,0,0,0,0,0|1,1,1]=4 334 B13R1.90 O=Cc1ccncc1SCC(=O)[O-] 62a_100011934409_100020667443 [1,0,0,0,0,0|1,1,1]=4 335 B13R1.90 O=Cc1ccncc1SCC(=O)[O-] 62a_100020667443_100011934409 [1,0,0,0,0,0|1,1,1]=4 336 B13R1.90 O=Cc1cnccc1SCC(=O)[O-] 62a_100000050567_100020667443 [1,0,0,0,0,0|1,1,1]=4 337 B13R1.90 O=Cc1cnccc1SCC(=O)[O-] 62a_100020667443_100000050567 [1,0,0,0,0,0|1,1,1]=4 338 B13R1.90 O=Cc1ncccc1SCC(=O)[O-] 62a_100011934733_100020667443 [1,0,0,0,0,0|1,1,1]=4 339 B13R1.90 O=Cc1ncccc1SCC(=O)[O-] 62a_100020667443_100011934733 [1,0,0,0,0,0|1,1,1]=4 340 B13R1.90 [13CH3]C(=O)COc1ccccc1C#N 1458a_100000182527_200025704644 [1,0,0,0,0,0|1,0,2]=4 341 B13R1.90 [13CH3]C(=O)COc1ccccc1CO 1458a_200011894254_200025704644 [1,0,0,0,0,0|1,0,2]=4 342 B13R1.90 [13CH3]Oc1ccccc1OCC(=O)N 7a_100000162348_200025704644 [1,0,0,0,0,0|3,0,0]=4 343 B13R1.90 [13CH3]Sc1ccccc1OCC(=O)N 62a_200000148491_200025704644 [1,0,0,0,0,0|3,0,0]=4 344 B13R1.572 C#CCNc1ccccc1C(=O)N 34a_100000185089_100000184674 [1,0,0,0,0,0|2,0,1]=4 345 B13R1.572 C#CCOc1ccccc1C(=O)C 1458a_100000217172_200000210301 [1,0,0,0,0,0|2,0,1]=4 346 B13R1.572 C#CCOc1ccccc1C(=O)N 34a_100000192804_100000184674 [1,0,0,0,0,0|1,0,1]=3 347 B13R1.572 C#CCOc1ccccc1C(=O)N 7a_100000192804_100000038162 [1,0,0,0,0,0|1,0,1]=3 348 B13R1.572 C#CCOc1ccccc1C(=O)[13CH3] 1458a_100000217172_200025704644 [1,0,0,0,0,0|2,0,1]=4 349 B13R1.572 C#CCOc1ccccc1C(=O)[O-] 7a_100015234032_100000038162 [1,0,0,0,0,0|2,0,1]=4 350 B13R1.572 C#CCOc1ccccc1C(=S)N 7a_100000745089_100000038162 [1,0,0,0,0,0|1,1,1]=4 351 B13R1.572 C#CCOc1cccnc1C(=O)N 34a_200011215183_100000184674 [1,0,0,0,0,0|2,0,1]=4 352 B13R1.572 C#CCOc1cccnc1C(=O)N 7a_200011215183_100000038162 [1,0,0,0,0,0|2,0,1]=4 353 B13R1.572 C#CCOc1ccncc1C(=O)N 34a_200011998761_100000184674 [1,0,0,0,0,0|2,0,1]=4 354 B13R1.572 C#CCOc1cnccc1C(=O)N 7a_100012022987_100000038162 [1,0,0,0,0,0|2,0,1]=4 355 B13R1.572 C#CCSc1ccccc1C(=O)N 62a_100000038162_100000162227 [1,0,0,0,0,0|1,1,1]=4 356 B13R1.572 C=C(C)c1ccccc1CCC=O 271570a_100000694244_100011713448 [1,0,0,0,0,0|3,0,0]=4 357 B13R1.572 C=C(C)c1ccccc1NCC=O 34a_100000037685_200009817547 [1,0,0,0,0,0|3,0,0]=4 358 B13R1.572 C=C(C)c1ccccc1OCCO 271570a_100000694244_100000230753 [1,0,0,0,0,0|2,0,1]=4 359 B13R1.572 C=CCNc1ccccc1C(=O)N 34a_100000185089_100015514636 [1,0,0,0,0,0|2,0,0]=3 360 B13R1.572 C=CCNc1cccnc1C(=O)N 27a_100020586998_200012359670 [1,0,0,0,0,0|3,0,0]=4 361 B13R1.572 C=CCNc1ccncc1C(=O)N 27a_100020586998_100000697804 [1,0,0,0,0,0|3,0,0]=4 362 B13R1.572 C=CCNc1ncccc1C(=O)N 27a_100020586998_100000162199 [1,0,0,0,0,0|3,0,0]=4 363 B13R1.572 C=CCOc1ccccc1C(=O)C 1458a_100000189412_200000210301 [1,0,0,0,0,0|2,0,0]=3 364 B13R1.572 C=CCOc1ccccc1C(=O)N 34a_100000192804_100015514636 [1,0,0,0,0,0|1,0,0]=2 365 B13R1.572 C=CCOc1ccccc1C(=O)N 7a_100000192804_100015514636 [1,0,0,0,0,0|1,0,0]=2 366 B13R1.572 C=CCOc1ccccc1C(=O)[13CH3] 1458a_100000189412_200025704644 [1,0,0,0,0,0|2,0,0]=3 367 B13R1.572 C=CCOc1ccccc1C(=O)[O-] 7a_100015234032_100015514636 [1,0,0,0,0,0|2,0,0]=3 368 B13R1.572 C=CCOc1ccccc1C(=S)N 7a_100000745089_100015514636 [1,0,0,0,0,0|1,1,0]=3 369 B13R1.572 C=CCOc1ccccc1[C@@H](C)N 34a_100025703389_100015514636 [1,0,0,0,0,0|2,0,1]=4 370 B13R1.572 C=CCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100015514636 [1,0,0,0,0,0|3,0,0]=4 371 B13R1.572 C=CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100015514636 [1,0,0,0,0,0|3,0,0]=4 372 B13R1.572 C=CCOc1cccnc1C(=O)C 34a_100000087166_100015514636 [1,0,0,0,0,0|3,0,0]=4 373 B13R1.572 C=CCOc1cccnc1C(=O)C 7a_100000087166_100015514636 [1,0,0,0,0,0|3,0,0]=4 374 B13R1.572 C=CCOc1cccnc1C(=O)N 34a_200011215183_100015514636 [1,0,0,0,0,0|2,0,0]=3 375 B13R1.572 C=CCOc1cccnc1C(=O)N 7a_200011215183_100015514636 [1,0,0,0,0,0|2,0,0]=3 376 B13R1.572 C=CCOc1ccncc1C(=O)N 34a_200011998761_100015514636 [1,0,0,0,0,0|2,0,0]=3 377 B13R1.572 C=CCOc1cnccc1C(=O)C 7a_100009872882_100015514636 [1,0,0,0,0,0|3,0,0]=4 378 B13R1.572 C=CCOc1cnccc1C(=O)N 7a_100012022987_100015514636 [1,0,0,0,0,0|2,0,0]=3 379 B13R1.572 C=CCOc1nccnc1C(=O)N 34a_100011830332_100015514636 [1,0,0,0,0,0|3,0,0]=4 380 B13R1.572 C=CCSc1ccccc1C(=O)C 62a_100000751169_100000210623 [1,0,0,0,0,0|2,1,0]=4 381 B13R1.572 C=CCSc1ccccc1C(=O)N 62a_100000162227_100000210623 [1,0,0,0,0,0|1,1,0]=3 382 B13R1.572 C=CCSc1ccccc1C(=O)N 62a_100000210623_100000162227 [1,0,0,0,0,0|1,1,0]=3 383 B13R1.572 C=CCSc1ccccc1C(=O)O 62a_100000210623_100000734275 [1,0,0,0,0,0|2,1,0]=4 384 B13R1.572 C=CCSc1ccccc1C(=O)O 62a_202125556159_100000210623 [1,0,0,0,0,0|2,1,0]=4 385 B13R1.572 C=CCSc1cccnc1C(=O)N 62a_100000210623_200012359670 [1,0,0,0,0,0|2,1,0]=4 386 B13R1.572 C=CCSc1cccnc1C(=O)N 62a_200012359670_100000210623 [1,0,0,0,0,0|2,1,0]=4 387 B13R1.572 C=CCSc1ccncc1C(=O)N 62a_100000210623_100000697804 [1,0,0,0,0,0|2,1,0]=4 388 B13R1.572 C=CCSc1ccncc1C(=O)N 62a_100000697804_100000210623 [1,0,0,0,0,0|2,1,0]=4 389 B13R1.572 C=CCSc1cnccc1C(=O)N 62a_100000210623_100010205435 [1,0,0,0,0,0|2,1,0]=4 390 B13R1.572 C=CCSc1cnccc1C(=O)N 62a_100010205435_100000210623 [1,0,0,0,0,0|2,1,0]=4 391 B13R1.572 C=CCSc1ncccc1C(=O)N 62a_100000162199_100000210623 [1,0,0,0,0,0|2,1,0]=4 392 B13R1.572 C=CCSc1ncccc1C(=O)N 62a_100000210623_100000162199 [1,0,0,0,0,0|2,1,0]=4 393 B13R1.572 CC(=O)c1ccccc1OCCO 1458a_200000217288_200000210301 [1,0,0,0,0,0|1,0,1]=3 394 B13R1.572 CC(=O)c1ccccc1SCC=O 62a_100000751169_200015260668 [1,0,0,0,0,0|1,1,0]=3 395 B13R1.572 CC(=O)c1ccccc1SCCO 62a_100000751169_100000211926 [1,0,0,0,0,0|1,1,1]=4 396 B13R1.572 CC(=O)c1cccnc1SCC=O 62a_100000753718_200015260668 [1,0,0,0,0,0|2,1,0]=4 397 B13R1.572 CC(=O)c1cccnc1SCC=O 62a_200015260668_100000753718 [1,0,0,0,0,0|2,1,0]=4 398 B13R1.572 CC(=O)c1ccncc1OCC=O 7a_100009872882_200015260668 [1,0,0,0,0,0|2,0,0]=3 399 B13R1.572 CC(=O)c1ccncc1OCCO 7a_100009872882_100000211926 [1,0,0,0,0,0|2,0,1]=4 400 B13R1.572 CC(=O)c1ccncc1SCC=O 62a_100009993184_200015260668 [1,0,0,0,0,0|2,1,0]=4 401 B13R1.572 CC(=O)c1ccncc1SCC=O 62a_200015260668_100009993184 [1,0,0,0,0,0|2,1,0]=4 402 B13R1.572 CC(=O)c1cnccc1SCC=O 62a_100160469449_200015260668 [1,0,0,0,0,0|2,1,0]=4 403 B13R1.572 CC(=O)c1cnccc1SCC=O 62a_200015260668_100160469449 [1,0,0,0,0,0|2,1,0]=4 404 B13R1.572 CC(=O)c1ncccc1OCC=O 34a_100000087166_200009817547 [1,0,0,0,0,0|2,0,0]=3 405 B13R1.572 CC(=O)c1ncccc1OCC=O 7a_100000087166_200015260668 [1,0,0,0,0,0|2,0,0]=3 406 B13R1.572 CC(=O)c1ncccc1OCCO 34a_100000087166_100000211926 [1,0,0,0,0,0|2,0,1]=4 407 B13R1.572 CC(=O)c1ncccc1OCCO 7a_100000087166_100000211926 [1,0,0,0,0,0|2,0,1]=4 408 B13R1.572 CC(=O)c1ncccc1SCC=O 62a_100012348690_200015260668 [1,0,0,0,0,0|2,1,0]=4 409 B13R1.572 CC(=O)c1ncccc1SCC=O 62a_200015260668_100012348690 [1,0,0,0,0,0|2,1,0]=4 410 B13R1.572 CC(C)c1ccccc1OCC=O 34a_100000211617_200009817547 [1,0,0,0,0,0|2,0,1]=4 411 B13R1.572 CC(C)c1ccccc1OCC=O 7a_100000211617_200015260668 [1,0,0,0,0,0|2,0,1]=4 412 B13R1.572 CC(N)c1ccccc1SCC=O 62a_100000181357_200015260668 [1,0,0,0,0,0|1,1,1]=4 413 B13R1.572 CC(N)c1ccccc1SCC=O 62a_200015260668_100000181357 [1,0,0,0,0,0|1,1,1]=4 414 B13R1.572 CC(O)c1ccccc1OCC=O 34a_200011232679_200009817547 [1,0,0,0,0,0|1,0,2]=4 415 B13R1.572 CC(O)c1ccccc1OCC=O 7a_200011232679_200015260668 [1,0,0,0,0,0|1,0,2]=4 416 B13R1.572 CCCCc1ccccc1C(=O)N 271570a_100020621405_100000162227 [1,0,0,0,0,0|2,0,1]=4 417 B13R1.572 CCCNc1ccccc1C(=O)N 34a_100000185089_100000210303 [1,0,0,0,0,0|2,0,1]=4 418 B13R1.572 CCCOc1ccccc1C(=O)C 1458a_100000215688_200000210301 [1,0,0,0,0,0|2,0,1]=4 419 B13R1.572 CCCOc1ccccc1C(=O)N 34a_100000192804_100000210303 [1,0,0,0,0,0|1,0,1]=3 420 B13R1.572 CCCOc1ccccc1C(=O)N 7a_100000192804_100000210303 [1,0,0,0,0,0|1,0,1]=3 421 B13R1.572 CCCOc1ccccc1C(=O)[13CH3] 1458a_100000215688_200025704644 [1,0,0,0,0,0|2,0,1]=4 422 B13R1.572 CCCOc1ccccc1C(=O)[O-] 7a_100015234032_100000210303 [1,0,0,0,0,0|2,0,1]=4 423 B13R1.572 CCCOc1ccccc1C(=S)N 7a_100000745089_100000210303 [1,0,0,0,0,0|1,1,1]=4 424 B13R1.572 CCCOc1cccnc1C(=O)N 34a_200011215183_100000210303 [1,0,0,0,0,0|2,0,1]=4 425 B13R1.572 CCCOc1cccnc1C(=O)N 7a_200011215183_100000210303 [1,0,0,0,0,0|2,0,1]=4 426 B13R1.572 CCCOc1ccncc1C(=O)N 34a_200011998761_100000210303 [1,0,0,0,0,0|2,0,1]=4 427 B13R1.572 CCCOc1cnccc1C(=O)N 7a_100012022987_100000210303 [1,0,0,0,0,0|2,0,1]=4 428 B13R1.572 CCCSc1ccccc1C(=O)N 62a_100000162227_100000210303 [1,0,0,0,0,0|1,1,1]=4 429 B13R1.572 CCCSc1ccccc1C(=O)N 62a_100000210303_100000162227 [1,0,0,0,0,0|1,1,1]=4 430 B13R1.572 COCSc1ccccc1C(=O)N 62a_100000162227_100000766300 [1,0,0,0,0,0|2,1,0]=4 431 B13R1.572 COCSc1ccccc1C(=O)N 62a_100000766300_100000162227 [1,0,0,0,0,0|2,1,0]=4 432 B13R1.572 CS(=O)c1ccccc1SCC=O 62a_100000734199_200015260668 [1,0,0,0,0,0|2,1,0]=4 433 B13R1.572 CSCNc1ccccc1C(=O)N 34a_100000185089_100011218213 [1,0,0,0,0,0|3,0,0]=4 434 B13R1.572 CSCOc1ccccc1C(=O)N 34a_100000192804_100011218213 [1,0,0,0,0,0|2,0,0]=3 435 B13R1.572 CSCOc1cccnc1C(=O)N 34a_200011215183_100011218213 [1,0,0,0,0,0|3,0,0]=4 436 B13R1.572 CSCOc1ccncc1C(=O)N 34a_200011998761_100011218213 [1,0,0,0,0,0|3,0,0]=4 437 B13R1.572 CSCSc1ccccc1C(=O)N 62a_100000162227_100011218213 [1,0,0,0,0,0|2,1,0]=4 438 B13R1.572 CSCSc1ccccc1C(=O)N 62a_100011218213_100000162227 [1,0,0,0,0,0|2,1,0]=4 439 B13R1.572 C[C@@H](N)c1ccccc1OCC=O 34a_100025703389_200009817547 [1,0,0,0,0,0|1,0,1]=3 440 B13R1.572 C[C@@H](N)c1ccccc1OCCO 34a_100025703389_100000211926 [1,0,0,0,0,0|1,0,2]=4 441 B13R1.572 N#CCOc1ccccc1C(=O)N 7a_100000192804_100011215382 [1,0,0,0,0,0|1,0,1]=3 442 B13R1.572 N#CCOc1ccccc1C(=O)[O-] 7a_100015234032_100011215382 [1,0,0,0,0,0|2,0,1]=4 443 B13R1.572 N#CCOc1ccccc1C(=S)N 7a_100000745089_100011215382 [1,0,0,0,0,0|1,1,1]=4 444 B13R1.572 N#CCOc1cccnc1C(=O)N 7a_200011215183_100011215382 [1,0,0,0,0,0|2,0,1]=4 445 B13R1.572 N#CCOc1cnccc1C(=O)N 7a_100012022987_100011215382 [1,0,0,0,0,0|2,0,1]=4 446 B13R1.572 N#CCSc1ccccc1C(=O)N 62a_100000162227_100011215382 [1,0,0,0,0,0|1,1,1]=4 447 B13R1.572 N#CCSc1ccccc1C(=O)N 62a_100011215382_100000162227 [1,0,0,0,0,0|1,1,1]=4 448 B13R1.572 NC(=O)c1ccccc1NCC=O 34a_100000185089_200009817547 [1,0,0,0,0,0|1,0,0]=2 449 B13R1.572 NC(=O)c1ccccc1NCCF 34a_100000185089_100011217306 [1,0,0,0,0,0|2,0,1]=4 450 B13R1.572 NC(=O)c1ccccc1NCCO 34a_100000185089_100000211926 [1,0,0,0,0,0|1,0,1]=3 451 B13R1.572 NC(=O)c1ccccc1OCC=O 34a_100000192804_200009817547 [1,0,0,0,0,0|0,0,0]=1 452 B13R1.572 NC(=O)c1ccccc1OCC=O 7a_100000192804_200015260668 [1,0,0,0,0,0|0,0,0]=1 453 B13R1.572 NC(=O)c1ccccc1OCCF 34a_100000192804_100011217306 [1,0,0,0,0,0|1,0,1]=3 454 B13R1.572 NC(=O)c1ccccc1OCCF 7a_100000192804_100011217306 [1,0,0,0,0,0|1,0,1]=3 455 B13R1.572 NC(=O)c1ccccc1OCCO 34a_100000192804_100000211926 [1,0,0,0,0,0|0,0,1]=2 456 B13R1.572 NC(=O)c1ccccc1OCCO 7a_100000192804_100000211926 [1,0,0,0,0,0|0,0,1]=2 457 B13R1.572 NC(=O)c1ccccc1SCC=O 62a_100000162227_200015260668 [1,0,0,0,0,0|0,1,0]=2 458 B13R1.572 NC(=O)c1ccccc1SCC=O 62a_200015260668_100000162227 [1,0,0,0,0,0|0,1,0]=2 459 B13R1.572 NC(=O)c1ccccc1SCCF 62a_100000162227_100011217306 [1,0,0,0,0,0|1,1,1]=4 460 B13R1.572 NC(=O)c1ccccc1SCCF 62a_100011217306_100000162227 [1,0,0,0,0,0|1,1,1]=4 461 B13R1.572 NC(=O)c1ccccc1SCCO 62a_100000162227_100000211926 [1,0,0,0,0,0|0,1,1]=3 462 B13R1.572 NC(=O)c1ccccc1SCCO 62a_100000211926_100000162227 [1,0,0,0,0,0|0,1,1]=3 463 B13R1.572 NC(=O)c1cccnc1NCCO 27a_100000210304_100000162199 [1,0,0,0,0,0|2,0,1]=4 464 B13R1.572 NC(=O)c1cccnc1SCC=O 62a_100000162199_200015260668 [1,0,0,0,0,0|1,1,0]=3 465 B13R1.572 NC(=O)c1cccnc1SCC=O 62a_200015260668_100000162199 [1,0,0,0,0,0|1,1,0]=3 466 B13R1.572 NC(=O)c1cccnc1SCCO 62a_100000162199_100000211926 [1,0,0,0,0,0|1,1,1]=4 467 B13R1.572 NC(=O)c1cccnc1SCCO 62a_100000211926_100000162199 [1,0,0,0,0,0|1,1,1]=4 468 B13R1.572 NC(=O)c1ccncc1OCC=O 7a_100012022987_200015260668 [1,0,0,0,0,0|1,0,0]=2 469 B13R1.572 NC(=O)c1ccncc1OCCF 7a_100012022987_100011217306 [1,0,0,0,0,0|2,0,1]=4 470 B13R1.572 NC(=O)c1ccncc1OCCO 7a_100012022987_100000211926 [1,0,0,0,0,0|1,0,1]=3 471 B13R1.572 NC(=O)c1ccncc1SCC=O 62a_100010205435_200015260668 [1,0,0,0,0,0|1,1,0]=3 472 B13R1.572 NC(=O)c1ccncc1SCC=O 62a_200015260668_100010205435 [1,0,0,0,0,0|1,1,0]=3 473 B13R1.572 NC(=O)c1ccncc1SCCO 62a_100000211926_100010205435 [1,0,0,0,0,0|1,1,1]=4 474 B13R1.572 NC(=O)c1ccncc1SCCO 62a_100010205435_100000211926 [1,0,0,0,0,0|1,1,1]=4 475 B13R1.572 NC(=O)c1cnccc1NCCO 27a_100000210304_100000697804 [1,0,0,0,0,0|2,0,1]=4 476 B13R1.572 NC(=O)c1cnccc1OCC=O 34a_200011998761_200009817547 [1,0,0,0,0,0|1,0,0]=2 477 B13R1.572 NC(=O)c1cnccc1OCCF 34a_200011998761_100011217306 [1,0,0,0,0,0|2,0,1]=4 478 B13R1.572 NC(=O)c1cnccc1OCCO 34a_200011998761_100000211926 [1,0,0,0,0,0|1,0,1]=3 479 B13R1.572 NC(=O)c1cnccc1SCC=O 62a_100000697804_200015260668 [1,0,0,0,0,0|1,1,0]=3 480 B13R1.572 NC(=O)c1cnccc1SCC=O 62a_200015260668_100000697804 [1,0,0,0,0,0|1,1,0]=3 481 B13R1.572 NC(=O)c1cnccc1SCCO 62a_100000211926_100000697804 [1,0,0,0,0,0|1,1,1]=4 482 B13R1.572 NC(=O)c1cnccc1SCCO 62a_100000697804_100000211926 [1,0,0,0,0,0|1,1,1]=4 483 B13R1.572 NC(=O)c1ncccc1NCCO 27a_100000210304_200012359670 [1,0,0,0,0,0|2,0,1]=4 484 B13R1.572 NC(=O)c1ncccc1OCC=O 34a_200011215183_200009817547 [1,0,0,0,0,0|1,0,0]=2 485 B13R1.572 NC(=O)c1ncccc1OCC=O 7a_200011215183_200015260668 [1,0,0,0,0,0|1,0,0]=2 486 B13R1.572 NC(=O)c1ncccc1OCCF 34a_200011215183_100011217306 [1,0,0,0,0,0|2,0,1]=4 487 B13R1.572 NC(=O)c1ncccc1OCCF 7a_200011215183_100011217306 [1,0,0,0,0,0|2,0,1]=4 488 B13R1.572 NC(=O)c1ncccc1OCCO 34a_200011215183_100000211926 [1,0,0,0,0,0|1,0,1]=3 489 B13R1.572 NC(=O)c1ncccc1OCCO 7a_200011215183_100000211926 [1,0,0,0,0,0|1,0,1]=3 490 B13R1.572 NC(=O)c1ncccc1SCC=O 62a_200012359670_200015260668 [1,0,0,0,0,0|1,1,0]=3 491 B13R1.572 NC(=O)c1ncccc1SCC=O 62a_200015260668_200012359670 [1,0,0,0,0,0|1,1,0]=3 492 B13R1.572 NC(=O)c1ncccc1SCCO 62a_100000211926_200012359670 [1,0,0,0,0,0|1,1,1]=4 493 B13R1.572 NC(=O)c1ncccc1SCCO 62a_200012359670_100000211926 [1,0,0,0,0,0|1,1,1]=4 494 B13R1.572 NC(=O)c1nccnc1OCC=O 34a_100011830332_200009817547 [1,0,0,0,0,0|2,0,0]=3 495 B13R1.572 NC(=O)c1nccnc1OCCO 34a_100011830332_100000211926 [1,0,0,0,0,0|2,0,1]=4 496 B13R1.572 NC(=O)c1nccnc1SCC=O 62a_100000094861_200015260668 [1,0,0,0,0,0|2,1,0]=4 497 B13R1.572 NC(=O)c1nccnc1SCC=O 62a_200015260668_100000094861 [1,0,0,0,0,0|2,1,0]=4 498 B13R1.572 NC(=S)c1ccccc1OCC=O 7a_100000745089_200015260668 [1,0,0,0,0,0|0,1,0]=2 499 B13R1.572 NC(=S)c1ccccc1OCCF 7a_100000745089_100011217306 [1,0,0,0,0,0|1,1,1]=4 500 B13R1.572 NC(=S)c1ccccc1OCCO 7a_100000745089_100000211926 [1,0,0,0,0,0|0,1,1]=3 501 B13R1.572 O=C(O)c1ccccc1SCCO 62a_100000211926_100000734275 [1,0,0,0,0,0|1,1,1]=4 502 B13R1.572 O=C(O)c1ccccc1SCCO 62a_202125556159_100000211926 [1,0,0,0,0,0|1,1,1]=4 503 B13R1.572 O=C([O-])c1ccccc1OCCF 7a_100015234032_100011217306 [1,0,0,0,0,0|2,0,1]=4 504 B13R1.572 O=C([O-])c1ccccc1OCCO 7a_100015234032_100000211926 [1,0,0,0,0,0|1,0,1]=3 505 B13R1.572 O=CCOc1ccccc1C(=O)[O-] 7a_100015234032_200015260668 [1,0,0,0,0,0|1,0,0]=2 506 B13R1.572 O=CCOc1ccccc1[N+](=O)[O-] 34a_100000186319_200009817547 [1,0,0,0,0,0|2,0,0]=3 507 B13R1.572 O=CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_200015260668 [1,0,0,0,0,0|2,0,0]=3 508 B13R1.572 O=CCOc1cccnc1[N+](=O)[O-] 7a_100000183951_200015260668 [1,0,0,0,0,0|3,0,0]=4 509 B13R1.572 O=CCSc1ccccc1C(=O)O 62a_200015260668_100000734275 [1,0,0,0,0,0|1,1,0]=3 510 B13R1.572 O=CCSc1ccccc1C(=O)O 62a_202125556159_200015260668 [1,0,0,0,0,0|1,1,0]=3 511 B13R1.572 O=[N+]([O-])c1ccccc1OCCO 34a_100000186319_100000211926 [1,0,0,0,0,0|2,0,1]=4 512 B13R1.572 O=[N+]([O-])c1ccccc1OCCO 7a_100000186319_100000211926 [1,0,0,0,0,0|2,0,1]=4 513 B13R1.572 [13CH3]C(=O)c1ccccc1OCCO 1458a_200000217288_200025704644 [1,0,0,0,0,0|1,0,1]=3 514 B15R1.508 CC(C)(C)COc1ccccc1C(=O)N 34a_100000192804_100011219605 [0,1,0,0,0,0|2,0,1]=4 515 B15R1.508 CC(C)(F)COc1ccccc1C(=O)N 34a_100000192804_100011997219 [0,1,0,0,0,0|2,0,1]=4 516 B15R1.508 CC(C)(O)CNc1ccccc1C(=O)N 34a_100000185089_100000764493 [0,1,0,0,0,0|2,0,1]=4 517 B15R1.508 CC(C)(O)COc1ccccc1C(=O)N 34a_100000192804_100000764493 [0,1,0,0,0,0|1,0,1]=3 518 B15R1.508 CC(C)(O)COc1ccccc1C(=O)N 7a_100000192804_100000764493 [0,1,0,0,0,0|1,0,1]=3 519 B15R1.508 CC(C)(O)COc1ccccc1C(=O)[O-] 7a_100015234032_100000764493 [0,1,0,0,0,0|2,0,1]=4 520 B15R1.508 CC(C)(O)COc1ccccc1C(=S)N 7a_100000745089_100000764493 [0,1,0,0,0,0|1,1,1]=4 521 B15R1.508 CC(C)(O)COc1cccnc1C(=O)N 34a_200011215183_100000764493 [0,1,0,0,0,0|2,0,1]=4 522 B15R1.508 CC(C)(O)COc1cccnc1C(=O)N 7a_200011215183_100000764493 [0,1,0,0,0,0|2,0,1]=4 523 B15R1.508 CC(C)(O)COc1ccncc1C(=O)N 34a_200011998761_100000764493 [0,1,0,0,0,0|2,0,1]=4 524 B15R1.508 CC(C)(O)COc1cnccc1C(=O)N 7a_100012022987_100000764493 [0,1,0,0,0,0|2,0,1]=4 525 B15R1.508 CC(C)(O)CSc1ccccc1C(=O)N 62a_100000162227_100000764493 [0,1,0,0,0,0|1,1,1]=4 526 B15R1.508 CC(C)(O)CSc1ccccc1C(=O)N 62a_100000764493_100000162227 [0,1,0,0,0,0|1,1,1]=4 527 B15R1.508 C[Si](C)(C)COc1ccccc1C(=O)N 7a_100000192804_100000233785 [0,1,0,0,0,0|2,1,0]=4 528 B15R1.508 NC(=O)c1ccccc1NCS(=O)(=O)[O-] 34a_100000185089_100009817235 [0,1,0,0,0,0|2,0,1]=4 529 B15R1.508 NC(=O)c1ccccc1OCS(=O)(=O)[O-] 34a_100000192804_100009817235 [0,1,0,0,0,0|1,0,1]=3 530 B15R1.508 NC(=O)c1ccccc1SCS(=O)(=O)N 62a_100000162227_100000741382 [0,1,0,0,0,0|1,1,1]=4 531 B15R1.508 NC(=O)c1ccccc1SCS(=O)(=O)N 62a_100000741382_100000162227 [0,1,0,0,0,0|1,1,1]=4 532 B15R1.508 NC(=O)c1ccccc1SCS(=O)(=O)[O-] 62a_100000162227_100009817235 [0,1,0,0,0,0|1,1,1]=4 533 B15R1.508 NC(=O)c1ccccc1SCS(=O)(=O)[O-] 62a_100009817235_100000162227 [0,1,0,0,0,0|1,1,1]=4 534 B15R1.508 NC(=O)c1cnccc1OCS(=O)(=O)[O-] 34a_200011998761_100009817235 [0,1,0,0,0,0|2,0,1]=4 535 B15R1.508 NC(=O)c1ncccc1OCS(=O)(=O)[O-] 34a_200011215183_100009817235 [0,1,0,0,0,0|2,0,1]=4 536 B15R1.985 C=C(C)CNc1ccccc1C(=O)NC 27a_100000765925_100000155073 [0,1,0,0,0,0|3,0,0]=4 537 B15R1.985 C=C(C)CNc1ccccc1C(=O)NC 34a_100000185696_100000748629 [0,1,0,0,0,0|3,0,0]=4 538 B15R1.985 C=C(C)COc1ccccc1C(=O)CBr 7a_100000188908_100000748629 [0,1,0,0,0,0|3,0,0]=4 539 B15R1.985 C=C(C)COc1ccccc1C(=O)CC 1458a_100000217157_100000210202 [0,1,0,0,0,0|3,0,0]=4 540 B15R1.985 C=C(C)COc1ccccc1C(=O)CC 7a_100000184720_100000748629 [0,1,0,0,0,0|3,0,0]=4 541 B15R1.985 C=C(C)COc1ccccc1C(=O)CF 1458a_100000217157_100015361967 [0,1,0,0,0,0|3,0,0]=4 542 B15R1.985 C=C(C)COc1ccccc1C(=O)NC 11a_106832991635_100000217157 [0,1,0,0,0,0|2,0,0]=3 543 B15R1.985 C=C(C)COc1ccccc1C(=O)NC 1626a_100102657272_100000217157 [0,1,0,0,0,0|2,0,0]=3 544 B15R1.985 C=C(C)COc1ccccc1C(=O)NC 240690a_100102657272_100000217157 [0,1,0,0,0,0|2,0,0]=3 545 B15R1.985 C=C(C)COc1ccccc1C(=O)NC 34a_100000185920_100000748629 [0,1,0,0,0,0|2,0,0]=3 546 B15R1.985 C=C(C)COc1ccccc1C(=O)NC 527a_100102657272_100000217157 [0,1,0,0,0,0|2,0,0]=3 547 B15R1.985 C=C(C)COc1ccccc1C(=O)NC 7a_100000185920_100000748629 [0,1,0,0,0,0|2,0,0]=3 548 B15R1.985 C=C(C)COc1ccccc1C(=O)NN 34a_100000186518_100000748629 [0,1,0,0,0,0|2,0,0]=3 549 B15R1.985 C=C(C)COc1ccccc1C(=O)NO 34a_100000188472_100000748629 [0,1,0,0,0,0|2,0,0]=3 550 B15R1.985 C=C(C)COc1ccccc1C(=O)OC 7a_100000150335_100000748629 [0,1,0,0,0,0|3,0,0]=4 551 B15R1.985 C=C(C)COc1cccnc1C(=O)NC 34a_100011376092_100000748629 [0,1,0,0,0,0|3,0,0]=4 552 B15R1.985 C=C(C)COc1cccnc1C(=O)NC 7a_100011376092_100000748629 [0,1,0,0,0,0|3,0,0]=4 553 B15R1.985 C=C(C)CSc1ccccc1C(=O)NC 62a_100000155073_100000211660 [0,1,0,0,0,0|2,1,0]=4 554 B15R1.985 C=C(C)CSc1ccccc1C(=O)NC 62a_100000748629_100000155073 [0,1,0,0,0,0|2,1,0]=4 555 B15R1.985 C=C(C)CSc1ccccc1C(=O)NN 62a_100000190081_100000211660 [0,1,0,0,0,0|2,1,0]=4 556 B15R1.985 C=C(C)CSc1ccccc1C(=O)NN 62a_100000748629_100000190081 [0,1,0,0,0,0|2,1,0]=4 557 B15R1.985 C=C(F)CNc1ccccc1C(=O)NC 34a_100000185696_100009893438 [0,1,0,0,0,0|3,0,0]=4 558 B15R1.985 C=C(F)COc1ccccc1C(=O)CBr 7a_100000188908_100000042424 [0,1,0,0,0,0|3,0,0]=4 559 B15R1.985 C=C(F)COc1ccccc1C(=O)CC 7a_100000184720_100000042424 [0,1,0,0,0,0|3,0,0]=4 560 B15R1.985 C=C(F)COc1ccccc1C(=O)NC 34a_100000185920_100009893438 [0,1,0,0,0,0|2,0,0]=3 561 B15R1.985 C=C(F)COc1ccccc1C(=O)NC 7a_100000185920_100000042424 [0,1,0,0,0,0|2,0,0]=3 562 B15R1.985 C=C(F)COc1ccccc1C(=O)NN 34a_100000186518_100009893438 [0,1,0,0,0,0|2,0,0]=3 563 B15R1.985 C=C(F)COc1ccccc1C(=O)NO 34a_100000188472_100009893438 [0,1,0,0,0,0|2,0,0]=3 564 B15R1.985 C=C(F)COc1ccccc1C(=O)OC 7a_100000150335_100000042424 [0,1,0,0,0,0|3,0,0]=4 565 B15R1.985 C=C(F)COc1cccnc1C(=O)NC 34a_100011376092_100009893438 [0,1,0,0,0,0|3,0,0]=4 566 B15R1.985 C=C(F)COc1cccnc1C(=O)NC 7a_100011376092_100000042424 [0,1,0,0,0,0|3,0,0]=4 567 B15R1.985 C=C(F)CSc1ccccc1C(=O)NC 62a_100000042424_100000155073 [0,1,0,0,0,0|2,1,0]=4 568 B15R1.985 C=C(F)CSc1ccccc1C(=O)NC 62a_100000155073_100000042424 [0,1,0,0,0,0|2,1,0]=4 569 B15R1.985 C=C(F)CSc1ccccc1C(=O)NN 62a_100000042424_100000190081 [0,1,0,0,0,0|2,1,0]=4 570 B15R1.985 C=C(F)CSc1ccccc1C(=O)NN 62a_100000190081_100000042424 [0,1,0,0,0,0|2,1,0]=4 571 B15R1.985 CC(=NO)c1ccccc1OCC(=O)N 34a_100000164216_100000187820 [0,1,0,0,0,0|2,0,1]=4 572 B15R1.985 CC(=NO)c1ccccc1OCC(=O)[O-] 34a_100000164216_100020667443 [0,1,0,0,0,0|1,0,2]=4 573 B15R1.985 CC(C)COc1ccccc1C(=O)NN 34a_100000186518_100000210624 [0,1,0,0,0,0|2,0,1]=4 574 B15R1.985 CC(C)COc1ccccc1C(=O)NO 34a_100000188472_100000210624 [0,1,0,0,0,0|2,0,1]=4 575 B15R1.985 CC(O)COc1ccccc1C(=O)CBr 7a_100000188908_100011218427 [0,1,0,0,0,0|2,0,1]=4 576 B15R1.985 CC(O)COc1ccccc1C(=O)NN 34a_100000186518_100011218427 [0,1,0,0,0,0|1,0,1]=3 577 B15R1.985 CC(O)COc1ccccc1C(=O)NO 34a_100000188472_100011218427 [0,1,0,0,0,0|1,0,1]=3 578 B15R1.985 CC(O)CSc1ccccc1C(=O)NN 62a_100000190081_100011218427 [0,1,0,0,0,0|1,1,1]=4 579 B15R1.985 CC(O)CSc1ccccc1C(=O)NN 62a_100011218427_100000190081 [0,1,0,0,0,0|1,1,1]=4 580 B15R1.985 CCC(=O)c1ccccc1OCC(=O)N 7a_100000184720_100000187820 [0,1,0,0,0,0|2,0,0]=3 581 B15R1.985 CCC(=O)c1ccccc1OCC(C)O 7a_100000184720_100011218427 [0,1,0,0,0,0|2,0,1]=4 582 B15R1.985 CCC(=O)c1ccccc1OC[C@@H](C)O 7a_100000184720_100009817552 [0,1,0,0,0,0|2,0,1]=4 583 B15R1.985 CCC(=O)c1ccccc1SCC(=O)N 1458a_100000180052_100000210202 [0,1,0,0,0,0|2,1,0]=4 584 B15R1.985 CNC(=O)c1ccccc1NCC(=O)N 34a_100000185696_100000187820 [0,1,0,0,0,0|2,0,0]=3 585 B15R1.985 CNC(=O)c1ccccc1NCC(=O)[O-] 34a_100000185696_100020667443 [0,1,0,0,0,0|1,0,1]=3 586 B15R1.985 CNC(=O)c1ccccc1NCC(C)O 27a_100000210904_100000155073 [0,1,0,0,0,0|2,0,1]=4 587 B15R1.985 CNC(=O)c1ccccc1NCC(C)O 34a_100000185696_100011218427 [0,1,0,0,0,0|2,0,1]=4 588 B15R1.985 CNC(=O)c1ccccc1NC[C@@H](C)O 34a_100000185696_100009817552 [0,1,0,0,0,0|2,0,1]=4 589 B15R1.985 CNC(=O)c1ccccc1NC[N+](=O)[O-] 34a_100000185696_100000761209 [0,1,0,0,0,0|2,0,1]=4 590 B15R1.985 CNC(=O)c1ccccc1OCC(=O)N 34a_100000185920_100000187820 [0,1,0,0,0,0|1,0,0]=2 591 B15R1.985 CNC(=O)c1ccccc1OCC(=O)N 7a_100000185920_100000187820 [0,1,0,0,0,0|1,0,0]=2 592 B15R1.985 CNC(=O)c1ccccc1OCC(=O)[O-] 34a_100000185920_100020667443 [0,1,0,0,0,0|0,0,1]=2 593 B15R1.985 CNC(=O)c1ccccc1OCC(C)C 34a_100000185920_100000210624 [0,1,0,0,0,0|2,0,1]=4 594 B15R1.985 CNC(=O)c1ccccc1OCC(C)C 7a_100000185920_100000210760 [0,1,0,0,0,0|2,0,1]=4 595 B15R1.985 CNC(=O)c1ccccc1OCC(C)O 34a_100000185920_100011218427 [0,1,0,0,0,0|1,0,1]=3 596 B15R1.985 CNC(=O)c1ccccc1OCC(C)O 7a_100000185920_100011218427 [0,1,0,0,0,0|1,0,1]=3 597 B15R1.985 CNC(=O)c1ccccc1OCC(F)F 34a_100000185920_100011934356 [0,1,0,0,0,0|2,0,1]=4 598 B15R1.985 CNC(=O)c1ccccc1OCC(F)F 7a_100000185920_100011934356 [0,1,0,0,0,0|2,0,1]=4 599 B15R1.985 CNC(=O)c1ccccc1OC[C@@H](C)O 34a_100000185920_100009817552 [0,1,0,0,0,0|1,0,1]=3 600 B15R1.985 CNC(=O)c1ccccc1OC[C@@H](C)O 7a_100000185920_100009817552 [0,1,0,0,0,0|1,0,1]=3 601 B15R1.985 CNC(=O)c1ccccc1OC[N+](=O)[O-] 34a_100000185920_100000761209 [0,1,0,0,0,0|1,0,1]=3 602 B15R1.985 CNC(=O)c1ccccc1SCC(=O)N 11a_106832991635_100000180052 [0,1,0,0,0,0|1,1,0]=3 603 B15R1.985 CNC(=O)c1ccccc1SCC(=O)N 240690a_100102657272_100000180052 [0,1,0,0,0,0|1,1,0]=3 604 B15R1.985 CNC(=O)c1ccccc1SCC(=O)N 527a_100102657272_100000180052 [0,1,0,0,0,0|1,1,0]=3 605 B15R1.985 CNC(=O)c1ccccc1SCC(=O)N 62a_100000155073_100000747473 [0,1,0,0,0,0|1,1,0]=3 606 B15R1.985 CNC(=O)c1ccccc1SCC(=O)N 62a_100000747473_100000155073 [0,1,0,0,0,0|1,1,0]=3 607 B15R1.985 CNC(=O)c1ccccc1SCC(=O)[O-] 62a_100000155073_100020667443 [0,1,0,0,0,0|0,1,1]=3 608 B15R1.985 CNC(=O)c1ccccc1SCC(=O)[O-] 62a_100020667443_100000155073 [0,1,0,0,0,0|0,1,1]=3 609 B15R1.985 CNC(=O)c1ccccc1SCC(C)O 62a_100000155073_100011218427 [0,1,0,0,0,0|1,1,1]=4 610 B15R1.985 CNC(=O)c1ccccc1SCC(C)O 62a_100011218427_100000155073 [0,1,0,0,0,0|1,1,1]=4 611 B15R1.985 CNC(=O)c1ccccc1SC[C@@H](C)O 62a_100000155073_100009817552 [0,1,0,0,0,0|1,1,1]=4 612 B15R1.985 CNC(=O)c1ccccc1SC[C@@H](C)O 62a_100009817552_100000155073 [0,1,0,0,0,0|1,1,1]=4 613 B15R1.985 CNC(=O)c1ccccc1SC[N+](=O)[O-] 62a_100000155073_100000761209 [0,1,0,0,0,0|1,1,1]=4 614 B15R1.985 CNC(=O)c1cccnc1SCC(=O)N 62a_100000159833_100000747473 [0,1,0,0,0,0|2,1,0]=4 615 B15R1.985 CNC(=O)c1cccnc1SCC(=O)N 62a_100000747473_100000159833 [0,1,0,0,0,0|2,1,0]=4 616 B15R1.985 CNC(=O)c1cccnc1SCC(=O)[O-] 62a_100000159833_100020667443 [0,1,0,0,0,0|1,1,1]=4 617 B15R1.985 CNC(=O)c1cccnc1SCC(=O)[O-] 62a_100020667443_100000159833 [0,1,0,0,0,0|1,1,1]=4 618 B15R1.985 CNC(=O)c1ncccc1OCC(=O)N 34a_100011376092_100000187820 [0,1,0,0,0,0|2,0,0]=3 619 B15R1.985 CNC(=O)c1ncccc1OCC(=O)N 7a_100011376092_100000187820 [0,1,0,0,0,0|2,0,0]=3 620 B15R1.985 CNC(=O)c1ncccc1OCC(=O)[O-] 34a_100011376092_100020667443 [0,1,0,0,0,0|1,0,1]=3 621 B15R1.985 CNC(=O)c1ncccc1OCC(C)O 34a_100011376092_100011218427 [0,1,0,0,0,0|2,0,1]=4 622 B15R1.985 CNC(=O)c1ncccc1OCC(C)O 7a_100011376092_100011218427 [0,1,0,0,0,0|2,0,1]=4 623 B15R1.985 CNC(=O)c1ncccc1OC[C@@H](C)O 34a_100011376092_100009817552 [0,1,0,0,0,0|2,0,1]=4 624 B15R1.985 CNC(=O)c1ncccc1OC[C@@H](C)O 7a_100011376092_100009817552 [0,1,0,0,0,0|2,0,1]=4 625 B15R1.985 CNC(=O)c1ncccc1OC[N+](=O)[O-] 34a_100011376092_100000761209 [0,1,0,0,0,0|2,0,1]=4 626 B15R1.985 COC(=O)c1ccccc1CCC(=O)C 1458a_100000070787_200010284099 [0,1,0,0,0,0|3,0,0]=4 627 B15R1.985 COC(=O)c1ccccc1CCC(=O)C 1458a_100000694103_200000210301 [0,1,0,0,0,0|3,0,0]=4 628 B15R1.985 COC(=O)c1ccccc1CCC(=O)[13CH3] 1458a_100000694103_200025704644 [0,1,0,0,0,0|3,0,0]=4 629 B15R1.985 COC(=O)c1ccccc1OCC(=O)N 7a_100000150335_100000187820 [0,1,0,0,0,0|2,0,0]=3 630 B15R1.985 COC(=O)c1ccccc1OCC(C)O 7a_100000150335_100011218427 [0,1,0,0,0,0|2,0,1]=4 631 B15R1.985 COC(=O)c1ccccc1OC[C@@H](C)O 7a_100000150335_100009817552 [0,1,0,0,0,0|2,0,1]=4 632 B15R1.985 COC(=O)c1ccccc1SCC(=O)N 62a_100000148710_100000747473 [0,1,0,0,0,0|2,1,0]=4 633 B15R1.985 COC(=O)c1ccccc1SCC(=O)N 62a_100000747473_100000148710 [0,1,0,0,0,0|2,1,0]=4 634 B15R1.985 COC(=O)c1ccccc1SCC(=O)[O-] 62a_100000148710_100020667443 [0,1,0,0,0,0|1,1,1]=4 635 B15R1.985 COC(=O)c1ccccc1SCC(=O)[O-] 62a_100020667443_100000148710 [0,1,0,0,0,0|1,1,1]=4 636 B15R1.985 COC(=O)c1ncccc1OCC(=O)N 34a_100000744052_100000187820 [0,1,0,0,0,0|3,0,0]=4 637 B15R1.985 COC(=O)c1ncccc1OCC(=O)N 7a_100000744052_100000187820 [0,1,0,0,0,0|3,0,0]=4 638 B15R1.985 COC(=O)c1ncccc1OCC(=O)[O-] 34a_100000744052_100020667443 [0,1,0,0,0,0|2,0,1]=4 639 B15R1.985 C[C@@H](O)COc1ccccc1C(=O)CBr 7a_100000188908_100009817552 [0,1,0,0,0,0|2,0,1]=4 640 B15R1.985 C[C@@H](O)COc1ccccc1C(=O)NN 34a_100000186518_100009817552 [0,1,0,0,0,0|1,0,1]=3 641 B15R1.985 C[C@@H](O)COc1ccccc1C(=O)NO 34a_100000188472_100009817552 [0,1,0,0,0,0|1,0,1]=3 642 B15R1.985 C[C@@H](O)CSc1ccccc1C(=O)NN 62a_100000190081_100009817552 [0,1,0,0,0,0|1,1,1]=4 643 B15R1.985 C[C@@H](O)CSc1ccccc1C(=O)NN 62a_100009817552_100000190081 [0,1,0,0,0,0|1,1,1]=4 644 B15R1.985 NC(=O)COc1ccccc1C(=O)CBr 7a_100000188908_100000187820 [0,1,0,0,0,0|2,0,0]=3 645 B15R1.985 NC(=O)COc1ccccc1C(=O)NO 34a_100000188472_100000187820 [0,1,0,0,0,0|1,0,0]=2 646 B15R1.985 NC(=O)CSc1ccccc1C(=O)CF 1458a_100000180052_100015361967 [0,1,0,0,0,0|2,1,0]=4 647 B15R1.985 NC(=O)CSc1ccccc1C(=O)O[Na] 62a_100000747473_114855342371 [0,1,0,0,0,0|2,1,0]=4 648 B15R1.985 NNC(=O)c1ccccc1OCC(=O)N 34a_100000186518_100000187820 [0,1,0,0,0,0|1,0,0]=2 649 B15R1.985 NNC(=O)c1ccccc1OCC(=O)[O-] 34a_100000186518_100020667443 [0,1,0,0,0,0|0,0,1]=2 650 B15R1.985 NNC(=O)c1ccccc1OCC(F)F 34a_100000186518_100011934356 [0,1,0,0,0,0|2,0,1]=4 651 B15R1.985 NNC(=O)c1ccccc1OC[N+](=O)[O-] 34a_100000186518_100000761209 [0,1,0,0,0,0|1,0,1]=3 652 B15R1.985 NNC(=O)c1ccccc1SCC(=O)N 62a_100000190081_100000747473 [0,1,0,0,0,0|1,1,0]=3 653 B15R1.985 NNC(=O)c1ccccc1SCC(=O)N 62a_100000747473_100000190081 [0,1,0,0,0,0|1,1,0]=3 654 B15R1.985 NNC(=O)c1ccccc1SCC(=O)[O-] 62a_100000190081_100020667443 [0,1,0,0,0,0|0,1,1]=3 655 B15R1.985 NNC(=O)c1ccccc1SCC(=O)[O-] 62a_100020667443_100000190081 [0,1,0,0,0,0|0,1,1]=3 656 B15R1.985 NNC(=O)c1ccccc1SC[N+](=O)[O-] 62a_100000190081_100000761209 [0,1,0,0,0,0|1,1,1]=4 657 B15R1.985 O=C(NO)c1ccccc1OCC(F)F 34a_100000188472_100011934356 [0,1,0,0,0,0|2,0,1]=4 658 B15R1.985 O=C(NO)c1ccccc1OC[N+](=O)[O-] 34a_100000188472_100000761209 [0,1,0,0,0,0|1,0,1]=3 659 B15R1.985 O=C([O-])COc1ccccc1C(=O)NO 34a_100000188472_100020667443 [0,1,0,0,0,0|0,0,1]=2 660 B15R1.985 O=C([O-])CSc1ccccc1C(=O)O[Na] 62a_100020667443_114855342371 [0,1,0,0,0,0|1,1,1]=4 661 B15R1.1108 C=C(C#N)CNc1ccccc1C(=O)N 34a_100000185089_100000694840 [0,1,0,0,0,0|3,0,0]=4 662 B15R1.1108 C=C(C#N)COc1ccccc1C(=O)N 34a_100000192804_100000694840 [0,1,0,0,0,0|2,0,0]=3 663 B15R1.1108 C=C(C#N)COc1cccnc1C(=O)N 34a_200011215183_100000694840 [0,1,0,0,0,0|3,0,0]=4 664 B15R1.1108 C=C(C#N)COc1ccncc1C(=O)N 34a_200011998761_100000694840 [0,1,0,0,0,0|3,0,0]=4 665 B15R1.1108 C=C(C#N)CSc1ccccc1C(=O)N 62a_100000162227_100000694840 [0,1,0,0,0,0|2,1,0]=4 666 B15R1.1108 C=C(C)c1ccccc1CCC(=O)OC 271570a_100000694244_100009815308 [0,1,0,0,0,0|3,0,0]=4 667 B15R1.1108 C=C(C)c1ccccc1NCC(=O)OC 34a_100000037685_100000747449 [0,1,0,0,0,0|3,0,0]=4 668 B15R1.1108 C=C(C)c1ccccc1OCC(=O)NC 271570a_100000694244_200000148481 [0,1,0,0,0,0|3,0,0]=4 669 B15R1.1108 C=C(C)c1ccccc1OCC(=O)NN 271570a_100000694244_100025785231 [0,1,0,0,0,0|3,0,0]=4 670 B15R1.1108 C=C(C)c1ccccc1OCC(=O)OC 271570a_100000694244_200000173920 [0,1,0,0,0,0|2,0,0]=3 671 B15R1.1108 C=CC(O)CNc1ccccc1C(=O)N 34a_100000185089_100000730141 [0,1,0,0,0,0|2,0,1]=4 672 B15R1.1108 C=CC(O)COc1ccccc1C(=O)N 34a_100000192804_100000730141 [0,1,0,0,0,0|1,0,1]=3 673 B15R1.1108 C=CC(O)COc1ccccc1C(=O)N 7a_100000192804_100000730141 [0,1,0,0,0,0|1,0,1]=3 674 B15R1.1108 C=CC(O)COc1ccccc1C(=O)[O-] 7a_100015234032_100000730141 [0,1,0,0,0,0|2,0,1]=4 675 B15R1.1108 C=CC(O)COc1ccccc1C(=S)N 7a_100000745089_100000730141 [0,1,0,0,0,0|1,1,1]=4 676 B15R1.1108 C=CC(O)COc1cccnc1C(=O)N 34a_200011215183_100000730141 [0,1,0,0,0,0|2,0,1]=4 677 B15R1.1108 C=CC(O)COc1cccnc1C(=O)N 7a_200011215183_100000730141 [0,1,0,0,0,0|2,0,1]=4 678 B15R1.1108 C=CC(O)COc1ccncc1C(=O)N 34a_200011998761_100000730141 [0,1,0,0,0,0|2,0,1]=4 679 B15R1.1108 C=CC(O)COc1cnccc1C(=O)N 7a_100012022987_100000730141 [0,1,0,0,0,0|2,0,1]=4 680 B15R1.1108 C=CC(O)CSc1ccccc1C(=O)N 62a_100000162227_100000730141 [0,1,0,0,0,0|1,1,1]=4 681 B15R1.1108 C=CC(O)CSc1ccccc1C(=O)N 62a_100000730141_100000162227 [0,1,0,0,0,0|1,1,1]=4 682 B15R1.1108 CCC(=O)COc1ccccc1C(=O)N 1458a_100000182327_100000210202 [0,1,0,0,0,0|1,0,0]=2 683 B15R1.1108 CCC(=O)COc1ccccc1C(=O)N 7a_100000192804_100000747405 [0,1,0,0,0,0|1,0,0]=2 684 B15R1.1108 CCC(=O)COc1ccccc1C(=O)[O-] 7a_100015234032_100000747405 [0,1,0,0,0,0|2,0,0]=3 685 B15R1.1108 CCC(=O)COc1ccccc1C(=S)N 7a_100000745089_100000747405 [0,1,0,0,0,0|1,1,0]=3 686 B15R1.1108 CCC(=O)COc1ccccc1[N+](=O)[O-] 1458a_100000182526_100000210202 [0,1,0,0,0,0|3,0,0]=4 687 B15R1.1108 CCC(=O)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100000747405 [0,1,0,0,0,0|3,0,0]=4 688 B15R1.1108 CCC(=O)COc1cccnc1C(=O)C 7a_100000087166_100000747405 [0,1,0,0,0,0|3,0,0]=4 689 B15R1.1108 CCC(=O)COc1cccnc1C(=O)N 7a_200011215183_100000747405 [0,1,0,0,0,0|2,0,0]=3 690 B15R1.1108 CCC(=O)COc1cnccc1C(=O)C 7a_100009872882_100000747405 [0,1,0,0,0,0|3,0,0]=4 691 B15R1.1108 CCC(=O)COc1cnccc1C(=O)N 7a_100012022987_100000747405 [0,1,0,0,0,0|2,0,0]=3 692 B15R1.1108 CCC(=O)CSc1ccccc1C(=O)C 62a_100000751169_100000747405 [0,1,0,0,0,0|2,1,0]=4 693 B15R1.1108 CCC(=O)CSc1ccccc1C(=O)N 62a_100000162227_100000747405 [0,1,0,0,0,0|1,1,0]=3 694 B15R1.1108 CCC(=O)CSc1ccccc1C(=O)N 62a_100000747405_100000162227 [0,1,0,0,0,0|1,1,0]=3 695 B15R1.1108 CCC(=O)CSc1ccccc1C(=O)O 62a_100000747405_100000734275 [0,1,0,0,0,0|2,1,0]=4 696 B15R1.1108 CCC(=O)CSc1ccccc1C(=O)O 62a_202125556159_100000747405 [0,1,0,0,0,0|2,1,0]=4 697 B15R1.1108 CCC(=O)CSc1cccnc1C(=O)N 62a_100000747405_200012359670 [0,1,0,0,0,0|2,1,0]=4 698 B15R1.1108 CCC(=O)CSc1cccnc1C(=O)N 62a_200012359670_100000747405 [0,1,0,0,0,0|2,1,0]=4 699 B15R1.1108 CCC(=O)CSc1ccncc1C(=O)N 62a_100000697804_100000747405 [0,1,0,0,0,0|2,1,0]=4 700 B15R1.1108 CCC(=O)CSc1ccncc1C(=O)N 62a_100000747405_100000697804 [0,1,0,0,0,0|2,1,0]=4 701 B15R1.1108 CCC(=O)CSc1cnccc1C(=O)N 62a_100000747405_100010205435 [0,1,0,0,0,0|2,1,0]=4 702 B15R1.1108 CCC(=O)CSc1cnccc1C(=O)N 62a_100010205435_100000747405 [0,1,0,0,0,0|2,1,0]=4 703 B15R1.1108 CCC(=O)CSc1ncccc1C(=O)N 62a_100000162199_100000747405 [0,1,0,0,0,0|2,1,0]=4 704 B15R1.1108 CCC(=O)CSc1ncccc1C(=O)N 62a_100000747405_100000162199 [0,1,0,0,0,0|2,1,0]=4 705 B15R1.1108 CCC(C)COc1ccccc1C(=O)N 34a_100000192804_100000748023 [0,1,0,0,0,0|2,0,1]=4 706 B15R1.1108 CCC(C)COc1ccccc1C(=O)N 7a_100000192804_100000748023 [0,1,0,0,0,0|2,0,1]=4 707 B15R1.1108 CCC(O)CNc1ccccc1C(=O)N 34a_100000185089_100011218378 [0,1,0,0,0,0|2,0,1]=4 708 B15R1.1108 CCC(O)COc1ccccc1C(=O)N 34a_100000192804_100011218378 [0,1,0,0,0,0|1,0,1]=3 709 B15R1.1108 CCC(O)COc1ccccc1C(=O)N 7a_100000192804_100011218378 [0,1,0,0,0,0|1,0,1]=3 710 B15R1.1108 CCC(O)COc1ccccc1C(=O)[O-] 7a_100015234032_100011218378 [0,1,0,0,0,0|2,0,1]=4 711 B15R1.1108 CCC(O)COc1ccccc1C(=S)N 7a_100000745089_100011218378 [0,1,0,0,0,0|1,1,1]=4 712 B15R1.1108 CCC(O)COc1cccnc1C(=O)N 34a_200011215183_100011218378 [0,1,0,0,0,0|2,0,1]=4 713 B15R1.1108 CCC(O)COc1cccnc1C(=O)N 7a_200011215183_100011218378 [0,1,0,0,0,0|2,0,1]=4 714 B15R1.1108 CCC(O)COc1ccncc1C(=O)N 34a_200011998761_100011218378 [0,1,0,0,0,0|2,0,1]=4 715 B15R1.1108 CCC(O)COc1cnccc1C(=O)N 7a_100012022987_100011218378 [0,1,0,0,0,0|2,0,1]=4 716 B15R1.1108 CCC(O)CSc1ccccc1C(=O)N 62a_100000162227_100011218378 [0,1,0,0,0,0|1,1,1]=4 717 B15R1.1108 CCC(O)CSc1ccccc1C(=O)N 62a_100011218378_100000162227 [0,1,0,0,0,0|1,1,1]=4 718 B15R1.1108 CC[C@H](C)COc1ccccc1C(=O)N 34a_100000192804_100009816398 [0,1,0,0,0,0|2,0,1]=4 719 B15R1.1108 CC[C@H](C)COc1ccccc1C(=O)N 7a_100000192804_100009816398 [0,1,0,0,0,0|2,0,1]=4 720 B15R1.1108 CNC(=O)CNc1ccccc1C(=O)N 34a_100000185089_100000183359 [0,1,0,0,0,0|2,0,0]=3 721 B15R1.1108 CNC(=O)CNc1cccnc1C(=O)N 27a_100000693194_200012359670 [0,1,0,0,0,0|3,0,0]=4 722 B15R1.1108 CNC(=O)CNc1ccncc1C(=O)N 27a_100000693194_100000697804 [0,1,0,0,0,0|3,0,0]=4 723 B15R1.1108 CNC(=O)CNc1ncccc1C(=O)N 27a_100000693194_100000162199 [0,1,0,0,0,0|3,0,0]=4 724 B15R1.1108 CNC(=O)COc1ccccc1C(=O)N 240690a_100102657272_100000182327 [0,1,0,0,0,0|1,0,0]=2 725 B15R1.1108 CNC(=O)COc1ccccc1C(=O)N 34a_100000192804_100000183359 [0,1,0,0,0,0|1,0,0]=2 726 B15R1.1108 CNC(=O)COc1ccccc1C(=O)N 7a_100000192804_100000183359 [0,1,0,0,0,0|1,0,0]=2 727 B15R1.1108 CNC(=O)COc1ccccc1C(=O)[O-] 7a_100015234032_100000183359 [0,1,0,0,0,0|2,0,0]=3 728 B15R1.1108 CNC(=O)COc1ccccc1C(=S)N 7a_100000745089_100000183359 [0,1,0,0,0,0|1,1,0]=3 729 B15R1.1108 CNC(=O)COc1ccccc1[C@@H](C)N 34a_100025703389_100000183359 [0,1,0,0,0,0|2,0,1]=4 730 B15R1.1108 CNC(=O)COc1ccccc1[N+](=O)[O-] 11a_106832991635_100000182526 [0,1,0,0,0,0|3,0,0]=4 731 B15R1.1108 CNC(=O)COc1ccccc1[N+](=O)[O-] 1626a_100102657272_100000182526 [0,1,0,0,0,0|3,0,0]=4 732 B15R1.1108 CNC(=O)COc1ccccc1[N+](=O)[O-] 240690a_100102657272_100000182526 [0,1,0,0,0,0|3,0,0]=4 733 B15R1.1108 CNC(=O)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100000183359 [0,1,0,0,0,0|3,0,0]=4 734 B15R1.1108 CNC(=O)COc1ccccc1[N+](=O)[O-] 527a_100102657272_100000182526 [0,1,0,0,0,0|3,0,0]=4 735 B15R1.1108 CNC(=O)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100000183359 [0,1,0,0,0,0|3,0,0]=4 736 B15R1.1108 CNC(=O)COc1cccnc1C(=O)C 34a_100000087166_100000183359 [0,1,0,0,0,0|3,0,0]=4 737 B15R1.1108 CNC(=O)COc1cccnc1C(=O)C 7a_100000087166_100000183359 [0,1,0,0,0,0|3,0,0]=4 738 B15R1.1108 CNC(=O)COc1cccnc1C(=O)N 34a_200011215183_100000183359 [0,1,0,0,0,0|2,0,0]=3 739 B15R1.1108 CNC(=O)COc1cccnc1C(=O)N 7a_200011215183_100000183359 [0,1,0,0,0,0|2,0,0]=3 740 B15R1.1108 CNC(=O)COc1ccncc1C(=O)N 34a_200011998761_100000183359 [0,1,0,0,0,0|2,0,0]=3 741 B15R1.1108 CNC(=O)COc1cnccc1C(=O)C 7a_100009872882_100000183359 [0,1,0,0,0,0|3,0,0]=4 742 B15R1.1108 CNC(=O)COc1cnccc1C(=O)N 7a_100012022987_100000183359 [0,1,0,0,0,0|2,0,0]=3 743 B15R1.1108 CNC(=O)COc1nccnc1C(=O)N 34a_100011830332_100000183359 [0,1,0,0,0,0|3,0,0]=4 744 B15R1.1108 CNC(=O)CSc1ccccc1C(=O)C 62a_100000751169_100000183359 [0,1,0,0,0,0|2,1,0]=4 745 B15R1.1108 CNC(=O)CSc1ccccc1C(=O)N 62a_100000162227_100000183359 [0,1,0,0,0,0|1,1,0]=3 746 B15R1.1108 CNC(=O)CSc1ccccc1C(=O)N 62a_100000183359_100000162227 [0,1,0,0,0,0|1,1,0]=3 747 B15R1.1108 CNC(=O)CSc1ccccc1C(=O)O 62a_100000183359_100000734275 [0,1,0,0,0,0|2,1,0]=4 748 B15R1.1108 CNC(=O)CSc1ccccc1C(=O)O 62a_202125556159_100000183359 [0,1,0,0,0,0|2,1,0]=4 749 B15R1.1108 CNC(=O)CSc1cccnc1C(=O)N 62a_100000183359_200012359670 [0,1,0,0,0,0|2,1,0]=4 750 B15R1.1108 CNC(=O)CSc1cccnc1C(=O)N 62a_200012359670_100000183359 [0,1,0,0,0,0|2,1,0]=4 751 B15R1.1108 CNC(=O)CSc1ccncc1C(=O)N 62a_100000183359_100000697804 [0,1,0,0,0,0|2,1,0]=4 752 B15R1.1108 CNC(=O)CSc1ccncc1C(=O)N 62a_100000697804_100000183359 [0,1,0,0,0,0|2,1,0]=4 753 B15R1.1108 CNC(=O)CSc1cnccc1C(=O)N 62a_100000183359_100010205435 [0,1,0,0,0,0|2,1,0]=4 754 B15R1.1108 CNC(=O)CSc1cnccc1C(=O)N 62a_100010205435_100000183359 [0,1,0,0,0,0|2,1,0]=4 755 B15R1.1108 CNC(=O)CSc1ncccc1C(=O)N 62a_100000162199_100000183359 [0,1,0,0,0,0|2,1,0]=4 756 B15R1.1108 CNC(=O)CSc1ncccc1C(=O)N 62a_100000183359_100000162199 [0,1,0,0,0,0|2,1,0]=4 757 B15R1.1108 COC(=O)CNc1ccccc1C(=O)N 34a_100000185089_100000747449 [0,1,0,0,0,0|1,0,0]=2 758 B15R1.1108 COC(=O)COc1ccccc1C(=O)N 34a_100000192804_100000747449 [0,1,0,0,0,0|0,0,0]=1 759 B15R1.1108 COC(=O)COc1ccccc1C(=O)N 7a_100000192804_100000747449 [0,1,0,0,0,0|0,0,0]=1 760 B15R1.1108 COC(=O)COc1ccccc1C(=O)[O-] 7a_100015234032_100000747449 [0,1,0,0,0,0|1,0,0]=2 761 B15R1.1108 COC(=O)COc1ccccc1C(=S)N 7a_100000745089_100000747449 [0,1,0,0,0,0|0,1,0]=2 762 B15R1.1108 COC(=O)COc1ccccc1C(C)C 34a_100000211617_100000747449 [0,1,0,0,0,0|2,0,1]=4 763 B15R1.1108 COC(=O)COc1ccccc1C(C)C 7a_100000211617_100000747449 [0,1,0,0,0,0|2,0,1]=4 764 B15R1.1108 COC(=O)COc1ccccc1C(C)O 34a_200011232679_100000747449 [0,1,0,0,0,0|1,0,2]=4 765 B15R1.1108 COC(=O)COc1ccccc1C(C)O 7a_200011232679_100000747449 [0,1,0,0,0,0|1,0,2]=4 766 B15R1.1108 COC(=O)COc1ccccc1[C@@H](C)N 34a_100025703389_100000747449 [0,1,0,0,0,0|1,0,1]=3 767 B15R1.1108 COC(=O)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100000747449 [0,1,0,0,0,0|2,0,0]=3 768 B15R1.1108 COC(=O)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100000747449 [0,1,0,0,0,0|2,0,0]=3 769 B15R1.1108 COC(=O)COc1cccnc1C(=O)C 34a_100000087166_100000747449 [0,1,0,0,0,0|2,0,0]=3 770 B15R1.1108 COC(=O)COc1cccnc1C(=O)C 7a_100000087166_100000747449 [0,1,0,0,0,0|2,0,0]=3 771 B15R1.1108 COC(=O)COc1cccnc1C(=O)N 34a_200011215183_100000747449 [0,1,0,0,0,0|1,0,0]=2 772 B15R1.1108 COC(=O)COc1cccnc1C(=O)N 7a_200011215183_100000747449 [0,1,0,0,0,0|1,0,0]=2 773 B15R1.1108 COC(=O)COc1cccnc1[N+](=O)[O-] 7a_100000183951_100000747449 [0,1,0,0,0,0|3,0,0]=4 774 B15R1.1108 COC(=O)COc1ccncc1C(=O)N 34a_200011998761_100000747449 [0,1,0,0,0,0|1,0,0]=2 775 B15R1.1108 COC(=O)COc1cnccc1C(=O)C 7a_100009872882_100000747449 [0,1,0,0,0,0|2,0,0]=3 776 B15R1.1108 COC(=O)COc1cnccc1C(=O)N 7a_100012022987_100000747449 [0,1,0,0,0,0|1,0,0]=2 777 B15R1.1108 COC(=O)COc1nccnc1C(=O)N 34a_100011830332_100000747449 [0,1,0,0,0,0|2,0,0]=3 778 B15R1.1108 COC(=O)CSc1ccccc1C(=O)C 62a_100000751169_100000747449 [0,1,0,0,0,0|1,1,0]=3 779 B15R1.1108 COC(=O)CSc1ccccc1C(=O)N 62a_100000162227_100000747449 [0,1,0,0,0,0|0,1,0]=2 780 B15R1.1108 COC(=O)CSc1ccccc1C(=O)N 62a_100000747449_100000162227 [0,1,0,0,0,0|0,1,0]=2 781 B15R1.1108 COC(=O)CSc1ccccc1C(=O)O 62a_100000747449_100000734275 [0,1,0,0,0,0|1,1,0]=3 782 B15R1.1108 COC(=O)CSc1ccccc1C(=O)O 62a_202125556159_100000747449 [0,1,0,0,0,0|1,1,0]=3 783 B15R1.1108 COC(=O)CSc1ccccc1C(C)N 62a_100000181357_100000747449 [0,1,0,0,0,0|1,1,1]=4 784 B15R1.1108 COC(=O)CSc1ccccc1C(C)N 62a_100000747449_100000181357 [0,1,0,0,0,0|1,1,1]=4 785 B15R1.1108 COC(=O)CSc1ccccc1S(=O)C 62a_100000734199_100000747449 [0,1,0,0,0,0|2,1,0]=4 786 B15R1.1108 COC(=O)CSc1cccnc1C(=O)C 62a_100000747449_100012348690 [0,1,0,0,0,0|2,1,0]=4 787 B15R1.1108 COC(=O)CSc1cccnc1C(=O)C 62a_100012348690_100000747449 [0,1,0,0,0,0|2,1,0]=4 788 B15R1.1108 COC(=O)CSc1cccnc1C(=O)N 62a_100000747449_200012359670 [0,1,0,0,0,0|1,1,0]=3 789 B15R1.1108 COC(=O)CSc1cccnc1C(=O)N 62a_200012359670_100000747449 [0,1,0,0,0,0|1,1,0]=3 790 B15R1.1108 COC(=O)CSc1ccncc1C(=O)C 62a_100000747449_100160469449 [0,1,0,0,0,0|2,1,0]=4 791 B15R1.1108 COC(=O)CSc1ccncc1C(=O)C 62a_100160469449_100000747449 [0,1,0,0,0,0|2,1,0]=4 792 B15R1.1108 COC(=O)CSc1ccncc1C(=O)N 62a_100000697804_100000747449 [0,1,0,0,0,0|1,1,0]=3 793 B15R1.1108 COC(=O)CSc1ccncc1C(=O)N 62a_100000747449_100000697804 [0,1,0,0,0,0|1,1,0]=3 794 B15R1.1108 COC(=O)CSc1cnccc1C(=O)C 62a_100000747449_100009993184 [0,1,0,0,0,0|2,1,0]=4 795 B15R1.1108 COC(=O)CSc1cnccc1C(=O)C 62a_100009993184_100000747449 [0,1,0,0,0,0|2,1,0]=4 796 B15R1.1108 COC(=O)CSc1cnccc1C(=O)N 62a_100000747449_100010205435 [0,1,0,0,0,0|1,1,0]=3 797 B15R1.1108 COC(=O)CSc1cnccc1C(=O)N 62a_100010205435_100000747449 [0,1,0,0,0,0|1,1,0]=3 798 B15R1.1108 COC(=O)CSc1ncccc1C(=O)C 62a_100000747449_100000753718 [0,1,0,0,0,0|2,1,0]=4 799 B15R1.1108 COC(=O)CSc1ncccc1C(=O)C 62a_100000753718_100000747449 [0,1,0,0,0,0|2,1,0]=4 800 B15R1.1108 COC(=O)CSc1ncccc1C(=O)N 62a_100000162199_100000747449 [0,1,0,0,0,0|1,1,0]=3 801 B15R1.1108 COC(=O)CSc1ncccc1C(=O)N 62a_100000747449_100000162199 [0,1,0,0,0,0|1,1,0]=3 802 B15R1.1108 COC(=O)CSc1nccnc1C(=O)N 62a_100000094861_100000747449 [0,1,0,0,0,0|2,1,0]=4 803 B15R1.1108 COC(=O)CSc1nccnc1C(=O)N 62a_100000747449_100000094861 [0,1,0,0,0,0|2,1,0]=4 804 B15R1.1108 C[C@@H](CO)CNc1ccccc1C(=O)N 34a_100000185089_100000059175 [0,1,0,0,0,0|2,0,1]=4 805 B15R1.1108 C[C@@H](CO)COc1ccccc1C(=O)N 34a_100000192804_100000059175 [0,1,0,0,0,0|1,0,1]=3 806 B15R1.1108 C[C@@H](CO)COc1ccccc1C(=O)N 7a_100000192804_100000059175 [0,1,0,0,0,0|1,0,1]=3 807 B15R1.1108 C[C@@H](CO)COc1ccccc1C(=O)[O-] 7a_100015234032_100000059175 [0,1,0,0,0,0|2,0,1]=4 808 B15R1.1108 C[C@@H](CO)COc1ccccc1C(=S)N 7a_100000745089_100000059175 [0,1,0,0,0,0|1,1,1]=4 809 B15R1.1108 C[C@@H](CO)COc1cccnc1C(=O)N 34a_200011215183_100000059175 [0,1,0,0,0,0|2,0,1]=4 810 B15R1.1108 C[C@@H](CO)COc1cccnc1C(=O)N 7a_200011215183_100000059175 [0,1,0,0,0,0|2,0,1]=4 811 B15R1.1108 C[C@@H](CO)COc1ccncc1C(=O)N 34a_200011998761_100000059175 [0,1,0,0,0,0|2,0,1]=4 812 B15R1.1108 C[C@@H](CO)COc1cnccc1C(=O)N 7a_100012022987_100000059175 [0,1,0,0,0,0|2,0,1]=4 813 B15R1.1108 C[C@@H](CO)CSc1ccccc1C(=O)N 62a_100000059175_100000162227 [0,1,0,0,0,0|1,1,1]=4 814 B15R1.1108 C[C@@H](CO)CSc1ccccc1C(=O)N 62a_100000162227_100000059175 [0,1,0,0,0,0|1,1,1]=4 815 B15R1.1108 NC(=O)c1ccccc1NCC(O)CO 34a_100000185089_100011219619 [0,1,0,0,0,0|1,0,2]=4 816 B15R1.1108 NC(=O)c1ccccc1NC[C@@H](O)CF 34a_100000185089_100015614560 [0,1,0,0,0,0|2,0,1]=4 817 B15R1.1108 NC(=O)c1ccccc1NC[C@@H](O)CO 34a_100000185089_100009815848 [0,1,0,0,0,0|1,0,2]=4 818 B15R1.1108 NC(=O)c1ccccc1OCC(=O)CF 1458a_100000182327_100015361967 [0,1,0,0,0,0|1,0,0]=2 819 B15R1.1108 NC(=O)c1ccccc1OCC(O)CO 34a_100000192804_100011219619 [0,1,0,0,0,0|0,0,2]=3 820 B15R1.1108 NC(=O)c1ccccc1OCC(O)CO 7a_100000192804_100011219619 [0,1,0,0,0,0|0,0,2]=3 821 B15R1.1108 NC(=O)c1ccccc1OC[C@@H](O)CF 34a_100000192804_100015614560 [0,1,0,0,0,0|1,0,1]=3 822 B15R1.1108 NC(=O)c1ccccc1OC[C@@H](O)CF 7a_100000192804_100015614560 [0,1,0,0,0,0|1,0,1]=3 823 B15R1.1108 NC(=O)c1ccccc1OC[C@@H](O)CO 34a_100000192804_100009815848 [0,1,0,0,0,0|0,0,2]=3 824 B15R1.1108 NC(=O)c1ccccc1OC[C@@H](O)CO 7a_100000192804_100009815848 [0,1,0,0,0,0|0,0,2]=3 825 B15R1.1108 NC(=O)c1ccccc1SCC(O)CO 62a_100000162227_100011219619 [0,1,0,0,0,0|0,1,2]=4 826 B15R1.1108 NC(=O)c1ccccc1SCC(O)CO 62a_100011219619_100000162227 [0,1,0,0,0,0|0,1,2]=4 827 B15R1.1108 NC(=O)c1ccccc1SC[C@@H](O)CF 62a_100000162227_100015614560 [0,1,0,0,0,0|1,1,1]=4 828 B15R1.1108 NC(=O)c1ccccc1SC[C@@H](O)CF 62a_100015614560_100000162227 [0,1,0,0,0,0|1,1,1]=4 829 B15R1.1108 NC(=O)c1ccccc1SC[C@@H](O)CO 62a_100000162227_100009815848 [0,1,0,0,0,0|0,1,2]=4 830 B15R1.1108 NC(=O)c1ccccc1SC[C@@H](O)CO 62a_100009815848_100000162227 [0,1,0,0,0,0|0,1,2]=4 831 B15R1.1108 NC(=O)c1ccncc1OCC(O)CO 7a_100012022987_100011219619 [0,1,0,0,0,0|1,0,2]=4 832 B15R1.1108 NC(=O)c1ccncc1OC[C@@H](O)CF 7a_100012022987_100015614560 [0,1,0,0,0,0|2,0,1]=4 833 B15R1.1108 NC(=O)c1ccncc1OC[C@@H](O)CO 7a_100012022987_100009815848 [0,1,0,0,0,0|1,0,2]=4 834 B15R1.1108 NC(=O)c1cnccc1OCC(O)CO 34a_200011998761_100011219619 [0,1,0,0,0,0|1,0,2]=4 835 B15R1.1108 NC(=O)c1cnccc1OC[C@@H](O)CF 34a_200011998761_100015614560 [0,1,0,0,0,0|2,0,1]=4 836 B15R1.1108 NC(=O)c1cnccc1OC[C@@H](O)CO 34a_200011998761_100009815848 [0,1,0,0,0,0|1,0,2]=4 837 B15R1.1108 NC(=O)c1ncccc1OCC(O)CO 34a_200011215183_100011219619 [0,1,0,0,0,0|1,0,2]=4 838 B15R1.1108 NC(=O)c1ncccc1OCC(O)CO 7a_200011215183_100011219619 [0,1,0,0,0,0|1,0,2]=4 839 B15R1.1108 NC(=O)c1ncccc1OC[C@@H](O)CF 34a_200011215183_100015614560 [0,1,0,0,0,0|2,0,1]=4 840 B15R1.1108 NC(=O)c1ncccc1OC[C@@H](O)CF 7a_200011215183_100015614560 [0,1,0,0,0,0|2,0,1]=4 841 B15R1.1108 NC(=O)c1ncccc1OC[C@@H](O)CO 34a_200011215183_100009815848 [0,1,0,0,0,0|1,0,2]=4 842 B15R1.1108 NC(=O)c1ncccc1OC[C@@H](O)CO 7a_200011215183_100009815848 [0,1,0,0,0,0|1,0,2]=4 843 B15R1.1108 NC(=S)c1ccccc1OCC(O)CO 7a_100000745089_100011219619 [0,1,0,0,0,0|0,1,2]=4 844 B15R1.1108 NC(=S)c1ccccc1OC[C@@H](O)CF 7a_100000745089_100015614560 [0,1,0,0,0,0|1,1,1]=4 845 B15R1.1108 NC(=S)c1ccccc1OC[C@@H](O)CO 7a_100000745089_100009815848 [0,1,0,0,0,0|0,1,2]=4 846 B15R1.1108 O=C(CF)COc1ccccc1[N+](=O)[O-] 1458a_100000182526_100015361967 [0,1,0,0,0,0|3,0,0]=4 847 B15R1.1108 O=C(CO)CCc1ccccc1[N+](=O)[O-] 1458a_100000210174_200011934512 [0,1,0,0,0,0|3,0,0]=4 848 B15R1.1108 O=C([O-])c1ccccc1OCC(O)CO 7a_100015234032_100011219619 [0,1,0,0,0,0|1,0,2]=4 849 B15R1.1108 O=C([O-])c1ccccc1OC[C@@H](O)CF 7a_100015234032_100015614560 [0,1,0,0,0,0|2,0,1]=4 850 B15R1.1108 O=C([O-])c1ccccc1OC[C@@H](O)CO 7a_100015234032_100009815848 [0,1,0,0,0,0|1,0,2]=4 851 B15R1.5509 C=C(C)CN(C)c1ccccc1C(=O)N 269982a_100000184419_100000748629 [0,1,0,0,0,0|3,0,0]=4 852 B15R1.5509 C=C(F)CN(C)c1ccccc1C(=O)N 269982a_100000184419_100009893438 [0,1,0,0,0,0|3,0,0]=4 853 B15R1.5509 CC(O)CN(C)c1ccccc1C(=O)N 269982a_100000184419_100011218427 [0,1,0,0,0,0|2,0,1]=4 854 B15R1.5509 CN(CC(=O)N)c1ccccc1C(=O)N 2230a_100000020997_200000210301 [0,1,0,0,0,0|2,0,0]=3 855 B15R1.5509 CN(CC(=O)N)c1ccccc1C(=O)N 269982a_100000184419_100000187820 [0,1,0,0,0,0|2,0,0]=3 856 B15R1.5509 CN(CC(=O)N)c1cccnc1C(=O)N 27a_100000739694_200012359670 [0,1,0,0,0,0|3,0,0]=4 857 B15R1.5509 CN(CC(=O)N)c1ccncc1C(=O)N 27a_100000739694_100000697804 [0,1,0,0,0,0|3,0,0]=4 858 B15R1.5509 CN(CC(=O)N)c1ncccc1C(=O)N 27a_100000739694_100000162199 [0,1,0,0,0,0|3,0,0]=4 859 B15R1.5509 CN(CC(=O)[O-])c1ccccc1C(=O)N 269982a_100000184419_100020667443 [0,1,0,0,0,0|1,0,1]=3 860 B15R1.5509 CN(C[N+](=O)[O-])c1ccccc1C(=O)N 269982a_100000184419_100000761209 [0,1,0,0,0,0|2,0,1]=4 861 B15R1.5509 C[C@@H](O)CN(C)c1ccccc1C(=O)N 269982a_100000184419_100009817552 [0,1,0,0,0,0|2,0,1]=4 862 B15R1.5509 [13CH3]N(CC(=O)N)c1ccccc1C(=O)N 2230a_100000020997_200025704644 [0,1,0,0,0,0|2,0,0]=3 863 B15R1.5915 CS(=O)(=O)c1ccccc1OCC(=O)N 34a_100000054562_100000187820 [0,1,0,0,0,0|3,0,0]=4 864 B15R1.5915 CS(=O)(=O)c1ccccc1OCC(=O)N 7a_100000054562_100000187820 [0,1,0,0,0,0|3,0,0]=4 865 B15R1.5915 CS(=O)(=O)c1ccccc1OCC(=O)[O-] 34a_100000054562_100020667443 [0,1,0,0,0,0|2,0,1]=4 866 B15R1.5915 NC(=O)CNc1ccccc1S(=O)(=O)N 34a_100011204920_100000187820 [0,1,0,0,0,0|3,0,0]=4 867 B15R1.5915 NC(=O)CSc1ccccc1S(=O)(=O)N 62a_100000164562_100000747473 [0,1,0,0,0,0|2,1,0]=4 868 B15R1.5915 NS(=O)(=O)c1ccccc1NCC(=O)[O-] 34a_100011204920_100020667443 [0,1,0,0,0,0|2,0,1]=4 869 B15R1.5915 NS(=O)(=O)c1ccccc1SCC(=O)[O-] 62a_100000164562_100020667443 [0,1,0,0,0,0|1,1,1]=4 870 B15R1.6620 C=C(C)CNc1c(cccc1C(=O)N)C 34a_100000223273_100000748629 [0,1,0,0,0,0|3,0,0]=4 871 B15R1.6620 C=C(C)CNc1c(cccc1C(=O)N)Cl 34a_200011997947_100000748629 [0,1,0,0,0,0|3,0,0]=4 872 B15R1.6620 C=C(C)CNc1c(cccc1C(=O)N)F 34a_100011722151_100000748629 [0,1,0,0,0,0|3,0,0]=4 873 B15R1.6620 C=C(C)COc1c(cccc1C(=O)C)C 34a_100009847209_100000748629 [0,1,0,0,0,0|3,0,0]=4 874 B15R1.6620 C=C(C)COc1c(cccc1C(=O)C)C 7a_100009847209_100000748629 [0,1,0,0,0,0|3,0,0]=4 875 B15R1.6620 C=C(C)COc1c(cccc1C(=O)C)Cl 34a_100000043392_100000748629 [0,1,0,0,0,0|3,0,0]=4 876 B15R1.6620 C=C(C)COc1c(cccc1C(=O)C)Cl 7a_100000043392_100000748629 [0,1,0,0,0,0|3,0,0]=4 877 B15R1.6620 C=C(C)COc1c(cccc1C(=O)C)F 34a_100011246037_100000748629 [0,1,0,0,0,0|3,0,0]=4 878 B15R1.6620 C=C(C)COc1c(cccc1C(=O)C)F 7a_100011246037_100000748629 [0,1,0,0,0,0|3,0,0]=4 879 B15R1.6620 C=C(C)COc1c(cccc1C(=O)N)Cl 34a_100009868166_100000748629 [0,1,0,0,0,0|2,0,0]=3 880 B15R1.6620 C=C(C)COc1c(cccc1C(=O)N)Cl 7a_100009868166_100000748629 [0,1,0,0,0,0|2,0,0]=3 881 B15R1.6620 C=C(C)COc1c(cccc1C(=O)N)F 34a_100009886295_100000748629 [0,1,0,0,0,0|2,0,0]=3 882 B15R1.6620 C=C(C)COc1c(cccc1C(=O)N)F 7a_100009886295_100000748629 [0,1,0,0,0,0|2,0,0]=3 883 B15R1.6620 C=C(C)CSc1c(cccc1C(=O)N)C 62a_100000748629_200011409216 [0,1,0,0,0,0|2,1,0]=4 884 B15R1.6620 C=C(C)CSc1c(cccc1C(=O)N)C 62a_200011409216_100000211660 [0,1,0,0,0,0|2,1,0]=4 885 B15R1.6620 C=C(C)CSc1c(cccc1C(=O)N)F 62a_100000748629_200012351544 [0,1,0,0,0,0|2,1,0]=4 886 B15R1.6620 C=C(C)CSc1c(cccc1C(=O)N)F 62a_200012351544_100000211660 [0,1,0,0,0,0|2,1,0]=4 887 B15R1.6620 C=C(F)CNc1c(cccc1C(=O)N)C 34a_100000223273_100009893438 [0,1,0,0,0,0|3,0,0]=4 888 B15R1.6620 C=C(F)CNc1c(cccc1C(=O)N)Cl 34a_200011997947_100009893438 [0,1,0,0,0,0|3,0,0]=4 889 B15R1.6620 C=C(F)CNc1c(cccc1C(=O)N)F 34a_100011722151_100009893438 [0,1,0,0,0,0|3,0,0]=4 890 B15R1.6620 C=C(F)COc1c(cccc1C(=O)C)C 34a_100009847209_100009893438 [0,1,0,0,0,0|3,0,0]=4 891 B15R1.6620 C=C(F)COc1c(cccc1C(=O)C)C 7a_100009847209_100000042424 [0,1,0,0,0,0|3,0,0]=4 892 B15R1.6620 C=C(F)COc1c(cccc1C(=O)C)Cl 34a_100000043392_100009893438 [0,1,0,0,0,0|3,0,0]=4 893 B15R1.6620 C=C(F)COc1c(cccc1C(=O)C)Cl 7a_100000043392_100000042424 [0,1,0,0,0,0|3,0,0]=4 894 B15R1.6620 C=C(F)COc1c(cccc1C(=O)C)F 34a_100011246037_100009893438 [0,1,0,0,0,0|3,0,0]=4 895 B15R1.6620 C=C(F)COc1c(cccc1C(=O)C)F 7a_100011246037_100000042424 [0,1,0,0,0,0|3,0,0]=4 896 B15R1.6620 C=C(F)COc1c(cccc1C(=O)N)Cl 34a_100009868166_100009893438 [0,1,0,0,0,0|2,0,0]=3 897 B15R1.6620 C=C(F)COc1c(cccc1C(=O)N)Cl 7a_100009868166_100000042424 [0,1,0,0,0,0|2,0,0]=3 898 B15R1.6620 C=C(F)COc1c(cccc1C(=O)N)F 34a_100009886295_100009893438 [0,1,0,0,0,0|2,0,0]=3 899 B15R1.6620 C=C(F)COc1c(cccc1C(=O)N)F 7a_100009886295_100000042424 [0,1,0,0,0,0|2,0,0]=3 900 B15R1.6620 C=C(F)CSc1c(cccc1C(=O)N)C 62a_100000042424_200011409216 [0,1,0,0,0,0|2,1,0]=4 901 B15R1.6620 C=C(F)CSc1c(cccc1C(=O)N)C 62a_200011409216_100000042424 [0,1,0,0,0,0|2,1,0]=4 902 B15R1.6620 C=C(F)CSc1c(cccc1C(=O)N)F 62a_100000042424_200012351544 [0,1,0,0,0,0|2,1,0]=4 903 B15R1.6620 C=C(F)CSc1c(cccc1C(=O)N)F 62a_200012351544_100000042424 [0,1,0,0,0,0|2,1,0]=4 904 B15R1.6620 CC(=O)c1cccc(c1OCC(=O)N)C 34a_100009847209_100000187820 [0,1,0,0,0,0|2,0,0]=3 905 B15R1.6620 CC(=O)c1cccc(c1OCC(=O)N)C 7a_100009847209_100000187820 [0,1,0,0,0,0|2,0,0]=3 906 B15R1.6620 CC(=O)c1cccc(c1OCC(=O)N)Cl 34a_100000043392_100000187820 [0,1,0,0,0,0|2,0,0]=3 907 B15R1.6620 CC(=O)c1cccc(c1OCC(=O)N)Cl 7a_100000043392_100000187820 [0,1,0,0,0,0|2,0,0]=3 908 B15R1.6620 CC(=O)c1cccc(c1OCC(=O)N)F 34a_100011246037_100000187820 [0,1,0,0,0,0|2,0,0]=3 909 B15R1.6620 CC(=O)c1cccc(c1OCC(=O)N)F 7a_100011246037_100000187820 [0,1,0,0,0,0|2,0,0]=3 910 B15R1.6620 CC(=O)c1cccc(c1OCC(=O)[O-])C 34a_100009847209_100020667443 [0,1,0,0,0,0|1,0,1]=3 911 B15R1.6620 CC(=O)c1cccc(c1OCC(=O)[O-])Cl 34a_100000043392_100020667443 [0,1,0,0,0,0|1,0,1]=3 912 B15R1.6620 CC(=O)c1cccc(c1OCC(=O)[O-])F 34a_100011246037_100020667443 [0,1,0,0,0,0|1,0,1]=3 913 B15R1.6620 CC(=O)c1cccc(c1OCC(C)O)C 34a_100009847209_100011218427 [0,1,0,0,0,0|2,0,1]=4 914 B15R1.6620 CC(=O)c1cccc(c1OCC(C)O)C 7a_100009847209_100011218427 [0,1,0,0,0,0|2,0,1]=4 915 B15R1.6620 CC(=O)c1cccc(c1OCC(C)O)Cl 34a_100000043392_100011218427 [0,1,0,0,0,0|2,0,1]=4 916 B15R1.6620 CC(=O)c1cccc(c1OCC(C)O)Cl 7a_100000043392_100011218427 [0,1,0,0,0,0|2,0,1]=4 917 B15R1.6620 CC(=O)c1cccc(c1OCC(C)O)F 34a_100011246037_100011218427 [0,1,0,0,0,0|2,0,1]=4 918 B15R1.6620 CC(=O)c1cccc(c1OCC(C)O)F 7a_100011246037_100011218427 [0,1,0,0,0,0|2,0,1]=4 919 B15R1.6620 CC(=O)c1cccc(c1OC[C@@H](C)O)C 34a_100009847209_100009817552 [0,1,0,0,0,0|2,0,1]=4 920 B15R1.6620 CC(=O)c1cccc(c1OC[C@@H](C)O)C 7a_100009847209_100009817552 [0,1,0,0,0,0|2,0,1]=4 921 B15R1.6620 CC(=O)c1cccc(c1OC[C@@H](C)O)Cl 34a_100000043392_100009817552 [0,1,0,0,0,0|2,0,1]=4 922 B15R1.6620 CC(=O)c1cccc(c1OC[C@@H](C)O)Cl 7a_100000043392_100009817552 [0,1,0,0,0,0|2,0,1]=4 923 B15R1.6620 CC(=O)c1cccc(c1OC[C@@H](C)O)F 34a_100011246037_100009817552 [0,1,0,0,0,0|2,0,1]=4 924 B15R1.6620 CC(=O)c1cccc(c1OC[C@@H](C)O)F 7a_100011246037_100009817552 [0,1,0,0,0,0|2,0,1]=4 925 B15R1.6620 CC(=O)c1cccc(c1OC[N+](=O)[O-])C 34a_100009847209_100000761209 [0,1,0,0,0,0|2,0,1]=4 926 B15R1.6620 CC(=O)c1cccc(c1OC[N+](=O)[O-])Cl 34a_100000043392_100000761209 [0,1,0,0,0,0|2,0,1]=4 927 B15R1.6620 CC(=O)c1cccc(c1OC[N+](=O)[O-])F 34a_100011246037_100000761209 [0,1,0,0,0,0|2,0,1]=4 928 B15R1.6620 CC(=O)c1cccc(c1SCC(=O)N)F 62a_100000747473_100012362612 [0,1,0,0,0,0|2,1,0]=4 929 B15R1.6620 CC(=O)c1cccc(c1SCC(=O)N)F 62a_100012362612_100000747473 [0,1,0,0,0,0|2,1,0]=4 930 B15R1.6620 CC(=O)c1cccc(c1SCC(=O)[O-])F 62a_100012362612_100020667443 [0,1,0,0,0,0|1,1,1]=4 931 B15R1.6620 CC(=O)c1cccc(c1SCC(=O)[O-])F 62a_100020667443_100012362612 [0,1,0,0,0,0|1,1,1]=4 932 B15R1.6620 CC(C)COc1c(cccc1C(=O)N)Cl 34a_100009868166_100000210624 [0,1,0,0,0,0|2,0,1]=4 933 B15R1.6620 CC(C)COc1c(cccc1C(=O)N)Cl 7a_100009868166_100000210760 [0,1,0,0,0,0|2,0,1]=4 934 B15R1.6620 CC(C)COc1c(cccc1C(=O)N)F 34a_100009886295_100000210624 [0,1,0,0,0,0|2,0,1]=4 935 B15R1.6620 CC(C)COc1c(cccc1C(=O)N)F 7a_100009886295_100000210760 [0,1,0,0,0,0|2,0,1]=4 936 B15R1.6620 CC(O)CNc1c(cccc1C(=O)N)Cl 34a_200011997947_100011218427 [0,1,0,0,0,0|2,0,1]=4 937 B15R1.6620 CC(O)CNc1c(cccc1C(=O)N)F 34a_100011722151_100011218427 [0,1,0,0,0,0|2,0,1]=4 938 B15R1.6620 CC(O)COc1c(cccc1C(=O)N)Cl 34a_100009868166_100011218427 [0,1,0,0,0,0|1,0,1]=3 939 B15R1.6620 CC(O)COc1c(cccc1C(=O)N)Cl 7a_100009868166_100011218427 [0,1,0,0,0,0|1,0,1]=3 940 B15R1.6620 CC(O)COc1c(cccc1C(=O)N)F 34a_100009886295_100011218427 [0,1,0,0,0,0|1,0,1]=3 941 B15R1.6620 CC(O)COc1c(cccc1C(=O)N)F 7a_100009886295_100011218427 [0,1,0,0,0,0|1,0,1]=3 942 B15R1.6620 CC(O)CSc1c(cccc1C(=O)N)F 62a_100011218427_200012351544 [0,1,0,0,0,0|1,1,1]=4 943 B15R1.6620 CC(O)CSc1c(cccc1C(=O)N)F 62a_200012351544_100011218427 [0,1,0,0,0,0|1,1,1]=4 944 B15R1.6620 C[C@@H](O)CNc1c(cccc1C(=O)N)Cl 34a_200011997947_100009817552 [0,1,0,0,0,0|2,0,1]=4 945 B15R1.6620 C[C@@H](O)CNc1c(cccc1C(=O)N)F 34a_100011722151_100009817552 [0,1,0,0,0,0|2,0,1]=4 946 B15R1.6620 C[C@@H](O)COc1c(cccc1C(=O)N)Cl 34a_100009868166_100009817552 [0,1,0,0,0,0|1,0,1]=3 947 B15R1.6620 C[C@@H](O)COc1c(cccc1C(=O)N)Cl 7a_100009868166_100009817552 [0,1,0,0,0,0|1,0,1]=3 948 B15R1.6620 C[C@@H](O)COc1c(cccc1C(=O)N)F 34a_100009886295_100009817552 [0,1,0,0,0,0|1,0,1]=3 949 B15R1.6620 C[C@@H](O)COc1c(cccc1C(=O)N)F 7a_100009886295_100009817552 [0,1,0,0,0,0|1,0,1]=3 950 B15R1.6620 C[C@@H](O)CSc1c(cccc1C(=O)N)F 62a_100009817552_200012351544 [0,1,0,0,0,0|1,1,1]=4 951 B15R1.6620 C[C@@H](O)CSc1c(cccc1C(=O)N)F 62a_200012351544_100009817552 [0,1,0,0,0,0|1,1,1]=4 952 B15R1.6620 Cc1cccc(c1NCC(=O)N)C(=O)N 34a_100000223273_100000187820 [0,1,0,0,0,0|2,0,0]=3 953 B15R1.6620 Cc1cccc(c1NCC(=O)[O-])C(=O)N 34a_100000223273_100020667443 [0,1,0,0,0,0|1,0,1]=3 954 B15R1.6620 Cc1cccc(c1NCC(C)O)C(=O)N 34a_100000223273_100011218427 [0,1,0,0,0,0|2,0,1]=4 955 B15R1.6620 Cc1cccc(c1NC[C@@H](C)O)C(=O)N 34a_100000223273_100009817552 [0,1,0,0,0,0|2,0,1]=4 956 B15R1.6620 Cc1cccc(c1NC[N+](=O)[O-])C(=O)N 34a_100000223273_100000761209 [0,1,0,0,0,0|2,0,1]=4 957 B15R1.6620 Cc1cccc(c1OCC(=O)N)[N+](=O)[O-] 34a_100000763257_100000187820 [0,1,0,0,0,0|3,0,0]=4 958 B15R1.6620 Cc1cccc(c1OCC(=O)N)[N+](=O)[O-] 7a_100000763257_100000187820 [0,1,0,0,0,0|3,0,0]=4 959 B15R1.6620 Cc1cccc(c1OCC(=O)[O-])[N+](=O)[O-] 34a_100000763257_100020667443 [0,1,0,0,0,0|2,0,1]=4 960 B15R1.6620 Cc1cccc(c1SCC(=O)N)C(=O)N 62a_100000747473_200011409216 [0,1,0,0,0,0|1,1,0]=3 961 B15R1.6620 Cc1cccc(c1SCC(=O)N)C(=O)N 62a_200011409216_100000747473 [0,1,0,0,0,0|1,1,0]=3 962 B15R1.6620 Cc1cccc(c1SCC(=O)[O-])C(=O)N 62a_100020667443_200011409216 [0,1,0,0,0,0|0,1,1]=3 963 B15R1.6620 Cc1cccc(c1SCC(=O)[O-])C(=O)N 62a_200011409216_100020667443 [0,1,0,0,0,0|0,1,1]=3 964 B15R1.6620 Cc1cccc(c1SCC(C)O)C(=O)N 62a_100011218427_200011409216 [0,1,0,0,0,0|1,1,1]=4 965 B15R1.6620 Cc1cccc(c1SCC(C)O)C(=O)N 62a_200011409216_100011218427 [0,1,0,0,0,0|1,1,1]=4 966 B15R1.6620 Cc1cccc(c1SC[C@@H](C)O)C(=O)N 62a_100009817552_200011409216 [0,1,0,0,0,0|1,1,1]=4 967 B15R1.6620 Cc1cccc(c1SC[C@@H](C)O)C(=O)N 62a_200011409216_100009817552 [0,1,0,0,0,0|1,1,1]=4 968 B15R1.6620 Cc1cccc(c1SC[N+](=O)[O-])C(=O)N 62a_200011409216_100000761209 [0,1,0,0,0,0|1,1,1]=4 969 B15R1.6620 NC(=O)CNc1c(cccc1C(=O)N)Cl 34a_200011997947_100000187820 [0,1,0,0,0,0|2,0,0]=3 970 B15R1.6620 NC(=O)CNc1c(cccc1C(=O)N)F 34a_100011722151_100000187820 [0,1,0,0,0,0|2,0,0]=3 971 B15R1.6620 NC(=O)COc1c(cccc1C(=O)N)Cl 34a_100009868166_100000187820 [0,1,0,0,0,0|1,0,0]=2 972 B15R1.6620 NC(=O)COc1c(cccc1C(=O)N)Cl 7a_100009868166_100000187820 [0,1,0,0,0,0|1,0,0]=2 973 B15R1.6620 NC(=O)COc1c(cccc1C(=O)N)F 34a_100009886295_100000187820 [0,1,0,0,0,0|1,0,0]=2 974 B15R1.6620 NC(=O)COc1c(cccc1C(=O)N)F 7a_100009886295_100000187820 [0,1,0,0,0,0|1,0,0]=2 975 B15R1.6620 NC(=O)COc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100000187820 [0,1,0,0,0,0|3,0,0]=4 976 B15R1.6620 NC(=O)COc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100000187820 [0,1,0,0,0,0|3,0,0]=4 977 B15R1.6620 NC(=O)COc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100000187820 [0,1,0,0,0,0|3,0,0]=4 978 B15R1.6620 NC(=O)COc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100000187820 [0,1,0,0,0,0|3,0,0]=4 979 B15R1.6620 NC(=O)CSc1c(cccc1C(=O)N)F 62a_100000747473_200012351544 [0,1,0,0,0,0|1,1,0]=3 980 B15R1.6620 NC(=O)CSc1c(cccc1C(=O)N)F 62a_200012351544_100000747473 [0,1,0,0,0,0|1,1,0]=3 981 B15R1.6620 NC(=O)c1cccc(c1NCC(=O)[O-])Cl 34a_200011997947_100020667443 [0,1,0,0,0,0|1,0,1]=3 982 B15R1.6620 NC(=O)c1cccc(c1NCC(=O)[O-])F 34a_100011722151_100020667443 [0,1,0,0,0,0|1,0,1]=3 983 B15R1.6620 NC(=O)c1cccc(c1NC[N+](=O)[O-])Cl 34a_200011997947_100000761209 [0,1,0,0,0,0|2,0,1]=4 984 B15R1.6620 NC(=O)c1cccc(c1NC[N+](=O)[O-])F 34a_100011722151_100000761209 [0,1,0,0,0,0|2,0,1]=4 985 B15R1.6620 NC(=O)c1cccc(c1OCC(=O)[O-])Cl 34a_100009868166_100020667443 [0,1,0,0,0,0|0,0,1]=2 986 B15R1.6620 NC(=O)c1cccc(c1OCC(=O)[O-])F 34a_100009886295_100020667443 [0,1,0,0,0,0|0,0,1]=2 987 B15R1.6620 NC(=O)c1cccc(c1OCC(F)F)Cl 34a_100009868166_100011934356 [0,1,0,0,0,0|2,0,1]=4 988 B15R1.6620 NC(=O)c1cccc(c1OCC(F)F)Cl 7a_100009868166_100011934356 [0,1,0,0,0,0|2,0,1]=4 989 B15R1.6620 NC(=O)c1cccc(c1OCC(F)F)F 34a_100009886295_100011934356 [0,1,0,0,0,0|2,0,1]=4 990 B15R1.6620 NC(=O)c1cccc(c1OCC(F)F)F 7a_100009886295_100011934356 [0,1,0,0,0,0|2,0,1]=4 991 B15R1.6620 NC(=O)c1cccc(c1OC[N+](=O)[O-])Cl 34a_100009868166_100000761209 [0,1,0,0,0,0|1,0,1]=3 992 B15R1.6620 NC(=O)c1cccc(c1OC[N+](=O)[O-])F 34a_100009886295_100000761209 [0,1,0,0,0,0|1,0,1]=3 993 B15R1.6620 NC(=O)c1cccc(c1SCC(=O)[O-])F 62a_100020667443_200012351544 [0,1,0,0,0,0|0,1,1]=3 994 B15R1.6620 NC(=O)c1cccc(c1SCC(=O)[O-])F 62a_200012351544_100020667443 [0,1,0,0,0,0|0,1,1]=3 995 B15R1.6620 NC(=O)c1cccc(c1SC[N+](=O)[O-])F 62a_200012351544_100000761209 [0,1,0,0,0,0|1,1,1]=4 996 B15R1.6620 O=C([O-])COc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100020667443 [0,1,0,0,0,0|2,0,1]=4 997 B15R1.6620 O=C([O-])COc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100020667443 [0,1,0,0,0,0|2,0,1]=4 998 B15R1.6620 O=C([O-])COc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100020667443 [0,1,0,0,0,0|2,0,1]=4 999 B15R1.8265 C=C(C)CNc1cccc(c1C(=O)N)C 34a_100102558177_100000748629 [0,1,0,0,0,0|3,0,0]=4 1000 B15R1.8265 C=C(C)CNc1cccc(c1C(=O)N)C 7a_100102558177_100000748629 [0,1,0,0,0,0|3,0,0]=4 1001 B15R1.8265 C=C(C)CNc1cccc(c1C(=O)N)Cl 34a_100000764435_100000748629 [0,1,0,0,0,0|3,0,0]=4 1002 B15R1.8265 C=C(C)CNc1cccc(c1C(=O)N)Cl 7a_100000764435_100000748629 [0,1,0,0,0,0|3,0,0]=4 1003 B15R1.8265 C=C(C)CNc1cccc(c1C(=O)N)F 27a_100000765925_100011219063 [0,1,0,0,0,0|3,0,0]=4 1004 B15R1.8265 C=C(C)CNc1cccc(c1C(=O)N)F 34a_100000036109_100000748629 [0,1,0,0,0,0|3,0,0]=4 1005 B15R1.8265 C=C(C)CNc1cccc(c1C(=O)N)F 7a_100000036109_100000748629 [0,1,0,0,0,0|3,0,0]=4 1006 B15R1.8265 C=C(C)COc1cccc(c1C(=O)C)Br 34a_100010174959_100000748629 [0,1,0,0,0,0|3,0,0]=4 1007 B15R1.8265 C=C(C)COc1cccc(c1C(=O)C)Br 7a_100010174959_100000748629 [0,1,0,0,0,0|3,0,0]=4 1008 B15R1.8265 C=C(C)COc1cccc(c1C(=O)C)C 34a_100009860897_100000748629 [0,1,0,0,0,0|3,0,0]=4 1009 B15R1.8265 C=C(C)COc1cccc(c1C(=O)C)C 7a_100009860897_100000748629 [0,1,0,0,0,0|3,0,0]=4 1010 B15R1.8265 C=C(C)COc1cccc(c1C(=O)C)Cl 34a_100000730630_100000748629 [0,1,0,0,0,0|3,0,0]=4 1011 B15R1.8265 C=C(C)COc1cccc(c1C(=O)C)Cl 7a_100000730630_100000748629 [0,1,0,0,0,0|3,0,0]=4 1012 B15R1.8265 C=C(C)COc1cccc(c1C(=O)C)F 34a_100011216272_100000748629 [0,1,0,0,0,0|3,0,0]=4 1013 B15R1.8265 C=C(C)COc1cccc(c1C(=O)C)F 7a_100011216272_100000748629 [0,1,0,0,0,0|3,0,0]=4 1014 B15R1.8265 C=C(C)COc1cccc(c1C(=O)N)F 34a_100000701607_100000748629 [0,1,0,0,0,0|2,0,0]=3 1015 B15R1.8265 C=C(C)COc1cccc(c1C(=O)N)F 7a_100000701607_100000748629 [0,1,0,0,0,0|2,0,0]=3 1016 B15R1.8265 C=C(C)CSc1cccc(c1C(=O)N)Cl 62a_100010147686_100000211660 [0,1,0,0,0,0|2,1,0]=4 1017 B15R1.8265 C=C(C)CSc1cccc(c1C(=O)N)F 62a_100011219063_100000211660 [0,1,0,0,0,0|2,1,0]=4 1018 B15R1.8265 C=C(F)CNc1cccc(c1C(=O)N)C 34a_100102558177_100009893438 [0,1,0,0,0,0|3,0,0]=4 1019 B15R1.8265 C=C(F)CNc1cccc(c1C(=O)N)C 7a_100102558177_100000042424 [0,1,0,0,0,0|3,0,0]=4 1020 B15R1.8265 C=C(F)CNc1cccc(c1C(=O)N)Cl 34a_100000764435_100009893438 [0,1,0,0,0,0|3,0,0]=4 1021 B15R1.8265 C=C(F)CNc1cccc(c1C(=O)N)Cl 7a_100000764435_100000042424 [0,1,0,0,0,0|3,0,0]=4 1022 B15R1.8265 C=C(F)CNc1cccc(c1C(=O)N)F 34a_100000036109_100009893438 [0,1,0,0,0,0|3,0,0]=4 1023 B15R1.8265 C=C(F)CNc1cccc(c1C(=O)N)F 7a_100000036109_100000042424 [0,1,0,0,0,0|3,0,0]=4 1024 B15R1.8265 C=C(F)COc1cccc(c1C(=O)C)Br 34a_100010174959_100009893438 [0,1,0,0,0,0|3,0,0]=4 1025 B15R1.8265 C=C(F)COc1cccc(c1C(=O)C)Br 7a_100010174959_100000042424 [0,1,0,0,0,0|3,0,0]=4 1026 B15R1.8265 C=C(F)COc1cccc(c1C(=O)C)C 34a_100009860897_100009893438 [0,1,0,0,0,0|3,0,0]=4 1027 B15R1.8265 C=C(F)COc1cccc(c1C(=O)C)C 7a_100009860897_100000042424 [0,1,0,0,0,0|3,0,0]=4 1028 B15R1.8265 C=C(F)COc1cccc(c1C(=O)C)Cl 34a_100000730630_100009893438 [0,1,0,0,0,0|3,0,0]=4 1029 B15R1.8265 C=C(F)COc1cccc(c1C(=O)C)Cl 7a_100000730630_100000042424 [0,1,0,0,0,0|3,0,0]=4 1030 B15R1.8265 C=C(F)COc1cccc(c1C(=O)C)F 34a_100011216272_100009893438 [0,1,0,0,0,0|3,0,0]=4 1031 B15R1.8265 C=C(F)COc1cccc(c1C(=O)C)F 7a_100011216272_100000042424 [0,1,0,0,0,0|3,0,0]=4 1032 B15R1.8265 C=C(F)COc1cccc(c1C(=O)N)F 34a_100000701607_100009893438 [0,1,0,0,0,0|2,0,0]=3 1033 B15R1.8265 C=C(F)COc1cccc(c1C(=O)N)F 7a_100000701607_100000042424 [0,1,0,0,0,0|2,0,0]=3 1034 B15R1.8265 C=C(F)CSc1cccc(c1C(=O)N)Cl 62a_100010147686_100000042424 [0,1,0,0,0,0|2,1,0]=4 1035 B15R1.8265 C=C(F)CSc1cccc(c1C(=O)N)F 62a_100011219063_100000042424 [0,1,0,0,0,0|2,1,0]=4 1036 B15R1.8265 CC(=O)c1c(cccc1OCC(=O)N)Br 34a_100010174959_100000187820 [0,1,0,0,0,0|2,0,0]=3 1037 B15R1.8265 CC(=O)c1c(cccc1OCC(=O)N)Br 7a_100010174959_100000187820 [0,1,0,0,0,0|2,0,0]=3 1038 B15R1.8265 CC(=O)c1c(cccc1OCC(=O)N)C 34a_100009860897_100000187820 [0,1,0,0,0,0|2,0,0]=3 1039 B15R1.8265 CC(=O)c1c(cccc1OCC(=O)N)C 7a_100009860897_100000187820 [0,1,0,0,0,0|2,0,0]=3 1040 B15R1.8265 CC(=O)c1c(cccc1OCC(=O)N)Cl 34a_100000730630_100000187820 [0,1,0,0,0,0|2,0,0]=3 1041 B15R1.8265 CC(=O)c1c(cccc1OCC(=O)N)Cl 7a_100000730630_100000187820 [0,1,0,0,0,0|2,0,0]=3 1042 B15R1.8265 CC(=O)c1c(cccc1OCC(=O)N)F 34a_100011216272_100000187820 [0,1,0,0,0,0|2,0,0]=3 1043 B15R1.8265 CC(=O)c1c(cccc1OCC(=O)N)F 7a_100011216272_100000187820 [0,1,0,0,0,0|2,0,0]=3 1044 B15R1.8265 CC(=O)c1c(cccc1OCC(=O)[O-])Br 34a_100010174959_100020667443 [0,1,0,0,0,0|1,0,1]=3 1045 B15R1.8265 CC(=O)c1c(cccc1OCC(=O)[O-])C 34a_100009860897_100020667443 [0,1,0,0,0,0|1,0,1]=3 1046 B15R1.8265 CC(=O)c1c(cccc1OCC(=O)[O-])Cl 34a_100000730630_100020667443 [0,1,0,0,0,0|1,0,1]=3 1047 B15R1.8265 CC(=O)c1c(cccc1OCC(=O)[O-])F 34a_100011216272_100020667443 [0,1,0,0,0,0|1,0,1]=3 1048 B15R1.8265 CC(=O)c1c(cccc1OCC(C)O)Br 34a_100010174959_100011218427 [0,1,0,0,0,0|2,0,1]=4 1049 B15R1.8265 CC(=O)c1c(cccc1OCC(C)O)Br 7a_100010174959_100011218427 [0,1,0,0,0,0|2,0,1]=4 1050 B15R1.8265 CC(=O)c1c(cccc1OCC(C)O)C 34a_100009860897_100011218427 [0,1,0,0,0,0|2,0,1]=4 1051 B15R1.8265 CC(=O)c1c(cccc1OCC(C)O)C 7a_100009860897_100011218427 [0,1,0,0,0,0|2,0,1]=4 1052 B15R1.8265 CC(=O)c1c(cccc1OCC(C)O)Cl 34a_100000730630_100011218427 [0,1,0,0,0,0|2,0,1]=4 1053 B15R1.8265 CC(=O)c1c(cccc1OCC(C)O)Cl 7a_100000730630_100011218427 [0,1,0,0,0,0|2,0,1]=4 1054 B15R1.8265 CC(=O)c1c(cccc1OCC(C)O)F 34a_100011216272_100011218427 [0,1,0,0,0,0|2,0,1]=4 1055 B15R1.8265 CC(=O)c1c(cccc1OCC(C)O)F 7a_100011216272_100011218427 [0,1,0,0,0,0|2,0,1]=4 1056 B15R1.8265 CC(=O)c1c(cccc1OC[C@@H](C)O)Br 34a_100010174959_100009817552 [0,1,0,0,0,0|2,0,1]=4 1057 B15R1.8265 CC(=O)c1c(cccc1OC[C@@H](C)O)Br 7a_100010174959_100009817552 [0,1,0,0,0,0|2,0,1]=4 1058 B15R1.8265 CC(=O)c1c(cccc1OC[C@@H](C)O)C 34a_100009860897_100009817552 [0,1,0,0,0,0|2,0,1]=4 1059 B15R1.8265 CC(=O)c1c(cccc1OC[C@@H](C)O)C 7a_100009860897_100009817552 [0,1,0,0,0,0|2,0,1]=4 1060 B15R1.8265 CC(=O)c1c(cccc1OC[C@@H](C)O)Cl 34a_100000730630_100009817552 [0,1,0,0,0,0|2,0,1]=4 1061 B15R1.8265 CC(=O)c1c(cccc1OC[C@@H](C)O)Cl 7a_100000730630_100009817552 [0,1,0,0,0,0|2,0,1]=4 1062 B15R1.8265 CC(=O)c1c(cccc1OC[C@@H](C)O)F 34a_100011216272_100009817552 [0,1,0,0,0,0|2,0,1]=4 1063 B15R1.8265 CC(=O)c1c(cccc1OC[C@@H](C)O)F 7a_100011216272_100009817552 [0,1,0,0,0,0|2,0,1]=4 1064 B15R1.8265 CC(=O)c1c(cccc1OC[N+](=O)[O-])Br 34a_100010174959_100000761209 [0,1,0,0,0,0|2,0,1]=4 1065 B15R1.8265 CC(=O)c1c(cccc1OC[N+](=O)[O-])C 34a_100009860897_100000761209 [0,1,0,0,0,0|2,0,1]=4 1066 B15R1.8265 CC(=O)c1c(cccc1OC[N+](=O)[O-])Cl 34a_100000730630_100000761209 [0,1,0,0,0,0|2,0,1]=4 1067 B15R1.8265 CC(=O)c1c(cccc1OC[N+](=O)[O-])F 34a_100011216272_100000761209 [0,1,0,0,0,0|2,0,1]=4 1068 B15R1.8265 CC(=O)c1c(cccc1SCC(=O)N)F 62a_100012351873_100000747473 [0,1,0,0,0,0|2,1,0]=4 1069 B15R1.8265 CC(=O)c1c(cccc1SCC(=O)[O-])F 62a_100012351873_100020667443 [0,1,0,0,0,0|1,1,1]=4 1070 B15R1.8265 CC(C)COc1cccc(c1C(=O)N)F 34a_100000701607_100000210624 [0,1,0,0,0,0|2,0,1]=4 1071 B15R1.8265 CC(C)COc1cccc(c1C(=O)N)F 7a_100000701607_100000210760 [0,1,0,0,0,0|2,0,1]=4 1072 B15R1.8265 CC(O)CNc1cccc(c1C(=O)N)Cl 34a_100000764435_100011218427 [0,1,0,0,0,0|2,0,1]=4 1073 B15R1.8265 CC(O)CNc1cccc(c1C(=O)N)Cl 7a_100000764435_100011218427 [0,1,0,0,0,0|2,0,1]=4 1074 B15R1.8265 CC(O)CNc1cccc(c1C(=O)N)F 27a_100000210904_100011219063 [0,1,0,0,0,0|2,0,1]=4 1075 B15R1.8265 CC(O)CNc1cccc(c1C(=O)N)F 34a_100000036109_100011218427 [0,1,0,0,0,0|2,0,1]=4 1076 B15R1.8265 CC(O)CNc1cccc(c1C(=O)N)F 7a_100000036109_100011218427 [0,1,0,0,0,0|2,0,1]=4 1077 B15R1.8265 CC(O)COc1cccc(c1C(=O)N)F 34a_100000701607_100011218427 [0,1,0,0,0,0|1,0,1]=3 1078 B15R1.8265 CC(O)COc1cccc(c1C(=O)N)F 7a_100000701607_100011218427 [0,1,0,0,0,0|1,0,1]=3 1079 B15R1.8265 CC(O)CSc1cccc(c1C(=O)N)Cl 62a_100010147686_100011218427 [0,1,0,0,0,0|1,1,1]=4 1080 B15R1.8265 CC(O)CSc1cccc(c1C(=O)N)F 62a_100011219063_100011218427 [0,1,0,0,0,0|1,1,1]=4 1081 B15R1.8265 C[C@@H](O)CNc1cccc(c1C(=O)N)Cl 34a_100000764435_100009817552 [0,1,0,0,0,0|2,0,1]=4 1082 B15R1.8265 C[C@@H](O)CNc1cccc(c1C(=O)N)Cl 7a_100000764435_100009817552 [0,1,0,0,0,0|2,0,1]=4 1083 B15R1.8265 C[C@@H](O)CNc1cccc(c1C(=O)N)F 34a_100000036109_100009817552 [0,1,0,0,0,0|2,0,1]=4 1084 B15R1.8265 C[C@@H](O)CNc1cccc(c1C(=O)N)F 7a_100000036109_100009817552 [0,1,0,0,0,0|2,0,1]=4 1085 B15R1.8265 C[C@@H](O)COc1cccc(c1C(=O)N)F 34a_100000701607_100009817552 [0,1,0,0,0,0|1,0,1]=3 1086 B15R1.8265 C[C@@H](O)COc1cccc(c1C(=O)N)F 7a_100000701607_100009817552 [0,1,0,0,0,0|1,0,1]=3 1087 B15R1.8265 C[C@@H](O)CSc1cccc(c1C(=O)N)Cl 62a_100010147686_100009817552 [0,1,0,0,0,0|1,1,1]=4 1088 B15R1.8265 C[C@@H](O)CSc1cccc(c1C(=O)N)F 62a_100011219063_100009817552 [0,1,0,0,0,0|1,1,1]=4 1089 B15R1.8265 Cc1cccc(c1C(=O)N)NCC(=O)N 34a_100102558177_100000187820 [0,1,0,0,0,0|2,0,0]=3 1090 B15R1.8265 Cc1cccc(c1C(=O)N)NCC(=O)N 7a_100102558177_100000187820 [0,1,0,0,0,0|2,0,0]=3 1091 B15R1.8265 Cc1cccc(c1C(=O)N)NCC(=O)[O-] 34a_100102558177_100020667443 [0,1,0,0,0,0|1,0,1]=3 1092 B15R1.8265 Cc1cccc(c1C(=O)N)NCC(C)O 34a_100102558177_100011218427 [0,1,0,0,0,0|2,0,1]=4 1093 B15R1.8265 Cc1cccc(c1C(=O)N)NCC(C)O 7a_100102558177_100011218427 [0,1,0,0,0,0|2,0,1]=4 1094 B15R1.8265 Cc1cccc(c1C(=O)N)NC[C@@H](C)O 34a_100102558177_100009817552 [0,1,0,0,0,0|2,0,1]=4 1095 B15R1.8265 Cc1cccc(c1C(=O)N)NC[C@@H](C)O 7a_100102558177_100009817552 [0,1,0,0,0,0|2,0,1]=4 1096 B15R1.8265 Cc1cccc(c1C(=O)N)NC[N+](=O)[O-] 34a_100102558177_100000761209 [0,1,0,0,0,0|2,0,1]=4 1097 B15R1.8265 Cc1cccc(c1[N+](=O)[O-])OCC(=O)N 34a_100000740142_100000187820 [0,1,0,0,0,0|3,0,0]=4 1098 B15R1.8265 Cc1cccc(c1[N+](=O)[O-])OCC(=O)N 7a_100000740142_100000187820 [0,1,0,0,0,0|3,0,0]=4 1099 B15R1.8265 Cc1cccc(c1[N+](=O)[O-])OCC(=O)[O-] 34a_100000740142_100020667443 [0,1,0,0,0,0|2,0,1]=4 1100 B15R1.8265 NC(=O)CNc1cccc(c1C(=O)N)Cl 34a_100000764435_100000187820 [0,1,0,0,0,0|2,0,0]=3 1101 B15R1.8265 NC(=O)CNc1cccc(c1C(=O)N)Cl 7a_100000764435_100000187820 [0,1,0,0,0,0|2,0,0]=3 1102 B15R1.8265 NC(=O)CNc1cccc(c1C(=O)N)F 34a_100000036109_100000187820 [0,1,0,0,0,0|2,0,0]=3 1103 B15R1.8265 NC(=O)CNc1cccc(c1C(=O)N)F 7a_100000036109_100000187820 [0,1,0,0,0,0|2,0,0]=3 1104 B15R1.8265 NC(=O)COc1cccc(c1C(=O)N)F 34a_100000701607_100000187820 [0,1,0,0,0,0|1,0,0]=2 1105 B15R1.8265 NC(=O)COc1cccc(c1C(=O)N)F 7a_100000701607_100000187820 [0,1,0,0,0,0|1,0,0]=2 1106 B15R1.8265 NC(=O)COc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100000187820 [0,1,0,0,0,0|3,0,0]=4 1107 B15R1.8265 NC(=O)COc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100000187820 [0,1,0,0,0,0|3,0,0]=4 1108 B15R1.8265 NC(=O)COc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100000187820 [0,1,0,0,0,0|3,0,0]=4 1109 B15R1.8265 NC(=O)COc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100000187820 [0,1,0,0,0,0|3,0,0]=4 1110 B15R1.8265 NC(=O)COc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100000187820 [0,1,0,0,0,0|3,0,0]=4 1111 B15R1.8265 NC(=O)COc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100000187820 [0,1,0,0,0,0|3,0,0]=4 1112 B15R1.8265 NC(=O)COc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100000187820 [0,1,0,0,0,0|3,0,0]=4 1113 B15R1.8265 NC(=O)CSc1cccc(c1C(=O)N)Cl 62a_100010147686_100000747473 [0,1,0,0,0,0|1,1,0]=3 1114 B15R1.8265 NC(=O)CSc1cccc(c1C(=O)N)F 62a_100011219063_100000747473 [0,1,0,0,0,0|1,1,0]=3 1115 B15R1.8265 NC(=O)CSc1cncc(c1C(=O)N)F 62a_100000747473_100010271514 [0,1,0,0,0,0|2,1,0]=4 1116 B15R1.8265 NC(=O)CSc1cncc(c1C(=O)N)F 62a_100010271514_100000747473 [0,1,0,0,0,0|2,1,0]=4 1117 B15R1.8265 NC(=O)c1c(cccc1NCC(=O)[O-])Cl 34a_100000764435_100020667443 [0,1,0,0,0,0|1,0,1]=3 1118 B15R1.8265 NC(=O)c1c(cccc1NCC(=O)[O-])F 34a_100000036109_100020667443 [0,1,0,0,0,0|1,0,1]=3 1119 B15R1.8265 NC(=O)c1c(cccc1NC[N+](=O)[O-])Cl 34a_100000764435_100000761209 [0,1,0,0,0,0|2,0,1]=4 1120 B15R1.8265 NC(=O)c1c(cccc1NC[N+](=O)[O-])F 34a_100000036109_100000761209 [0,1,0,0,0,0|2,0,1]=4 1121 B15R1.8265 NC(=O)c1c(cccc1OCC(=O)[O-])F 34a_100000701607_100020667443 [0,1,0,0,0,0|0,0,1]=2 1122 B15R1.8265 NC(=O)c1c(cccc1OCC(F)F)F 34a_100000701607_100011934356 [0,1,0,0,0,0|2,0,1]=4 1123 B15R1.8265 NC(=O)c1c(cccc1OCC(F)F)F 7a_100000701607_100011934356 [0,1,0,0,0,0|2,0,1]=4 1124 B15R1.8265 NC(=O)c1c(cccc1OC[N+](=O)[O-])F 34a_100000701607_100000761209 [0,1,0,0,0,0|1,0,1]=3 1125 B15R1.8265 NC(=O)c1c(cccc1SCC(=O)[O-])Cl 62a_100010147686_100020667443 [0,1,0,0,0,0|0,1,1]=3 1126 B15R1.8265 NC(=O)c1c(cccc1SCC(=O)[O-])F 62a_100011219063_100020667443 [0,1,0,0,0,0|0,1,1]=3 1127 B15R1.8265 NC(=O)c1c(cccc1SC[N+](=O)[O-])Cl 62a_100010147686_100000761209 [0,1,0,0,0,0|1,1,1]=4 1128 B15R1.8265 NC(=O)c1c(cccc1SC[N+](=O)[O-])F 62a_100011219063_100000761209 [0,1,0,0,0,0|1,1,1]=4 1129 B15R1.8265 NC(=O)c1c(cncc1SCC(=O)[O-])F 62a_100010271514_100020667443 [0,1,0,0,0,0|1,1,1]=4 1130 B15R1.8265 NC(=O)c1c(cncc1SCC(=O)[O-])F 62a_100020667443_100010271514 [0,1,0,0,0,0|1,1,1]=4 1131 B15R1.8265 O=C([O-])COc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100020667443 [0,1,0,0,0,0|2,0,1]=4 1132 B15R1.8265 O=C([O-])COc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100020667443 [0,1,0,0,0,0|2,0,1]=4 1133 B15R1.8265 O=C([O-])COc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100020667443 [0,1,0,0,0,0|2,0,1]=4 1134 B15R1.8415 C=C(C)CNc1ccc(cc1C(=O)N)Br 27a_100000765925_200000162314 [0,1,0,0,0,0|3,0,0]=4 1135 B15R1.8415 C=C(C)CNc1ccc(cc1C(=O)N)Br 34a_100000740421_100000748629 [0,1,0,0,0,0|3,0,0]=4 1136 B15R1.8415 C=C(C)CNc1ccc(cc1C(=O)N)Br 7a_100000740421_100000748629 [0,1,0,0,0,0|3,0,0]=4 1137 B15R1.8415 C=C(C)CNc1ccc(cc1C(=O)N)C 34a_100011692829_100000748629 [0,1,0,0,0,0|3,0,0]=4 1138 B15R1.8415 C=C(C)CNc1ccc(cc1C(=O)N)Cl 34a_100000743835_100000748629 [0,1,0,0,0,0|3,0,0]=4 1139 B15R1.8415 C=C(C)CNc1ccc(cc1C(=O)N)Cl 7a_100000743835_100000748629 [0,1,0,0,0,0|3,0,0]=4 1140 B15R1.8415 C=C(C)CNc1ccc(cc1C(=O)N)F 34a_100000741173_100000748629 [0,1,0,0,0,0|3,0,0]=4 1141 B15R1.8415 C=C(C)CNc1ccc(cc1C(=O)N)F 7a_100000741173_100000748629 [0,1,0,0,0,0|3,0,0]=4 1142 B15R1.8415 C=C(C)COc1ccc(cc1C(=O)C)Br 34a_100000212127_100000748629 [0,1,0,0,0,0|3,0,0]=4 1143 B15R1.8415 C=C(C)COc1ccc(cc1C(=O)C)Br 7a_100000212127_100000748629 [0,1,0,0,0,0|3,0,0]=4 1144 B15R1.8415 C=C(C)COc1ccc(cc1C(=O)C)C 34a_100000195442_100000748629 [0,1,0,0,0,0|3,0,0]=4 1145 B15R1.8415 C=C(C)COc1ccc(cc1C(=O)C)C 7a_100000195442_100000748629 [0,1,0,0,0,0|3,0,0]=4 1146 B15R1.8415 C=C(C)COc1ccc(cc1C(=O)C)Cl 34a_100000185566_100000748629 [0,1,0,0,0,0|3,0,0]=4 1147 B15R1.8415 C=C(C)COc1ccc(cc1C(=O)C)Cl 7a_100000185566_100000748629 [0,1,0,0,0,0|3,0,0]=4 1148 B15R1.8415 C=C(C)COc1ccc(cc1C(=O)C)F 7a_100000182812_100000748629 [0,1,0,0,0,0|3,0,0]=4 1149 B15R1.8415 C=C(C)COc1ccc(cc1C(=O)C)I 7a_100010712555_100000748629 [0,1,0,0,0,0|3,0,0]=4 1150 B15R1.8415 C=C(C)COc1ccc(cc1C(=O)C)N 34a_100011218865_100000748629 [0,1,0,0,0,0|3,0,0]=4 1151 B15R1.8415 C=C(C)COc1ccc(cc1C(=O)N)Br 34a_100000192807_100000748629 [0,1,0,0,0,0|2,0,0]=3 1152 B15R1.8415 C=C(C)COc1ccc(cc1C(=O)N)Br 7a_100000192807_100000748629 [0,1,0,0,0,0|2,0,0]=3 1153 B15R1.8415 C=C(C)COc1ccc(cc1C(=O)N)C 34a_200000192840_100000748629 [0,1,0,0,0,0|2,0,0]=3 1154 B15R1.8415 C=C(C)COc1ccc(cc1C(=O)N)C 7a_200000192840_100000748629 [0,1,0,0,0,0|2,0,0]=3 1155 B15R1.8415 C=C(C)COc1ccc(cc1C(=O)N)Cl 34a_100000185026_100000748629 [0,1,0,0,0,0|2,0,0]=3 1156 B15R1.8415 C=C(C)COc1ccc(cc1C(=O)N)Cl 7a_100000185026_100000748629 [0,1,0,0,0,0|2,0,0]=3 1157 B15R1.8415 C=C(C)COc1ccc(cc1C(=O)N)F 34a_100012186459_100000748629 [0,1,0,0,0,0|2,0,0]=3 1158 B15R1.8415 C=C(C)COc1ccc(cc1C(=O)N)F 7a_100012186459_100000748629 [0,1,0,0,0,0|2,0,0]=3 1159 B15R1.8415 C=C(C)COc1ccc(cc1C(=O)N)I 34a_100000192813_100000748629 [0,1,0,0,0,0|2,0,0]=3 1160 B15R1.8415 C=C(C)COc1ccc(cc1C(=O)N)I 7a_100000192813_100000748629 [0,1,0,0,0,0|2,0,0]=3 1161 B15R1.8415 C=C(C)CSc1ccc(cc1C(=O)N)Br 62a_200000162314_100000211660 [0,1,0,0,0,0|2,1,0]=4 1162 B15R1.8415 C=C(C)CSc1ccc(cc1C(=O)N)C 62a_100000748629_200012349609 [0,1,0,0,0,0|2,1,0]=4 1163 B15R1.8415 C=C(C)CSc1ccc(cc1C(=O)N)C 62a_200012349609_100000211660 [0,1,0,0,0,0|2,1,0]=4 1164 B15R1.8415 C=C(C)CSc1ccc(cc1C(=O)N)F 62a_100000206434_100000211660 [0,1,0,0,0,0|2,1,0]=4 1165 B15R1.8415 C=C(C)CSc1ccc(cc1C(=O)N)F 62a_100000748629_100000206434 [0,1,0,0,0,0|2,1,0]=4 1166 B15R1.8415 C=C(C)CSc1ccc(cc1C(=O)N)N 62a_100015186447_100000211660 [0,1,0,0,0,0|2,1,0]=4 1167 B15R1.8415 C=C(C)c1cc(ccc1OCC(=O)N)C 271570a_100000694244_200000148664 [0,1,0,0,0,0|3,0,0]=4 1168 B15R1.8415 C=C(F)CNc1ccc(cc1C(=O)N)Br 34a_100000740421_100009893438 [0,1,0,0,0,0|3,0,0]=4 1169 B15R1.8415 C=C(F)CNc1ccc(cc1C(=O)N)Br 7a_100000740421_100000042424 [0,1,0,0,0,0|3,0,0]=4 1170 B15R1.8415 C=C(F)CNc1ccc(cc1C(=O)N)C 34a_100011692829_100009893438 [0,1,0,0,0,0|3,0,0]=4 1171 B15R1.8415 C=C(F)CNc1ccc(cc1C(=O)N)Cl 34a_100000743835_100009893438 [0,1,0,0,0,0|3,0,0]=4 1172 B15R1.8415 C=C(F)CNc1ccc(cc1C(=O)N)Cl 7a_100000743835_100000042424 [0,1,0,0,0,0|3,0,0]=4 1173 B15R1.8415 C=C(F)CNc1ccc(cc1C(=O)N)F 34a_100000741173_100009893438 [0,1,0,0,0,0|3,0,0]=4 1174 B15R1.8415 C=C(F)CNc1ccc(cc1C(=O)N)F 7a_100000741173_100000042424 [0,1,0,0,0,0|3,0,0]=4 1175 B15R1.8415 C=C(F)COc1ccc(cc1C(=O)C)Br 34a_100000212127_100009893438 [0,1,0,0,0,0|3,0,0]=4 1176 B15R1.8415 C=C(F)COc1ccc(cc1C(=O)C)Br 7a_100000212127_100000042424 [0,1,0,0,0,0|3,0,0]=4 1177 B15R1.8415 C=C(F)COc1ccc(cc1C(=O)C)C 34a_100000195442_100009893438 [0,1,0,0,0,0|3,0,0]=4 1178 B15R1.8415 C=C(F)COc1ccc(cc1C(=O)C)C 7a_100000195442_100000042424 [0,1,0,0,0,0|3,0,0]=4 1179 B15R1.8415 C=C(F)COc1ccc(cc1C(=O)C)Cl 34a_100000185566_100009893438 [0,1,0,0,0,0|3,0,0]=4 1180 B15R1.8415 C=C(F)COc1ccc(cc1C(=O)C)Cl 7a_100000185566_100000042424 [0,1,0,0,0,0|3,0,0]=4 1181 B15R1.8415 C=C(F)COc1ccc(cc1C(=O)C)F 7a_100000182812_100000042424 [0,1,0,0,0,0|3,0,0]=4 1182 B15R1.8415 C=C(F)COc1ccc(cc1C(=O)C)I 7a_100010712555_100000042424 [0,1,0,0,0,0|3,0,0]=4 1183 B15R1.8415 C=C(F)COc1ccc(cc1C(=O)C)N 34a_100011218865_100009893438 [0,1,0,0,0,0|3,0,0]=4 1184 B15R1.8415 C=C(F)COc1ccc(cc1C(=O)N)Br 34a_100000192807_100009893438 [0,1,0,0,0,0|2,0,0]=3 1185 B15R1.8415 C=C(F)COc1ccc(cc1C(=O)N)Br 7a_100000192807_100000042424 [0,1,0,0,0,0|2,0,0]=3 1186 B15R1.8415 C=C(F)COc1ccc(cc1C(=O)N)C 34a_200000192840_100009893438 [0,1,0,0,0,0|2,0,0]=3 1187 B15R1.8415 C=C(F)COc1ccc(cc1C(=O)N)C 7a_200000192840_100000042424 [0,1,0,0,0,0|2,0,0]=3 1188 B15R1.8415 C=C(F)COc1ccc(cc1C(=O)N)Cl 34a_100000185026_100009893438 [0,1,0,0,0,0|2,0,0]=3 1189 B15R1.8415 C=C(F)COc1ccc(cc1C(=O)N)Cl 7a_100000185026_100000042424 [0,1,0,0,0,0|2,0,0]=3 1190 B15R1.8415 C=C(F)COc1ccc(cc1C(=O)N)F 34a_100012186459_100009893438 [0,1,0,0,0,0|2,0,0]=3 1191 B15R1.8415 C=C(F)COc1ccc(cc1C(=O)N)F 7a_100012186459_100000042424 [0,1,0,0,0,0|2,0,0]=3 1192 B15R1.8415 C=C(F)COc1ccc(cc1C(=O)N)I 34a_100000192813_100009893438 [0,1,0,0,0,0|2,0,0]=3 1193 B15R1.8415 C=C(F)COc1ccc(cc1C(=O)N)I 7a_100000192813_100000042424 [0,1,0,0,0,0|2,0,0]=3 1194 B15R1.8415 C=C(F)CSc1ccc(cc1C(=O)N)Br 62a_200000162314_100000042424 [0,1,0,0,0,0|2,1,0]=4 1195 B15R1.8415 C=C(F)CSc1ccc(cc1C(=O)N)C 62a_100000042424_200012349609 [0,1,0,0,0,0|2,1,0]=4 1196 B15R1.8415 C=C(F)CSc1ccc(cc1C(=O)N)C 62a_200012349609_100000042424 [0,1,0,0,0,0|2,1,0]=4 1197 B15R1.8415 C=C(F)CSc1ccc(cc1C(=O)N)F 62a_100000042424_100000206434 [0,1,0,0,0,0|2,1,0]=4 1198 B15R1.8415 C=C(F)CSc1ccc(cc1C(=O)N)F 62a_100000206434_100000042424 [0,1,0,0,0,0|2,1,0]=4 1199 B15R1.8415 C=C(F)CSc1ccc(cc1C(=O)N)N 62a_100015186447_100000042424 [0,1,0,0,0,0|2,1,0]=4 1200 B15R1.8415 CC(=O)COc1ccc(cc1[N+](=O)[O-])Cl 1458a_200011213644_200000210301 [0,1,0,0,0,0|3,0,0]=4 1201 B15R1.8415 CC(=O)COc1ccc(cc1[N+](=O)[O-])F 1458a_200011659226_200000210301 [0,1,0,0,0,0|3,0,0]=4 1202 B15R1.8415 CC(=O)c1cc(ccc1OCC(=O)N)Br 34a_100000212127_100000187820 [0,1,0,0,0,0|2,0,0]=3 1203 B15R1.8415 CC(=O)c1cc(ccc1OCC(=O)N)Br 7a_100000212127_100000187820 [0,1,0,0,0,0|2,0,0]=3 1204 B15R1.8415 CC(=O)c1cc(ccc1OCC(=O)N)C 34a_100000195442_100000187820 [0,1,0,0,0,0|2,0,0]=3 1205 B15R1.8415 CC(=O)c1cc(ccc1OCC(=O)N)C 7a_100000195442_100000187820 [0,1,0,0,0,0|2,0,0]=3 1206 B15R1.8415 CC(=O)c1cc(ccc1OCC(=O)N)Cl 34a_100000185566_100000187820 [0,1,0,0,0,0|2,0,0]=3 1207 B15R1.8415 CC(=O)c1cc(ccc1OCC(=O)N)Cl 7a_100000185566_100000187820 [0,1,0,0,0,0|2,0,0]=3 1208 B15R1.8415 CC(=O)c1cc(ccc1OCC(=O)N)F 7a_100000182812_100000187820 [0,1,0,0,0,0|2,0,0]=3 1209 B15R1.8415 CC(=O)c1cc(ccc1OCC(=O)N)I 7a_100010712555_100000187820 [0,1,0,0,0,0|2,0,0]=3 1210 B15R1.8415 CC(=O)c1cc(ccc1OCC(=O)N)N 34a_100011218865_100000187820 [0,1,0,0,0,0|2,0,0]=3 1211 B15R1.8415 CC(=O)c1cc(ccc1OCC(=O)[O-])Br 34a_100000212127_100020667443 [0,1,0,0,0,0|1,0,1]=3 1212 B15R1.8415 CC(=O)c1cc(ccc1OCC(=O)[O-])C 34a_100000195442_100020667443 [0,1,0,0,0,0|1,0,1]=3 1213 B15R1.8415 CC(=O)c1cc(ccc1OCC(=O)[O-])Cl 34a_100000185566_100020667443 [0,1,0,0,0,0|1,0,1]=3 1214 B15R1.8415 CC(=O)c1cc(ccc1OCC(=O)[O-])N 34a_100011218865_100020667443 [0,1,0,0,0,0|1,0,1]=3 1215 B15R1.8415 CC(=O)c1cc(ccc1OCC(C)O)Br 34a_100000212127_100011218427 [0,1,0,0,0,0|2,0,1]=4 1216 B15R1.8415 CC(=O)c1cc(ccc1OCC(C)O)Br 7a_100000212127_100011218427 [0,1,0,0,0,0|2,0,1]=4 1217 B15R1.8415 CC(=O)c1cc(ccc1OCC(C)O)C 34a_100000195442_100011218427 [0,1,0,0,0,0|2,0,1]=4 1218 B15R1.8415 CC(=O)c1cc(ccc1OCC(C)O)C 7a_100000195442_100011218427 [0,1,0,0,0,0|2,0,1]=4 1219 B15R1.8415 CC(=O)c1cc(ccc1OCC(C)O)Cl 34a_100000185566_100011218427 [0,1,0,0,0,0|2,0,1]=4 1220 B15R1.8415 CC(=O)c1cc(ccc1OCC(C)O)Cl 7a_100000185566_100011218427 [0,1,0,0,0,0|2,0,1]=4 1221 B15R1.8415 CC(=O)c1cc(ccc1OCC(C)O)F 7a_100000182812_100011218427 [0,1,0,0,0,0|2,0,1]=4 1222 B15R1.8415 CC(=O)c1cc(ccc1OCC(C)O)I 7a_100010712555_100011218427 [0,1,0,0,0,0|2,0,1]=4 1223 B15R1.8415 CC(=O)c1cc(ccc1OCC(C)O)N 34a_100011218865_100011218427 [0,1,0,0,0,0|2,0,1]=4 1224 B15R1.8415 CC(=O)c1cc(ccc1OC[C@@H](C)O)Br 34a_100000212127_100009817552 [0,1,0,0,0,0|2,0,1]=4 1225 B15R1.8415 CC(=O)c1cc(ccc1OC[C@@H](C)O)Br 7a_100000212127_100009817552 [0,1,0,0,0,0|2,0,1]=4 1226 B15R1.8415 CC(=O)c1cc(ccc1OC[C@@H](C)O)C 34a_100000195442_100009817552 [0,1,0,0,0,0|2,0,1]=4 1227 B15R1.8415 CC(=O)c1cc(ccc1OC[C@@H](C)O)C 7a_100000195442_100009817552 [0,1,0,0,0,0|2,0,1]=4 1228 B15R1.8415 CC(=O)c1cc(ccc1OC[C@@H](C)O)Cl 34a_100000185566_100009817552 [0,1,0,0,0,0|2,0,1]=4 1229 B15R1.8415 CC(=O)c1cc(ccc1OC[C@@H](C)O)Cl 7a_100000185566_100009817552 [0,1,0,0,0,0|2,0,1]=4 1230 B15R1.8415 CC(=O)c1cc(ccc1OC[C@@H](C)O)F 7a_100000182812_100009817552 [0,1,0,0,0,0|2,0,1]=4 1231 B15R1.8415 CC(=O)c1cc(ccc1OC[C@@H](C)O)I 7a_100010712555_100009817552 [0,1,0,0,0,0|2,0,1]=4 1232 B15R1.8415 CC(=O)c1cc(ccc1OC[C@@H](C)O)N 34a_100011218865_100009817552 [0,1,0,0,0,0|2,0,1]=4 1233 B15R1.8415 CC(=O)c1cc(ccc1OC[N+](=O)[O-])Br 34a_100000212127_100000761209 [0,1,0,0,0,0|2,0,1]=4 1234 B15R1.8415 CC(=O)c1cc(ccc1OC[N+](=O)[O-])C 34a_100000195442_100000761209 [0,1,0,0,0,0|2,0,1]=4 1235 B15R1.8415 CC(=O)c1cc(ccc1OC[N+](=O)[O-])Cl 34a_100000185566_100000761209 [0,1,0,0,0,0|2,0,1]=4 1236 B15R1.8415 CC(=O)c1cc(ccc1OC[N+](=O)[O-])N 34a_100011218865_100000761209 [0,1,0,0,0,0|2,0,1]=4 1237 B15R1.8415 CC(=O)c1cc(ccc1SCC(=O)N)Br 62a_100012349576_100000747473 [0,1,0,0,0,0|2,1,0]=4 1238 B15R1.8415 CC(=O)c1cc(ccc1SCC(=O)N)C 62a_100000747473_100012361225 [0,1,0,0,0,0|2,1,0]=4 1239 B15R1.8415 CC(=O)c1cc(ccc1SCC(=O)N)C 62a_100012361225_100000747473 [0,1,0,0,0,0|2,1,0]=4 1240 B15R1.8415 CC(=O)c1cc(ccc1SCC(=O)N)F 62a_100000747473_100010200798 [0,1,0,0,0,0|2,1,0]=4 1241 B15R1.8415 CC(=O)c1cc(ccc1SCC(=O)N)F 62a_100012353695_100000747473 [0,1,0,0,0,0|2,1,0]=4 1242 B15R1.8415 CC(=O)c1cc(ccc1SCC(=O)N)N 62a_100012349454_100000747473 [0,1,0,0,0,0|2,1,0]=4 1243 B15R1.8415 CC(=O)c1cc(ccc1SCC(=O)[O-])Br 62a_100012349576_100020667443 [0,1,0,0,0,0|1,1,1]=4 1244 B15R1.8415 CC(=O)c1cc(ccc1SCC(=O)[O-])C 62a_100012361225_100020667443 [0,1,0,0,0,0|1,1,1]=4 1245 B15R1.8415 CC(=O)c1cc(ccc1SCC(=O)[O-])C 62a_100020667443_100012361225 [0,1,0,0,0,0|1,1,1]=4 1246 B15R1.8415 CC(=O)c1cc(ccc1SCC(=O)[O-])F 62a_100012353695_100020667443 [0,1,0,0,0,0|1,1,1]=4 1247 B15R1.8415 CC(=O)c1cc(ccc1SCC(=O)[O-])F 62a_100020667443_100010200798 [0,1,0,0,0,0|1,1,1]=4 1248 B15R1.8415 CC(=O)c1cc(ccc1SCC(=O)[O-])N 62a_100012349454_100020667443 [0,1,0,0,0,0|1,1,1]=4 1249 B15R1.8415 CC(C)COc1ccc(cc1C(=O)N)Br 34a_100000192807_100000210624 [0,1,0,0,0,0|2,0,1]=4 1250 B15R1.8415 CC(C)COc1ccc(cc1C(=O)N)Br 7a_100000192807_100000210760 [0,1,0,0,0,0|2,0,1]=4 1251 B15R1.8415 CC(C)COc1ccc(cc1C(=O)N)Cl 34a_100000185026_100000210624 [0,1,0,0,0,0|2,0,1]=4 1252 B15R1.8415 CC(C)COc1ccc(cc1C(=O)N)Cl 7a_100000185026_100000210760 [0,1,0,0,0,0|2,0,1]=4 1253 B15R1.8415 CC(C)COc1ccc(cc1C(=O)N)F 34a_100012186459_100000210624 [0,1,0,0,0,0|2,0,1]=4 1254 B15R1.8415 CC(C)COc1ccc(cc1C(=O)N)F 7a_100012186459_100000210760 [0,1,0,0,0,0|2,0,1]=4 1255 B15R1.8415 CC(C)COc1ccc(cc1C(=O)N)I 34a_100000192813_100000210624 [0,1,0,0,0,0|2,0,1]=4 1256 B15R1.8415 CC(C)COc1ccc(cc1C(=O)N)I 7a_100000192813_100000210760 [0,1,0,0,0,0|2,0,1]=4 1257 B15R1.8415 CC(O)CNc1ccc(cc1C(=O)N)Br 27a_100000210904_200000162314 [0,1,0,0,0,0|2,0,1]=4 1258 B15R1.8415 CC(O)CNc1ccc(cc1C(=O)N)Br 34a_100000740421_100011218427 [0,1,0,0,0,0|2,0,1]=4 1259 B15R1.8415 CC(O)CNc1ccc(cc1C(=O)N)Br 7a_100000740421_100011218427 [0,1,0,0,0,0|2,0,1]=4 1260 B15R1.8415 CC(O)CNc1ccc(cc1C(=O)N)Cl 34a_100000743835_100011218427 [0,1,0,0,0,0|2,0,1]=4 1261 B15R1.8415 CC(O)CNc1ccc(cc1C(=O)N)Cl 7a_100000743835_100011218427 [0,1,0,0,0,0|2,0,1]=4 1262 B15R1.8415 CC(O)CNc1ccc(cc1C(=O)N)F 34a_100000741173_100011218427 [0,1,0,0,0,0|2,0,1]=4 1263 B15R1.8415 CC(O)CNc1ccc(cc1C(=O)N)F 7a_100000741173_100011218427 [0,1,0,0,0,0|2,0,1]=4 1264 B15R1.8415 CC(O)COc1ccc(cc1C(=O)N)Br 34a_100000192807_100011218427 [0,1,0,0,0,0|1,0,1]=3 1265 B15R1.8415 CC(O)COc1ccc(cc1C(=O)N)Br 7a_100000192807_100011218427 [0,1,0,0,0,0|1,0,1]=3 1266 B15R1.8415 CC(O)COc1ccc(cc1C(=O)N)Cl 34a_100000185026_100011218427 [0,1,0,0,0,0|1,0,1]=3 1267 B15R1.8415 CC(O)COc1ccc(cc1C(=O)N)Cl 7a_100000185026_100011218427 [0,1,0,0,0,0|1,0,1]=3 1268 B15R1.8415 CC(O)COc1ccc(cc1C(=O)N)F 34a_100012186459_100011218427 [0,1,0,0,0,0|1,0,1]=3 1269 B15R1.8415 CC(O)COc1ccc(cc1C(=O)N)F 7a_100012186459_100011218427 [0,1,0,0,0,0|1,0,1]=3 1270 B15R1.8415 CC(O)COc1ccc(cc1C(=O)N)I 34a_100000192813_100011218427 [0,1,0,0,0,0|1,0,1]=3 1271 B15R1.8415 CC(O)COc1ccc(cc1C(=O)N)I 7a_100000192813_100011218427 [0,1,0,0,0,0|1,0,1]=3 1272 B15R1.8415 CC(O)CSc1ccc(cc1C(=O)N)Br 62a_200000162314_100011218427 [0,1,0,0,0,0|1,1,1]=4 1273 B15R1.8415 CC(O)CSc1ccc(cc1C(=O)N)F 62a_100000206434_100011218427 [0,1,0,0,0,0|1,1,1]=4 1274 B15R1.8415 CC(O)CSc1ccc(cc1C(=O)N)F 62a_100011218427_100000206434 [0,1,0,0,0,0|1,1,1]=4 1275 B15R1.8415 CC(O)CSc1ccc(cc1C(=O)N)N 62a_100015186447_100011218427 [0,1,0,0,0,0|1,1,1]=4 1276 B15R1.8415 C[C@@H](N)c1cc(ccc1OCC(=O)N)Cl 34a_100011853016_100000187820 [0,1,0,0,0,0|2,0,1]=4 1277 B15R1.8415 C[C@@H](N)c1cc(ccc1OCC(=O)N)Cl 7a_100011853016_100000187820 [0,1,0,0,0,0|2,0,1]=4 1278 B15R1.8415 C[C@@H](N)c1cc(ccc1OCC(=O)[O-])Cl 34a_100011853016_100020667443 [0,1,0,0,0,0|1,0,2]=4 1279 B15R1.8415 C[C@@H](O)CNc1ccc(cc1C(=O)N)Br 34a_100000740421_100009817552 [0,1,0,0,0,0|2,0,1]=4 1280 B15R1.8415 C[C@@H](O)CNc1ccc(cc1C(=O)N)Br 7a_100000740421_100009817552 [0,1,0,0,0,0|2,0,1]=4 1281 B15R1.8415 C[C@@H](O)CNc1ccc(cc1C(=O)N)Cl 34a_100000743835_100009817552 [0,1,0,0,0,0|2,0,1]=4 1282 B15R1.8415 C[C@@H](O)CNc1ccc(cc1C(=O)N)Cl 7a_100000743835_100009817552 [0,1,0,0,0,0|2,0,1]=4 1283 B15R1.8415 C[C@@H](O)CNc1ccc(cc1C(=O)N)F 34a_100000741173_100009817552 [0,1,0,0,0,0|2,0,1]=4 1284 B15R1.8415 C[C@@H](O)CNc1ccc(cc1C(=O)N)F 7a_100000741173_100009817552 [0,1,0,0,0,0|2,0,1]=4 1285 B15R1.8415 C[C@@H](O)COc1ccc(cc1C(=O)N)Br 34a_100000192807_100009817552 [0,1,0,0,0,0|1,0,1]=3 1286 B15R1.8415 C[C@@H](O)COc1ccc(cc1C(=O)N)Br 7a_100000192807_100009817552 [0,1,0,0,0,0|1,0,1]=3 1287 B15R1.8415 C[C@@H](O)COc1ccc(cc1C(=O)N)Cl 34a_100000185026_100009817552 [0,1,0,0,0,0|1,0,1]=3 1288 B15R1.8415 C[C@@H](O)COc1ccc(cc1C(=O)N)Cl 7a_100000185026_100009817552 [0,1,0,0,0,0|1,0,1]=3 1289 B15R1.8415 C[C@@H](O)COc1ccc(cc1C(=O)N)F 34a_100012186459_100009817552 [0,1,0,0,0,0|1,0,1]=3 1290 B15R1.8415 C[C@@H](O)COc1ccc(cc1C(=O)N)F 7a_100012186459_100009817552 [0,1,0,0,0,0|1,0,1]=3 1291 B15R1.8415 C[C@@H](O)COc1ccc(cc1C(=O)N)I 34a_100000192813_100009817552 [0,1,0,0,0,0|1,0,1]=3 1292 B15R1.8415 C[C@@H](O)COc1ccc(cc1C(=O)N)I 7a_100000192813_100009817552 [0,1,0,0,0,0|1,0,1]=3 1293 B15R1.8415 C[C@@H](O)CSc1ccc(cc1C(=O)N)Br 62a_200000162314_100009817552 [0,1,0,0,0,0|1,1,1]=4 1294 B15R1.8415 C[C@@H](O)CSc1ccc(cc1C(=O)N)F 62a_100000206434_100009817552 [0,1,0,0,0,0|1,1,1]=4 1295 B15R1.8415 C[C@@H](O)CSc1ccc(cc1C(=O)N)F 62a_100009817552_100000206434 [0,1,0,0,0,0|1,1,1]=4 1296 B15R1.8415 C[C@@H](O)CSc1ccc(cc1C(=O)N)N 62a_100015186447_100009817552 [0,1,0,0,0,0|1,1,1]=4 1297 B15R1.8415 C[C@H](N)c1cc(ccc1OCC(=O)N)F 34a_100160469477_100000187820 [0,1,0,0,0,0|2,0,1]=4 1298 B15R1.8415 C[C@H](N)c1cc(ccc1OCC(=O)N)F 7a_100160469477_100000187820 [0,1,0,0,0,0|2,0,1]=4 1299 B15R1.8415 C[C@H](N)c1cc(ccc1OCC(=O)[O-])F 34a_100160469477_100020667443 [0,1,0,0,0,0|1,0,2]=4 1300 B15R1.8415 Cc1ccc(c(c1)C(=O)N)NCC(=O)N 34a_100011692829_100000187820 [0,1,0,0,0,0|2,0,0]=3 1301 B15R1.8415 Cc1ccc(c(c1)C(=O)N)NCC(=O)[O-] 34a_100011692829_100020667443 [0,1,0,0,0,0|1,0,1]=3 1302 B15R1.8415 Cc1ccc(c(c1)C(=O)N)NCC(C)O 34a_100011692829_100011218427 [0,1,0,0,0,0|2,0,1]=4 1303 B15R1.8415 Cc1ccc(c(c1)C(=O)N)NC[C@@H](C)O 34a_100011692829_100009817552 [0,1,0,0,0,0|2,0,1]=4 1304 B15R1.8415 Cc1ccc(c(c1)C(=O)N)NC[N+](=O)[O-] 34a_100011692829_100000761209 [0,1,0,0,0,0|2,0,1]=4 1305 B15R1.8415 Cc1ccc(c(c1)C(=O)N)OCC(=O)N 34a_200000192840_100000187820 [0,1,0,0,0,0|1,0,0]=2 1306 B15R1.8415 Cc1ccc(c(c1)C(=O)N)OCC(=O)N 7a_200000192840_100000187820 [0,1,0,0,0,0|1,0,0]=2 1307 B15R1.8415 Cc1ccc(c(c1)C(=O)N)OCC(=O)[O-] 34a_200000192840_100020667443 [0,1,0,0,0,0|0,0,1]=2 1308 B15R1.8415 Cc1ccc(c(c1)C(=O)N)OCC(C)C 34a_200000192840_100000210624 [0,1,0,0,0,0|2,0,1]=4 1309 B15R1.8415 Cc1ccc(c(c1)C(=O)N)OCC(C)C 7a_200000192840_100000210760 [0,1,0,0,0,0|2,0,1]=4 1310 B15R1.8415 Cc1ccc(c(c1)C(=O)N)OCC(C)O 34a_200000192840_100011218427 [0,1,0,0,0,0|1,0,1]=3 1311 B15R1.8415 Cc1ccc(c(c1)C(=O)N)OCC(C)O 7a_200000192840_100011218427 [0,1,0,0,0,0|1,0,1]=3 1312 B15R1.8415 Cc1ccc(c(c1)C(=O)N)OCC(F)F 34a_200000192840_100011934356 [0,1,0,0,0,0|2,0,1]=4 1313 B15R1.8415 Cc1ccc(c(c1)C(=O)N)OCC(F)F 7a_200000192840_100011934356 [0,1,0,0,0,0|2,0,1]=4 1314 B15R1.8415 Cc1ccc(c(c1)C(=O)N)OC[C@@H](C)O 34a_200000192840_100009817552 [0,1,0,0,0,0|1,0,1]=3 1315 B15R1.8415 Cc1ccc(c(c1)C(=O)N)OC[C@@H](C)O 7a_200000192840_100009817552 [0,1,0,0,0,0|1,0,1]=3 1316 B15R1.8415 Cc1ccc(c(c1)C(=O)N)OC[N+](=O)[O-] 34a_200000192840_100000761209 [0,1,0,0,0,0|1,0,1]=3 1317 B15R1.8415 Cc1ccc(c(c1)C(=O)N)SCC(=O)N 62a_100000747473_200012349609 [0,1,0,0,0,0|1,1,0]=3 1318 B15R1.8415 Cc1ccc(c(c1)C(=O)N)SCC(=O)N 62a_200012349609_100000747473 [0,1,0,0,0,0|1,1,0]=3 1319 B15R1.8415 Cc1ccc(c(c1)C(=O)N)SCC(=O)[O-] 62a_100020667443_200012349609 [0,1,0,0,0,0|0,1,1]=3 1320 B15R1.8415 Cc1ccc(c(c1)C(=O)N)SCC(=O)[O-] 62a_200012349609_100020667443 [0,1,0,0,0,0|0,1,1]=3 1321 B15R1.8415 Cc1ccc(c(c1)C(=O)N)SCC(C)O 62a_100011218427_200012349609 [0,1,0,0,0,0|1,1,1]=4 1322 B15R1.8415 Cc1ccc(c(c1)C(=O)N)SCC(C)O 62a_200012349609_100011218427 [0,1,0,0,0,0|1,1,1]=4 1323 B15R1.8415 Cc1ccc(c(c1)C(=O)N)SC[C@@H](C)O 62a_100009817552_200012349609 [0,1,0,0,0,0|1,1,1]=4 1324 B15R1.8415 Cc1ccc(c(c1)C(=O)N)SC[C@@H](C)O 62a_200012349609_100009817552 [0,1,0,0,0,0|1,1,1]=4 1325 B15R1.8415 Cc1ccc(c(c1)C(=O)N)SC[N+](=O)[O-] 62a_200012349609_100000761209 [0,1,0,0,0,0|1,1,1]=4 1326 B15R1.8415 Cc1ccc(c(c1)[N+](=O)[O-])OCC(=O)N 34a_100000195567_100000187820 [0,1,0,0,0,0|3,0,0]=4 1327 B15R1.8415 Cc1ccc(c(c1)[N+](=O)[O-])OCC(=O)N 7a_100000195567_100000187820 [0,1,0,0,0,0|3,0,0]=4 1328 B15R1.8415 Cc1ccc(c(c1)[N+](=O)[O-])OCC(=O)[O-] 34a_100000195567_100020667443 [0,1,0,0,0,0|2,0,1]=4 1329 B15R1.8415 NC(=O)CNc1ccc(cc1C(=O)N)Br 34a_100000740421_100000187820 [0,1,0,0,0,0|2,0,0]=3 1330 B15R1.8415 NC(=O)CNc1ccc(cc1C(=O)N)Br 7a_100000740421_100000187820 [0,1,0,0,0,0|2,0,0]=3 1331 B15R1.8415 NC(=O)CNc1ccc(cc1C(=O)N)Cl 34a_100000743835_100000187820 [0,1,0,0,0,0|2,0,0]=3 1332 B15R1.8415 NC(=O)CNc1ccc(cc1C(=O)N)Cl 7a_100000743835_100000187820 [0,1,0,0,0,0|2,0,0]=3 1333 B15R1.8415 NC(=O)CNc1ccc(cc1C(=O)N)F 34a_100000741173_100000187820 [0,1,0,0,0,0|2,0,0]=3 1334 B15R1.8415 NC(=O)CNc1ccc(cc1C(=O)N)F 7a_100000741173_100000187820 [0,1,0,0,0,0|2,0,0]=3 1335 B15R1.8415 NC(=O)COc1ccc(cc1C(=O)N)Br 34a_100000192807_100000187820 [0,1,0,0,0,0|1,0,0]=2 1336 B15R1.8415 NC(=O)COc1ccc(cc1C(=O)N)Br 7a_100000192807_100000187820 [0,1,0,0,0,0|1,0,0]=2 1337 B15R1.8415 NC(=O)COc1ccc(cc1C(=O)N)Cl 34a_100000185026_100000187820 [0,1,0,0,0,0|1,0,0]=2 1338 B15R1.8415 NC(=O)COc1ccc(cc1C(=O)N)Cl 7a_100000185026_100000187820 [0,1,0,0,0,0|1,0,0]=2 1339 B15R1.8415 NC(=O)COc1ccc(cc1C(=O)N)F 34a_100012186459_100000187820 [0,1,0,0,0,0|1,0,0]=2 1340 B15R1.8415 NC(=O)COc1ccc(cc1C(=O)N)F 7a_100012186459_100000187820 [0,1,0,0,0,0|1,0,0]=2 1341 B15R1.8415 NC(=O)COc1ccc(cc1C(=O)N)I 34a_100000192813_100000187820 [0,1,0,0,0,0|1,0,0]=2 1342 B15R1.8415 NC(=O)COc1ccc(cc1C(=O)N)I 7a_100000192813_100000187820 [0,1,0,0,0,0|1,0,0]=2 1343 B15R1.8415 NC(=O)COc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100000187820 [0,1,0,0,0,0|3,0,0]=4 1344 B15R1.8415 NC(=O)COc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100000187820 [0,1,0,0,0,0|3,0,0]=4 1345 B15R1.8415 NC(=O)COc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100000187820 [0,1,0,0,0,0|3,0,0]=4 1346 B15R1.8415 NC(=O)COc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100000187820 [0,1,0,0,0,0|3,0,0]=4 1347 B15R1.8415 NC(=O)COc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100000187820 [0,1,0,0,0,0|3,0,0]=4 1348 B15R1.8415 NC(=O)COc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100000187820 [0,1,0,0,0,0|3,0,0]=4 1349 B15R1.8415 NC(=O)COc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100000187820 [0,1,0,0,0,0|3,0,0]=4 1350 B15R1.8415 NC(=O)COc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100000187820 [0,1,0,0,0,0|3,0,0]=4 1351 B15R1.8415 NC(=O)COc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100000187820 [0,1,0,0,0,0|3,0,0]=4 1352 B15R1.8415 NC(=O)CSc1ccc(cc1C(=O)N)Br 62a_200000162314_100000747473 [0,1,0,0,0,0|1,1,0]=3 1353 B15R1.8415 NC(=O)CSc1ccc(cc1C(=O)N)F 62a_100000206434_100000747473 [0,1,0,0,0,0|1,1,0]=3 1354 B15R1.8415 NC(=O)CSc1ccc(cc1C(=O)N)F 62a_100000747473_100000206434 [0,1,0,0,0,0|1,1,0]=3 1355 B15R1.8415 NC(=O)CSc1ccc(cc1C(=O)N)N 62a_100015186447_100000747473 [0,1,0,0,0,0|1,1,0]=3 1356 B15R1.8415 NC(=O)CSc1ccc(cc1C(=O)O)Br 62a_100011072988_100000747473 [0,1,0,0,0,0|2,1,0]=4 1357 B15R1.8415 NC(=O)CSc1ncc(cc1C(=O)N)F 62a_100000747473_100012183597 [0,1,0,0,0,0|2,1,0]=4 1358 B15R1.8415 NC(=O)CSc1ncc(cc1C(=O)N)F 62a_100012183597_100000747473 [0,1,0,0,0,0|2,1,0]=4 1359 B15R1.8415 NC(=O)c1cc(ccc1NCC(=O)[O-])Br 34a_100000740421_100020667443 [0,1,0,0,0,0|1,0,1]=3 1360 B15R1.8415 NC(=O)c1cc(ccc1NCC(=O)[O-])Cl 34a_100000743835_100020667443 [0,1,0,0,0,0|1,0,1]=3 1361 B15R1.8415 NC(=O)c1cc(ccc1NCC(=O)[O-])F 34a_100000741173_100020667443 [0,1,0,0,0,0|1,0,1]=3 1362 B15R1.8415 NC(=O)c1cc(ccc1NC[N+](=O)[O-])Br 34a_100000740421_100000761209 [0,1,0,0,0,0|2,0,1]=4 1363 B15R1.8415 NC(=O)c1cc(ccc1NC[N+](=O)[O-])Cl 34a_100000743835_100000761209 [0,1,0,0,0,0|2,0,1]=4 1364 B15R1.8415 NC(=O)c1cc(ccc1NC[N+](=O)[O-])F 34a_100000741173_100000761209 [0,1,0,0,0,0|2,0,1]=4 1365 B15R1.8415 NC(=O)c1cc(ccc1OCC(=O)[O-])Br 34a_100000192807_100020667443 [0,1,0,0,0,0|0,0,1]=2 1366 B15R1.8415 NC(=O)c1cc(ccc1OCC(=O)[O-])Cl 34a_100000185026_100020667443 [0,1,0,0,0,0|0,0,1]=2 1367 B15R1.8415 NC(=O)c1cc(ccc1OCC(=O)[O-])F 34a_100012186459_100020667443 [0,1,0,0,0,0|0,0,1]=2 1368 B15R1.8415 NC(=O)c1cc(ccc1OCC(=O)[O-])I 34a_100000192813_100020667443 [0,1,0,0,0,0|0,0,1]=2 1369 B15R1.8415 NC(=O)c1cc(ccc1OCC(F)F)Br 34a_100000192807_100011934356 [0,1,0,0,0,0|2,0,1]=4 1370 B15R1.8415 NC(=O)c1cc(ccc1OCC(F)F)Br 7a_100000192807_100011934356 [0,1,0,0,0,0|2,0,1]=4 1371 B15R1.8415 NC(=O)c1cc(ccc1OCC(F)F)Cl 34a_100000185026_100011934356 [0,1,0,0,0,0|2,0,1]=4 1372 B15R1.8415 NC(=O)c1cc(ccc1OCC(F)F)Cl 7a_100000185026_100011934356 [0,1,0,0,0,0|2,0,1]=4 1373 B15R1.8415 NC(=O)c1cc(ccc1OCC(F)F)F 34a_100012186459_100011934356 [0,1,0,0,0,0|2,0,1]=4 1374 B15R1.8415 NC(=O)c1cc(ccc1OCC(F)F)F 7a_100012186459_100011934356 [0,1,0,0,0,0|2,0,1]=4 1375 B15R1.8415 NC(=O)c1cc(ccc1OCC(F)F)I 34a_100000192813_100011934356 [0,1,0,0,0,0|2,0,1]=4 1376 B15R1.8415 NC(=O)c1cc(ccc1OCC(F)F)I 7a_100000192813_100011934356 [0,1,0,0,0,0|2,0,1]=4 1377 B15R1.8415 NC(=O)c1cc(ccc1OC[N+](=O)[O-])Br 34a_100000192807_100000761209 [0,1,0,0,0,0|1,0,1]=3 1378 B15R1.8415 NC(=O)c1cc(ccc1OC[N+](=O)[O-])Cl 34a_100000185026_100000761209 [0,1,0,0,0,0|1,0,1]=3 1379 B15R1.8415 NC(=O)c1cc(ccc1OC[N+](=O)[O-])F 34a_100012186459_100000761209 [0,1,0,0,0,0|1,0,1]=3 1380 B15R1.8415 NC(=O)c1cc(ccc1OC[N+](=O)[O-])I 34a_100000192813_100000761209 [0,1,0,0,0,0|1,0,1]=3 1381 B15R1.8415 NC(=O)c1cc(ccc1SCC(=O)[O-])Br 62a_200000162314_100020667443 [0,1,0,0,0,0|0,1,1]=3 1382 B15R1.8415 NC(=O)c1cc(ccc1SCC(=O)[O-])F 62a_100000206434_100020667443 [0,1,0,0,0,0|0,1,1]=3 1383 B15R1.8415 NC(=O)c1cc(ccc1SCC(=O)[O-])F 62a_100020667443_100000206434 [0,1,0,0,0,0|0,1,1]=3 1384 B15R1.8415 NC(=O)c1cc(ccc1SCC(=O)[O-])N 62a_100015186447_100020667443 [0,1,0,0,0,0|0,1,1]=3 1385 B15R1.8415 NC(=O)c1cc(ccc1SC[N+](=O)[O-])Br 62a_200000162314_100000761209 [0,1,0,0,0,0|1,1,1]=4 1386 B15R1.8415 NC(=O)c1cc(ccc1SC[N+](=O)[O-])F 62a_100000206434_100000761209 [0,1,0,0,0,0|1,1,1]=4 1387 B15R1.8415 NC(=O)c1cc(ccc1SC[N+](=O)[O-])N 62a_100015186447_100000761209 [0,1,0,0,0,0|1,1,1]=4 1388 B15R1.8415 NC(=O)c1cc(cnc1SCC(=O)[O-])F 62a_100012183597_100020667443 [0,1,0,0,0,0|1,1,1]=4 1389 B15R1.8415 NC(=O)c1cc(cnc1SCC(=O)[O-])F 62a_100020667443_100012183597 [0,1,0,0,0,0|1,1,1]=4 1390 B15R1.8415 Nc1ccc(c(c1)[N+](=O)[O-])OCC(=O)[O-] 34a_100000032192_100020667443 [0,1,0,0,0,0|2,0,1]=4 1391 B15R1.8415 O=C([O-])COc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100020667443 [0,1,0,0,0,0|2,0,1]=4 1392 B15R1.8415 O=C([O-])COc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100020667443 [0,1,0,0,0,0|2,0,1]=4 1393 B15R1.8415 O=C([O-])COc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100020667443 [0,1,0,0,0,0|2,0,1]=4 1394 B15R1.8415 O=C([O-])CSc1ccc(cc1C(=O)O)Br 62a_100011072988_100020667443 [0,1,0,0,0,0|1,1,1]=4 1395 B15R1.8415 [13CH3]C(=O)COc1ccc(cc1[N+](=O)[O-])Cl 1458a_200011213644_200025704644 [0,1,0,0,0,0|3,0,0]=4 1396 B15R1.8415 [13CH3]C(=O)COc1ccc(cc1[N+](=O)[O-])F 1458a_200011659226_200025704644 [0,1,0,0,0,0|3,0,0]=4 1397 B15R1.8435 C=C(C)CNc1cc(ccc1C(=O)N)Br 27a_100000765925_100009815748 [0,1,0,0,0,0|3,0,0]=4 1398 B15R1.8435 C=C(C)CNc1cc(ccc1C(=O)N)Br 7a_100012349972_100000748629 [0,1,0,0,0,0|3,0,0]=4 1399 B15R1.8435 C=C(C)CNc1cc(ccc1C(=O)N)C 34a_100011219537_100000748629 [0,1,0,0,0,0|3,0,0]=4 1400 B15R1.8435 C=C(C)CNc1cc(ccc1C(=O)N)C 7a_100011219537_100000748629 [0,1,0,0,0,0|3,0,0]=4 1401 B15R1.8435 C=C(C)CNc1cc(ccc1C(=O)N)Cl 34a_100000738103_100000748629 [0,1,0,0,0,0|3,0,0]=4 1402 B15R1.8435 C=C(C)CNc1cc(ccc1C(=O)N)Cl 7a_100000738103_100000748629 [0,1,0,0,0,0|3,0,0]=4 1403 B15R1.8435 C=C(C)CNc1cc(ccc1C(=O)N)F 27a_100000765925_100000206404 [0,1,0,0,0,0|3,0,0]=4 1404 B15R1.8435 C=C(C)CNc1cc(ccc1C(=O)N)F 34a_100011298637_100000748629 [0,1,0,0,0,0|3,0,0]=4 1405 B15R1.8435 C=C(C)COc1cc(ccc1C(=O)C)Br 7a_100000188348_100000748629 [0,1,0,0,0,0|3,0,0]=4 1406 B15R1.8435 C=C(C)COc1cc(ccc1C(=O)C)C 34a_100000234885_100000748629 [0,1,0,0,0,0|3,0,0]=4 1407 B15R1.8435 C=C(C)COc1cc(ccc1C(=O)C)C 7a_100000234885_100000748629 [0,1,0,0,0,0|3,0,0]=4 1408 B15R1.8435 C=C(C)COc1cc(ccc1C(=O)C)Cl 34a_100000061402_100000748629 [0,1,0,0,0,0|3,0,0]=4 1409 B15R1.8435 C=C(C)COc1cc(ccc1C(=O)C)Cl 7a_100000061402_100000748629 [0,1,0,0,0,0|3,0,0]=4 1410 B15R1.8435 C=C(C)COc1cc(ccc1C(=O)C)F 7a_100011215782_100000748629 [0,1,0,0,0,0|3,0,0]=4 1411 B15R1.8435 C=C(C)COc1cc(ccc1C(=O)N)Br 34a_100011550861_100000748629 [0,1,0,0,0,0|2,0,0]=3 1412 B15R1.8435 C=C(C)COc1cc(ccc1C(=O)N)Br 7a_100011550861_100000748629 [0,1,0,0,0,0|2,0,0]=3 1413 B15R1.8435 C=C(C)COc1cc(ccc1C(=O)N)C 34a_100000192831_100000748629 [0,1,0,0,0,0|2,0,0]=3 1414 B15R1.8435 C=C(C)COc1cc(ccc1C(=O)N)C 7a_100000192831_100000748629 [0,1,0,0,0,0|2,0,0]=3 1415 B15R1.8435 C=C(C)COc1cc(ccc1C(=O)N)Cl 34a_100000192836_100000748629 [0,1,0,0,0,0|2,0,0]=3 1416 B15R1.8435 C=C(C)COc1cc(ccc1C(=O)N)Cl 7a_100000192836_100000748629 [0,1,0,0,0,0|2,0,0]=3 1417 B15R1.8435 C=C(C)COc1cc(ccc1C(=O)N)N 34a_100000223280_100000748629 [0,1,0,0,0,0|2,0,0]=3 1418 B15R1.8435 C=C(C)COc1cc(ccc1C(=O)N)N 7a_100000223280_100000748629 [0,1,0,0,0,0|2,0,0]=3 1419 B15R1.8435 C=C(C)CSc1cc(ccc1C(=O)N)Br 62a_100009815748_100000211660 [0,1,0,0,0,0|2,1,0]=4 1420 B15R1.8435 C=C(C)CSc1cc(ccc1C(=O)N)F 62a_100000206404_100000211660 [0,1,0,0,0,0|2,1,0]=4 1421 B15R1.8435 C=C(C)CSc1cc(ccc1C(=O)N)F 62a_100000748629_100000206404 [0,1,0,0,0,0|2,1,0]=4 1422 B15R1.8435 C=C(F)CNc1cc(ccc1C(=O)N)Br 7a_100012349972_100000042424 [0,1,0,0,0,0|3,0,0]=4 1423 B15R1.8435 C=C(F)CNc1cc(ccc1C(=O)N)C 34a_100011219537_100009893438 [0,1,0,0,0,0|3,0,0]=4 1424 B15R1.8435 C=C(F)CNc1cc(ccc1C(=O)N)C 7a_100011219537_100000042424 [0,1,0,0,0,0|3,0,0]=4 1425 B15R1.8435 C=C(F)CNc1cc(ccc1C(=O)N)Cl 34a_100000738103_100009893438 [0,1,0,0,0,0|3,0,0]=4 1426 B15R1.8435 C=C(F)CNc1cc(ccc1C(=O)N)Cl 7a_100000738103_100000042424 [0,1,0,0,0,0|3,0,0]=4 1427 B15R1.8435 C=C(F)CNc1cc(ccc1C(=O)N)F 34a_100011298637_100009893438 [0,1,0,0,0,0|3,0,0]=4 1428 B15R1.8435 C=C(F)COc1cc(ccc1C(=O)C)Br 7a_100000188348_100000042424 [0,1,0,0,0,0|3,0,0]=4 1429 B15R1.8435 C=C(F)COc1cc(ccc1C(=O)C)C 34a_100000234885_100009893438 [0,1,0,0,0,0|3,0,0]=4 1430 B15R1.8435 C=C(F)COc1cc(ccc1C(=O)C)C 7a_100000234885_100000042424 [0,1,0,0,0,0|3,0,0]=4 1431 B15R1.8435 C=C(F)COc1cc(ccc1C(=O)C)Cl 34a_100000061402_100009893438 [0,1,0,0,0,0|3,0,0]=4 1432 B15R1.8435 C=C(F)COc1cc(ccc1C(=O)C)Cl 7a_100000061402_100000042424 [0,1,0,0,0,0|3,0,0]=4 1433 B15R1.8435 C=C(F)COc1cc(ccc1C(=O)C)F 7a_100011215782_100000042424 [0,1,0,0,0,0|3,0,0]=4 1434 B15R1.8435 C=C(F)COc1cc(ccc1C(=O)N)Br 34a_100011550861_100009893438 [0,1,0,0,0,0|2,0,0]=3 1435 B15R1.8435 C=C(F)COc1cc(ccc1C(=O)N)Br 7a_100011550861_100000042424 [0,1,0,0,0,0|2,0,0]=3 1436 B15R1.8435 C=C(F)COc1cc(ccc1C(=O)N)C 34a_100000192831_100009893438 [0,1,0,0,0,0|2,0,0]=3 1437 B15R1.8435 C=C(F)COc1cc(ccc1C(=O)N)C 7a_100000192831_100000042424 [0,1,0,0,0,0|2,0,0]=3 1438 B15R1.8435 C=C(F)COc1cc(ccc1C(=O)N)Cl 34a_100000192836_100009893438 [0,1,0,0,0,0|2,0,0]=3 1439 B15R1.8435 C=C(F)COc1cc(ccc1C(=O)N)Cl 7a_100000192836_100000042424 [0,1,0,0,0,0|2,0,0]=3 1440 B15R1.8435 C=C(F)COc1cc(ccc1C(=O)N)N 34a_100000223280_100009893438 [0,1,0,0,0,0|2,0,0]=3 1441 B15R1.8435 C=C(F)COc1cc(ccc1C(=O)N)N 7a_100000223280_100000042424 [0,1,0,0,0,0|2,0,0]=3 1442 B15R1.8435 C=C(F)CSc1cc(ccc1C(=O)N)Br 62a_100009815748_100000042424 [0,1,0,0,0,0|2,1,0]=4 1443 B15R1.8435 C=C(F)CSc1cc(ccc1C(=O)N)F 62a_100000042424_100000206404 [0,1,0,0,0,0|2,1,0]=4 1444 B15R1.8435 C=C(F)CSc1cc(ccc1C(=O)N)F 62a_100000206404_100000042424 [0,1,0,0,0,0|2,1,0]=4 1445 B15R1.8435 CC(=O)c1ccc(cc1OCC(=O)N)Br 7a_100000188348_100000187820 [0,1,0,0,0,0|2,0,0]=3 1446 B15R1.8435 CC(=O)c1ccc(cc1OCC(=O)N)C 34a_100000234885_100000187820 [0,1,0,0,0,0|2,0,0]=3 1447 B15R1.8435 CC(=O)c1ccc(cc1OCC(=O)N)C 7a_100000234885_100000187820 [0,1,0,0,0,0|2,0,0]=3 1448 B15R1.8435 CC(=O)c1ccc(cc1OCC(=O)N)Cl 34a_100000061402_100000187820 [0,1,0,0,0,0|2,0,0]=3 1449 B15R1.8435 CC(=O)c1ccc(cc1OCC(=O)N)Cl 7a_100000061402_100000187820 [0,1,0,0,0,0|2,0,0]=3 1450 B15R1.8435 CC(=O)c1ccc(cc1OCC(=O)N)F 7a_100011215782_100000187820 [0,1,0,0,0,0|2,0,0]=3 1451 B15R1.8435 CC(=O)c1ccc(cc1OCC(=O)[O-])C 34a_100000234885_100020667443 [0,1,0,0,0,0|1,0,1]=3 1452 B15R1.8435 CC(=O)c1ccc(cc1OCC(=O)[O-])Cl 34a_100000061402_100020667443 [0,1,0,0,0,0|1,0,1]=3 1453 B15R1.8435 CC(=O)c1ccc(cc1OCC(C)O)Br 7a_100000188348_100011218427 [0,1,0,0,0,0|2,0,1]=4 1454 B15R1.8435 CC(=O)c1ccc(cc1OCC(C)O)C 34a_100000234885_100011218427 [0,1,0,0,0,0|2,0,1]=4 1455 B15R1.8435 CC(=O)c1ccc(cc1OCC(C)O)C 7a_100000234885_100011218427 [0,1,0,0,0,0|2,0,1]=4 1456 B15R1.8435 CC(=O)c1ccc(cc1OCC(C)O)Cl 34a_100000061402_100011218427 [0,1,0,0,0,0|2,0,1]=4 1457 B15R1.8435 CC(=O)c1ccc(cc1OCC(C)O)Cl 7a_100000061402_100011218427 [0,1,0,0,0,0|2,0,1]=4 1458 B15R1.8435 CC(=O)c1ccc(cc1OCC(C)O)F 7a_100011215782_100011218427 [0,1,0,0,0,0|2,0,1]=4 1459 B15R1.8435 CC(=O)c1ccc(cc1OC[C@@H](C)O)Br 7a_100000188348_100009817552 [0,1,0,0,0,0|2,0,1]=4 1460 B15R1.8435 CC(=O)c1ccc(cc1OC[C@@H](C)O)C 34a_100000234885_100009817552 [0,1,0,0,0,0|2,0,1]=4 1461 B15R1.8435 CC(=O)c1ccc(cc1OC[C@@H](C)O)C 7a_100000234885_100009817552 [0,1,0,0,0,0|2,0,1]=4 1462 B15R1.8435 CC(=O)c1ccc(cc1OC[C@@H](C)O)Cl 34a_100000061402_100009817552 [0,1,0,0,0,0|2,0,1]=4 1463 B15R1.8435 CC(=O)c1ccc(cc1OC[C@@H](C)O)Cl 7a_100000061402_100009817552 [0,1,0,0,0,0|2,0,1]=4 1464 B15R1.8435 CC(=O)c1ccc(cc1OC[C@@H](C)O)F 7a_100011215782_100009817552 [0,1,0,0,0,0|2,0,1]=4 1465 B15R1.8435 CC(=O)c1ccc(cc1OC[N+](=O)[O-])C 34a_100000234885_100000761209 [0,1,0,0,0,0|2,0,1]=4 1466 B15R1.8435 CC(=O)c1ccc(cc1OC[N+](=O)[O-])Cl 34a_100000061402_100000761209 [0,1,0,0,0,0|2,0,1]=4 1467 B15R1.8435 CC(=O)c1ccc(cc1SCC(=O)N)C 62a_100000747473_100012353930 [0,1,0,0,0,0|2,1,0]=4 1468 B15R1.8435 CC(=O)c1ccc(cc1SCC(=O)N)C 62a_100012353930_100000747473 [0,1,0,0,0,0|2,1,0]=4 1469 B15R1.8435 CC(=O)c1ccc(cc1SCC(=O)N)F 62a_100000686192_100000747473 [0,1,0,0,0,0|2,1,0]=4 1470 B15R1.8435 CC(=O)c1ccc(cc1SCC(=O)N)O 62a_100012340537_100000747473 [0,1,0,0,0,0|2,1,0]=4 1471 B15R1.8435 CC(=O)c1ccc(cc1SCC(=O)[O-])C 62a_100012353930_100020667443 [0,1,0,0,0,0|1,1,1]=4 1472 B15R1.8435 CC(=O)c1ccc(cc1SCC(=O)[O-])C 62a_100020667443_100012353930 [0,1,0,0,0,0|1,1,1]=4 1473 B15R1.8435 CC(=O)c1ccc(cc1SCC(=O)[O-])F 62a_100000686192_100020667443 [0,1,0,0,0,0|1,1,1]=4 1474 B15R1.8435 CC(=O)c1ccc(cc1SCC(=O)[O-])O 62a_100012340537_100020667443 [0,1,0,0,0,0|1,1,1]=4 1475 B15R1.8435 CC(C)COc1cc(ccc1C(=O)N)Br 34a_100011550861_100000210624 [0,1,0,0,0,0|2,0,1]=4 1476 B15R1.8435 CC(C)COc1cc(ccc1C(=O)N)Br 7a_100011550861_100000210760 [0,1,0,0,0,0|2,0,1]=4 1477 B15R1.8435 CC(C)COc1cc(ccc1C(=O)N)Cl 34a_100000192836_100000210624 [0,1,0,0,0,0|2,0,1]=4 1478 B15R1.8435 CC(C)COc1cc(ccc1C(=O)N)Cl 7a_100000192836_100000210760 [0,1,0,0,0,0|2,0,1]=4 1479 B15R1.8435 CC(C)COc1cc(ccc1C(=O)N)N 34a_100000223280_100000210624 [0,1,0,0,0,0|2,0,1]=4 1480 B15R1.8435 CC(C)COc1cc(ccc1C(=O)N)N 7a_100000223280_100000210760 [0,1,0,0,0,0|2,0,1]=4 1481 B15R1.8435 CC(O)CNc1cc(ccc1C(=O)N)Br 27a_100000210904_100009815748 [0,1,0,0,0,0|2,0,1]=4 1482 B15R1.8435 CC(O)CNc1cc(ccc1C(=O)N)Br 7a_100012349972_100011218427 [0,1,0,0,0,0|2,0,1]=4 1483 B15R1.8435 CC(O)CNc1cc(ccc1C(=O)N)Cl 34a_100000738103_100011218427 [0,1,0,0,0,0|2,0,1]=4 1484 B15R1.8435 CC(O)CNc1cc(ccc1C(=O)N)Cl 7a_100000738103_100011218427 [0,1,0,0,0,0|2,0,1]=4 1485 B15R1.8435 CC(O)CNc1cc(ccc1C(=O)N)F 27a_100000210904_100000206404 [0,1,0,0,0,0|2,0,1]=4 1486 B15R1.8435 CC(O)CNc1cc(ccc1C(=O)N)F 34a_100011298637_100011218427 [0,1,0,0,0,0|2,0,1]=4 1487 B15R1.8435 CC(O)COc1cc(ccc1C(=O)N)Br 34a_100011550861_100011218427 [0,1,0,0,0,0|1,0,1]=3 1488 B15R1.8435 CC(O)COc1cc(ccc1C(=O)N)Br 7a_100011550861_100011218427 [0,1,0,0,0,0|1,0,1]=3 1489 B15R1.8435 CC(O)COc1cc(ccc1C(=O)N)Cl 34a_100000192836_100011218427 [0,1,0,0,0,0|1,0,1]=3 1490 B15R1.8435 CC(O)COc1cc(ccc1C(=O)N)Cl 7a_100000192836_100011218427 [0,1,0,0,0,0|1,0,1]=3 1491 B15R1.8435 CC(O)COc1cc(ccc1C(=O)N)N 34a_100000223280_100011218427 [0,1,0,0,0,0|1,0,1]=3 1492 B15R1.8435 CC(O)COc1cc(ccc1C(=O)N)N 7a_100000223280_100011218427 [0,1,0,0,0,0|1,0,1]=3 1493 B15R1.8435 CC(O)CSc1cc(ccc1C(=O)N)Br 62a_100009815748_100011218427 [0,1,0,0,0,0|1,1,1]=4 1494 B15R1.8435 CC(O)CSc1cc(ccc1C(=O)N)F 62a_100000206404_100011218427 [0,1,0,0,0,0|1,1,1]=4 1495 B15R1.8435 CC(O)CSc1cc(ccc1C(=O)N)F 62a_100011218427_100000206404 [0,1,0,0,0,0|1,1,1]=4 1496 B15R1.8435 C[C@@H](O)CNc1cc(ccc1C(=O)N)Br 7a_100012349972_100009817552 [0,1,0,0,0,0|2,0,1]=4 1497 B15R1.8435 C[C@@H](O)CNc1cc(ccc1C(=O)N)Cl 34a_100000738103_100009817552 [0,1,0,0,0,0|2,0,1]=4 1498 B15R1.8435 C[C@@H](O)CNc1cc(ccc1C(=O)N)Cl 7a_100000738103_100009817552 [0,1,0,0,0,0|2,0,1]=4 1499 B15R1.8435 C[C@@H](O)CNc1cc(ccc1C(=O)N)F 34a_100011298637_100009817552 [0,1,0,0,0,0|2,0,1]=4 1500 B15R1.8435 C[C@@H](O)COc1cc(ccc1C(=O)N)Br 34a_100011550861_100009817552 [0,1,0,0,0,0|1,0,1]=3 1501 B15R1.8435 C[C@@H](O)COc1cc(ccc1C(=O)N)Br 7a_100011550861_100009817552 [0,1,0,0,0,0|1,0,1]=3 1502 B15R1.8435 C[C@@H](O)COc1cc(ccc1C(=O)N)Cl 34a_100000192836_100009817552 [0,1,0,0,0,0|1,0,1]=3 1503 B15R1.8435 C[C@@H](O)COc1cc(ccc1C(=O)N)Cl 7a_100000192836_100009817552 [0,1,0,0,0,0|1,0,1]=3 1504 B15R1.8435 C[C@@H](O)COc1cc(ccc1C(=O)N)N 34a_100000223280_100009817552 [0,1,0,0,0,0|1,0,1]=3 1505 B15R1.8435 C[C@@H](O)COc1cc(ccc1C(=O)N)N 7a_100000223280_100009817552 [0,1,0,0,0,0|1,0,1]=3 1506 B15R1.8435 C[C@@H](O)CSc1cc(ccc1C(=O)N)Br 62a_100009815748_100009817552 [0,1,0,0,0,0|1,1,1]=4 1507 B15R1.8435 C[C@@H](O)CSc1cc(ccc1C(=O)N)F 62a_100000206404_100009817552 [0,1,0,0,0,0|1,1,1]=4 1508 B15R1.8435 C[C@@H](O)CSc1cc(ccc1C(=O)N)F 62a_100009817552_100000206404 [0,1,0,0,0,0|1,1,1]=4 1509 B15R1.8435 Cc1ccc(c(c1)NCC(=O)N)C(=O)N 34a_100011219537_100000187820 [0,1,0,0,0,0|2,0,0]=3 1510 B15R1.8435 Cc1ccc(c(c1)NCC(=O)N)C(=O)N 7a_100011219537_100000187820 [0,1,0,0,0,0|2,0,0]=3 1511 B15R1.8435 Cc1ccc(c(c1)NCC(=O)[O-])C(=O)N 34a_100011219537_100020667443 [0,1,0,0,0,0|1,0,1]=3 1512 B15R1.8435 Cc1ccc(c(c1)NCC(C)O)C(=O)N 34a_100011219537_100011218427 [0,1,0,0,0,0|2,0,1]=4 1513 B15R1.8435 Cc1ccc(c(c1)NCC(C)O)C(=O)N 7a_100011219537_100011218427 [0,1,0,0,0,0|2,0,1]=4 1514 B15R1.8435 Cc1ccc(c(c1)NC[C@@H](C)O)C(=O)N 34a_100011219537_100009817552 [0,1,0,0,0,0|2,0,1]=4 1515 B15R1.8435 Cc1ccc(c(c1)NC[C@@H](C)O)C(=O)N 7a_100011219537_100009817552 [0,1,0,0,0,0|2,0,1]=4 1516 B15R1.8435 Cc1ccc(c(c1)NC[N+](=O)[O-])C(=O)N 34a_100011219537_100000761209 [0,1,0,0,0,0|2,0,1]=4 1517 B15R1.8435 Cc1ccc(c(c1)OCC(=O)N)C(=O)N 34a_100000192831_100000187820 [0,1,0,0,0,0|1,0,0]=2 1518 B15R1.8435 Cc1ccc(c(c1)OCC(=O)N)C(=O)N 7a_100000192831_100000187820 [0,1,0,0,0,0|1,0,0]=2 1519 B15R1.8435 Cc1ccc(c(c1)OCC(=O)N)[N+](=O)[O-] 34a_100000195450_100000187820 [0,1,0,0,0,0|3,0,0]=4 1520 B15R1.8435 Cc1ccc(c(c1)OCC(=O)N)[N+](=O)[O-] 7a_100000195450_100000187820 [0,1,0,0,0,0|3,0,0]=4 1521 B15R1.8435 Cc1ccc(c(c1)OCC(=O)[O-])C(=O)N 34a_100000192831_100020667443 [0,1,0,0,0,0|0,0,1]=2 1522 B15R1.8435 Cc1ccc(c(c1)OCC(=O)[O-])[N+](=O)[O-] 34a_100000195450_100020667443 [0,1,0,0,0,0|2,0,1]=4 1523 B15R1.8435 Cc1ccc(c(c1)OCC(C)C)C(=O)N 34a_100000192831_100000210624 [0,1,0,0,0,0|2,0,1]=4 1524 B15R1.8435 Cc1ccc(c(c1)OCC(C)C)C(=O)N 7a_100000192831_100000210760 [0,1,0,0,0,0|2,0,1]=4 1525 B15R1.8435 Cc1ccc(c(c1)OCC(C)O)C(=O)N 34a_100000192831_100011218427 [0,1,0,0,0,0|1,0,1]=3 1526 B15R1.8435 Cc1ccc(c(c1)OCC(C)O)C(=O)N 7a_100000192831_100011218427 [0,1,0,0,0,0|1,0,1]=3 1527 B15R1.8435 Cc1ccc(c(c1)OCC(F)F)C(=O)N 34a_100000192831_100011934356 [0,1,0,0,0,0|2,0,1]=4 1528 B15R1.8435 Cc1ccc(c(c1)OCC(F)F)C(=O)N 7a_100000192831_100011934356 [0,1,0,0,0,0|2,0,1]=4 1529 B15R1.8435 Cc1ccc(c(c1)OC[C@@H](C)O)C(=O)N 34a_100000192831_100009817552 [0,1,0,0,0,0|1,0,1]=3 1530 B15R1.8435 Cc1ccc(c(c1)OC[C@@H](C)O)C(=O)N 7a_100000192831_100009817552 [0,1,0,0,0,0|1,0,1]=3 1531 B15R1.8435 Cc1ccc(c(c1)OC[N+](=O)[O-])C(=O)N 34a_100000192831_100000761209 [0,1,0,0,0,0|1,0,1]=3 1532 B15R1.8435 Cc1ccc(c(n1)SCC(=O)N)C(=O)N 62a_100000041523_100000747473 [0,1,0,0,0,0|2,1,0]=4 1533 B15R1.8435 Cc1ccc(c(n1)SCC(=O)N)C(=O)N 62a_100000747473_100000041523 [0,1,0,0,0,0|2,1,0]=4 1534 B15R1.8435 Cc1ccc(c(n1)SCC(=O)[O-])C(=O)N 62a_100000041523_100020667443 [0,1,0,0,0,0|1,1,1]=4 1535 B15R1.8435 Cc1ccc(c(n1)SCC(=O)[O-])C(=O)N 62a_100020667443_100000041523 [0,1,0,0,0,0|1,1,1]=4 1536 B15R1.8435 NC(=O)CNc1cc(ccc1C(=O)N)Br 7a_100012349972_100000187820 [0,1,0,0,0,0|2,0,0]=3 1537 B15R1.8435 NC(=O)CNc1cc(ccc1C(=O)N)Cl 34a_100000738103_100000187820 [0,1,0,0,0,0|2,0,0]=3 1538 B15R1.8435 NC(=O)CNc1cc(ccc1C(=O)N)Cl 7a_100000738103_100000187820 [0,1,0,0,0,0|2,0,0]=3 1539 B15R1.8435 NC(=O)CNc1cc(ccc1C(=O)N)F 34a_100011298637_100000187820 [0,1,0,0,0,0|2,0,0]=3 1540 B15R1.8435 NC(=O)COc1cc(ccc1C(=O)N)Br 34a_100011550861_100000187820 [0,1,0,0,0,0|1,0,0]=2 1541 B15R1.8435 NC(=O)COc1cc(ccc1C(=O)N)Br 7a_100011550861_100000187820 [0,1,0,0,0,0|1,0,0]=2 1542 B15R1.8435 NC(=O)COc1cc(ccc1C(=O)N)Cl 34a_100000192836_100000187820 [0,1,0,0,0,0|1,0,0]=2 1543 B15R1.8435 NC(=O)COc1cc(ccc1C(=O)N)Cl 7a_100000192836_100000187820 [0,1,0,0,0,0|1,0,0]=2 1544 B15R1.8435 NC(=O)COc1cc(ccc1C(=O)N)N 34a_100000223280_100000187820 [0,1,0,0,0,0|1,0,0]=2 1545 B15R1.8435 NC(=O)COc1cc(ccc1C(=O)N)N 7a_100000223280_100000187820 [0,1,0,0,0,0|1,0,0]=2 1546 B15R1.8435 NC(=O)COc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100000187820 [0,1,0,0,0,0|3,0,0]=4 1547 B15R1.8435 NC(=O)COc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100000187820 [0,1,0,0,0,0|3,0,0]=4 1548 B15R1.8435 NC(=O)COc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100000187820 [0,1,0,0,0,0|3,0,0]=4 1549 B15R1.8435 NC(=O)COc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100000187820 [0,1,0,0,0,0|3,0,0]=4 1550 B15R1.8435 NC(=O)COc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100000187820 [0,1,0,0,0,0|3,0,0]=4 1551 B15R1.8435 NC(=O)COc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100000187820 [0,1,0,0,0,0|3,0,0]=4 1552 B15R1.8435 NC(=O)CSc1cc(ccc1C(=O)N)Br 62a_100009815748_100000747473 [0,1,0,0,0,0|1,1,0]=3 1553 B15R1.8435 NC(=O)CSc1cc(ccc1C(=O)N)F 62a_100000206404_100000747473 [0,1,0,0,0,0|1,1,0]=3 1554 B15R1.8435 NC(=O)CSc1cc(ccc1C(=O)N)F 62a_100000747473_100000206404 [0,1,0,0,0,0|1,1,0]=3 1555 B15R1.8435 NC(=O)c1ccc(cc1NCC(=O)[O-])Cl 34a_100000738103_100020667443 [0,1,0,0,0,0|1,0,1]=3 1556 B15R1.8435 NC(=O)c1ccc(cc1NCC(=O)[O-])F 34a_100011298637_100020667443 [0,1,0,0,0,0|1,0,1]=3 1557 B15R1.8435 NC(=O)c1ccc(cc1NC[N+](=O)[O-])Cl 34a_100000738103_100000761209 [0,1,0,0,0,0|2,0,1]=4 1558 B15R1.8435 NC(=O)c1ccc(cc1NC[N+](=O)[O-])F 34a_100011298637_100000761209 [0,1,0,0,0,0|2,0,1]=4 1559 B15R1.8435 NC(=O)c1ccc(cc1OCC(=O)[O-])Br 34a_100011550861_100020667443 [0,1,0,0,0,0|0,0,1]=2 1560 B15R1.8435 NC(=O)c1ccc(cc1OCC(=O)[O-])Cl 34a_100000192836_100020667443 [0,1,0,0,0,0|0,0,1]=2 1561 B15R1.8435 NC(=O)c1ccc(cc1OCC(=O)[O-])N 34a_100000223280_100020667443 [0,1,0,0,0,0|0,0,1]=2 1562 B15R1.8435 NC(=O)c1ccc(cc1OCC(F)F)Br 34a_100011550861_100011934356 [0,1,0,0,0,0|2,0,1]=4 1563 B15R1.8435 NC(=O)c1ccc(cc1OCC(F)F)Br 7a_100011550861_100011934356 [0,1,0,0,0,0|2,0,1]=4 1564 B15R1.8435 NC(=O)c1ccc(cc1OCC(F)F)Cl 34a_100000192836_100011934356 [0,1,0,0,0,0|2,0,1]=4 1565 B15R1.8435 NC(=O)c1ccc(cc1OCC(F)F)Cl 7a_100000192836_100011934356 [0,1,0,0,0,0|2,0,1]=4 1566 B15R1.8435 NC(=O)c1ccc(cc1OCC(F)F)N 34a_100000223280_100011934356 [0,1,0,0,0,0|2,0,1]=4 1567 B15R1.8435 NC(=O)c1ccc(cc1OCC(F)F)N 7a_100000223280_100011934356 [0,1,0,0,0,0|2,0,1]=4 1568 B15R1.8435 NC(=O)c1ccc(cc1OC[N+](=O)[O-])Br 34a_100011550861_100000761209 [0,1,0,0,0,0|1,0,1]=3 1569 B15R1.8435 NC(=O)c1ccc(cc1OC[N+](=O)[O-])Cl 34a_100000192836_100000761209 [0,1,0,0,0,0|1,0,1]=3 1570 B15R1.8435 NC(=O)c1ccc(cc1OC[N+](=O)[O-])N 34a_100000223280_100000761209 [0,1,0,0,0,0|1,0,1]=3 1571 B15R1.8435 NC(=O)c1ccc(cc1SCC(=O)[O-])Br 62a_100009815748_100020667443 [0,1,0,0,0,0|0,1,1]=3 1572 B15R1.8435 NC(=O)c1ccc(cc1SCC(=O)[O-])F 62a_100000206404_100020667443 [0,1,0,0,0,0|0,1,1]=3 1573 B15R1.8435 NC(=O)c1ccc(cc1SCC(=O)[O-])F 62a_100020667443_100000206404 [0,1,0,0,0,0|0,1,1]=3 1574 B15R1.8435 NC(=O)c1ccc(cc1SC[N+](=O)[O-])Br 62a_100009815748_100000761209 [0,1,0,0,0,0|1,1,1]=4 1575 B15R1.8435 NC(=O)c1ccc(cc1SC[N+](=O)[O-])F 62a_100000206404_100000761209 [0,1,0,0,0,0|1,1,1]=4 1576 B15R1.8435 O=C([O-])COc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100020667443 [0,1,0,0,0,0|2,0,1]=4 1577 B15R1.8435 O=C([O-])COc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100020667443 [0,1,0,0,0,0|2,0,1]=4 1578 B15R1.8875 C=C(C)c1ccccc1OC(C)C(=O)N 271570a_100000694244_100000148488 [0,1,0,0,0,0|3,0,0]=4 1579 B15R1.8875 CC(=O)C(C)Oc1ccccc1C(=O)N 7a_100000192804_100000179758 [0,1,0,0,0,0|1,0,0]=2 1580 B15R1.8875 CC(=O)C(C)Oc1ccccc1C(=O)[O-] 7a_100015234032_100000179758 [0,1,0,0,0,0|2,0,0]=3 1581 B15R1.8875 CC(=O)C(C)Oc1ccccc1C(=S)N 7a_100000745089_100000179758 [0,1,0,0,0,0|1,1,0]=3 1582 B15R1.8875 CC(=O)C(C)Oc1ccccc1[N+](=O)[O-] 7a_100000186319_100000179758 [0,1,0,0,0,0|3,0,0]=4 1583 B15R1.8875 CC(=O)C(C)Oc1cccnc1C(=O)N 7a_200011215183_100000179758 [0,1,0,0,0,0|2,0,0]=3 1584 B15R1.8875 CC(=O)C(C)Oc1cnccc1C(=O)N 7a_100012022987_100000179758 [0,1,0,0,0,0|2,0,0]=3 1585 B15R1.8875 CC(=O)C(C)Sc1ccccc1C(=O)N 62a_100000162227_100009814033 [0,1,0,0,0,0|1,1,0]=3 1586 B15R1.8875 CC(=O)C(C)Sc1ccccc1C(=O)N 62a_100009814033_100000162227 [0,1,0,0,0,0|1,1,0]=3 1587 B15R1.8875 CC(=O)C(C)Sc1ccccc1C(=O)O 62a_100009814033_100000734275 [0,1,0,0,0,0|2,1,0]=4 1588 B15R1.8875 CC(=O)C(C)Sc1ccccc1C(=O)O 62a_202125556159_100009814033 [0,1,0,0,0,0|2,1,0]=4 1589 B15R1.8875 CC(=O)C(C)Sc1cccnc1C(=O)N 62a_100009814033_200012359670 [0,1,0,0,0,0|2,1,0]=4 1590 B15R1.8875 CC(=O)C(C)Sc1cccnc1C(=O)N 62a_200012359670_100009814033 [0,1,0,0,0,0|2,1,0]=4 1591 B15R1.8875 CC(=O)C(C)Sc1ccncc1C(=O)N 62a_100000697804_100009814033 [0,1,0,0,0,0|2,1,0]=4 1592 B15R1.8875 CC(=O)C(C)Sc1ccncc1C(=O)N 62a_100009814033_100000697804 [0,1,0,0,0,0|2,1,0]=4 1593 B15R1.8875 CC(=O)C(C)Sc1cnccc1C(=O)N 62a_100009814033_100010205435 [0,1,0,0,0,0|2,1,0]=4 1594 B15R1.8875 CC(=O)C(C)Sc1cnccc1C(=O)N 62a_100010205435_100009814033 [0,1,0,0,0,0|2,1,0]=4 1595 B15R1.8875 CC(=O)C(C)Sc1ncccc1C(=O)N 62a_100000162199_100009814033 [0,1,0,0,0,0|2,1,0]=4 1596 B15R1.8875 CC(=O)C(C)Sc1ncccc1C(=O)N 62a_100009814033_100000162199 [0,1,0,0,0,0|2,1,0]=4 1597 B15R1.8875 CC(=O)c1ccccc1SC(C)C(=O)C 62a_100000751169_100009814033 [0,1,0,0,0,0|2,1,0]=4 1598 B15R1.8875 CC(=O)c1ccccc1SC(C)C(=O)N 62a_100000751169_100000702099 [0,1,0,0,0,0|2,1,0]=4 1599 B15R1.8875 CC(=O)c1ccccc1SC(F)C(=O)N 62a_100000751169_100009813875 [0,1,0,0,0,0|2,1,0]=4 1600 B15R1.8875 CC(=O)c1ccccc1SC(F)C(=O)[O-] 62a_100000751169_100020610796 [0,1,0,0,0,0|1,1,1]=4 1601 B15R1.8875 CC(=O)c1ccncc1OC(C)C(=O)C 7a_100009872882_100000179758 [0,1,0,0,0,0|3,0,0]=4 1602 B15R1.8875 CC(=O)c1ccncc1OC(C)C(=O)N 7a_100009872882_100000702099 [0,1,0,0,0,0|3,0,0]=4 1603 B15R1.8875 CC(=O)c1ccncc1OC(F)C(=O)N 7a_100009872882_100009813875 [0,1,0,0,0,0|3,0,0]=4 1604 B15R1.8875 CC(=O)c1ncccc1OC(C)C(=O)C 7a_100000087166_100000179758 [0,1,0,0,0,0|3,0,0]=4 1605 B15R1.8875 CC(=O)c1ncccc1OC(C)C(=O)N 34a_100000087166_100000702099 [0,1,0,0,0,0|3,0,0]=4 1606 B15R1.8875 CC(=O)c1ncccc1OC(C)C(=O)N 7a_100000087166_100000702099 [0,1,0,0,0,0|3,0,0]=4 1607 B15R1.8875 CC(=O)c1ncccc1OC(F)C(=O)N 34a_100000087166_100009813875 [0,1,0,0,0,0|3,0,0]=4 1608 B15R1.8875 CC(=O)c1ncccc1OC(F)C(=O)N 7a_100000087166_100009813875 [0,1,0,0,0,0|3,0,0]=4 1609 B15R1.8875 CC(=O)c1ncccc1OC(F)C(=O)[O-] 34a_100000087166_100020610796 [0,1,0,0,0,0|2,0,1]=4 1610 B15R1.8875 CC(Nc1ccccc1C(=O)N)C(=O)N 34a_100000185089_100000702099 [0,1,0,0,0,0|2,0,0]=3 1611 B15R1.8875 CC(Oc1ccccc1C(=O)N)C(=O)N 34a_100000192804_100000702099 [0,1,0,0,0,0|1,0,0]=2 1612 B15R1.8875 CC(Oc1ccccc1C(=O)N)C(=O)N 7a_100000192804_100000702099 [0,1,0,0,0,0|1,0,0]=2 1613 B15R1.8875 CC(Oc1ccccc1C(=O)[O-])C(=O)N 7a_100015234032_100000702099 [0,1,0,0,0,0|2,0,0]=3 1614 B15R1.8875 CC(Oc1ccccc1C(=S)N)C(=O)N 7a_100000745089_100000702099 [0,1,0,0,0,0|1,1,0]=3 1615 B15R1.8875 CC(Oc1ccccc1[C@@H](C)N)C(=O)N 34a_100025703389_100000702099 [0,1,0,0,0,0|2,0,1]=4 1616 B15R1.8875 CC(Oc1ccccc1[N+](=O)[O-])C(=O)N 34a_100000186319_100000702099 [0,1,0,0,0,0|3,0,0]=4 1617 B15R1.8875 CC(Oc1ccccc1[N+](=O)[O-])C(=O)N 7a_100000186319_100000702099 [0,1,0,0,0,0|3,0,0]=4 1618 B15R1.8875 CC(Oc1cccnc1C(=O)N)C(=O)N 34a_200011215183_100000702099 [0,1,0,0,0,0|2,0,0]=3 1619 B15R1.8875 CC(Oc1cccnc1C(=O)N)C(=O)N 7a_200011215183_100000702099 [0,1,0,0,0,0|2,0,0]=3 1620 B15R1.8875 CC(Oc1ccncc1C(=O)N)C(=O)N 34a_200011998761_100000702099 [0,1,0,0,0,0|2,0,0]=3 1621 B15R1.8875 CC(Oc1cnccc1C(=O)N)C(=O)N 7a_100012022987_100000702099 [0,1,0,0,0,0|2,0,0]=3 1622 B15R1.8875 CC(Oc1nccnc1C(=O)N)C(=O)N 34a_100011830332_100000702099 [0,1,0,0,0,0|3,0,0]=4 1623 B15R1.8875 CC(Sc1ccccc1C(=O)N)C(=O)N 62a_100000162227_100000702099 [0,1,0,0,0,0|1,1,0]=3 1624 B15R1.8875 CC(Sc1ccccc1C(=O)N)C(=O)N 62a_100000702099_100000162227 [0,1,0,0,0,0|1,1,0]=3 1625 B15R1.8875 CC(Sc1ccccc1C(=O)O)C(=O)N 62a_100000702099_100000734275 [0,1,0,0,0,0|2,1,0]=4 1626 B15R1.8875 CC(Sc1ccccc1C(=O)O)C(=O)N 62a_202125556159_100000702099 [0,1,0,0,0,0|2,1,0]=4 1627 B15R1.8875 CC(Sc1cccnc1C(=O)N)C(=O)N 62a_100000702099_200012359670 [0,1,0,0,0,0|2,1,0]=4 1628 B15R1.8875 CC(Sc1cccnc1C(=O)N)C(=O)N 62a_200012359670_100000702099 [0,1,0,0,0,0|2,1,0]=4 1629 B15R1.8875 CC(Sc1ccncc1C(=O)N)C(=O)N 62a_100000697804_100000702099 [0,1,0,0,0,0|2,1,0]=4 1630 B15R1.8875 CC(Sc1ccncc1C(=O)N)C(=O)N 62a_100000702099_100000697804 [0,1,0,0,0,0|2,1,0]=4 1631 B15R1.8875 CC(Sc1cnccc1C(=O)N)C(=O)N 62a_100000702099_100010205435 [0,1,0,0,0,0|2,1,0]=4 1632 B15R1.8875 CC(Sc1cnccc1C(=O)N)C(=O)N 62a_100010205435_100000702099 [0,1,0,0,0,0|2,1,0]=4 1633 B15R1.8875 CC(Sc1ncccc1C(=O)N)C(=O)N 62a_100000162199_100000702099 [0,1,0,0,0,0|2,1,0]=4 1634 B15R1.8875 CC(Sc1ncccc1C(=O)N)C(=O)N 62a_100000702099_100000162199 [0,1,0,0,0,0|2,1,0]=4 1635 B15R1.8875 C[C@@H](N)c1ccccc1OC(F)C(=O)N 34a_100025703389_100009813875 [0,1,0,0,0,0|2,0,1]=4 1636 B15R1.8875 C[C@@H](N)c1ccccc1OC(F)C(=O)[O-] 34a_100025703389_100020610796 [0,1,0,0,0,0|1,0,2]=4 1637 B15R1.8875 C[C@@H](Nc1cccnc1C(=O)N)C(=O)N 27a_100000119354_200012359670 [0,1,0,0,0,0|3,0,0]=4 1638 B15R1.8875 C[C@@H](Nc1ccncc1C(=O)N)C(=O)N 27a_100000119354_100000697804 [0,1,0,0,0,0|3,0,0]=4 1639 B15R1.8875 C[C@@H](Nc1ncccc1C(=O)N)C(=O)N 27a_100000119354_100000162199 [0,1,0,0,0,0|3,0,0]=4 1640 B15R1.8875 NC(=O)C(=O)Nc1ccccc1C(=O)N 22a_100000185089_100011215815 [0,1,0,0,0,0|2,0,1]=4 1641 B15R1.8875 NC(=O)C(F)Oc1ccccc1C(=O)[O-] 7a_100015234032_100009813875 [0,1,0,0,0,0|2,0,0]=3 1642 B15R1.8875 NC(=O)C(F)Oc1ccccc1C(=S)N 7a_100000745089_100009813875 [0,1,0,0,0,0|1,1,0]=3 1643 B15R1.8875 NC(=O)C(F)Oc1ccccc1[N+](=O)[O-] 34a_100000186319_100009813875 [0,1,0,0,0,0|3,0,0]=4 1644 B15R1.8875 NC(=O)C(F)Oc1ccccc1[N+](=O)[O-] 7a_100000186319_100009813875 [0,1,0,0,0,0|3,0,0]=4 1645 B15R1.8875 NC(=O)C(F)Sc1ccccc1C(=O)O 62a_100009813875_100000734275 [0,1,0,0,0,0|2,1,0]=4 1646 B15R1.8875 NC(=O)C(F)Sc1ccccc1C(=O)O 62a_202125556159_100009813875 [0,1,0,0,0,0|2,1,0]=4 1647 B15R1.8875 NC(=O)c1ccccc1NC(F)C(=O)N 34a_100000185089_100009813875 [0,1,0,0,0,0|2,0,0]=3 1648 B15R1.8875 NC(=O)c1ccccc1NC(F)C(=O)[O-] 34a_100000185089_100020610796 [0,1,0,0,0,0|1,0,1]=3 1649 B15R1.8875 NC(=O)c1ccccc1OC(F)C(=O)N 34a_100000192804_100009813875 [0,1,0,0,0,0|1,0,0]=2 1650 B15R1.8875 NC(=O)c1ccccc1OC(F)C(=O)N 7a_100000192804_100009813875 [0,1,0,0,0,0|1,0,0]=2 1651 B15R1.8875 NC(=O)c1ccccc1OC(F)C(=O)[O-] 34a_100000192804_100020610796 [0,1,0,0,0,0|0,0,1]=2 1652 B15R1.8875 NC(=O)c1ccccc1SC(F)C(=O)N 62a_100000162227_100009813875 [0,1,0,0,0,0|1,1,0]=3 1653 B15R1.8875 NC(=O)c1ccccc1SC(F)C(=O)N 62a_100009813875_100000162227 [0,1,0,0,0,0|1,1,0]=3 1654 B15R1.8875 NC(=O)c1ccccc1SC(F)C(=O)[O-] 62a_100000162227_100020610796 [0,1,0,0,0,0|0,1,1]=3 1655 B15R1.8875 NC(=O)c1ccccc1SC(F)C(=O)[O-] 62a_100020610796_100000162227 [0,1,0,0,0,0|0,1,1]=3 1656 B15R1.8875 NC(=O)c1cccnc1SC(F)C(=O)N 62a_100000162199_100009813875 [0,1,0,0,0,0|2,1,0]=4 1657 B15R1.8875 NC(=O)c1cccnc1SC(F)C(=O)N 62a_100009813875_100000162199 [0,1,0,0,0,0|2,1,0]=4 1658 B15R1.8875 NC(=O)c1cccnc1SC(F)C(=O)[O-] 62a_100000162199_100020610796 [0,1,0,0,0,0|1,1,1]=4 1659 B15R1.8875 NC(=O)c1cccnc1SC(F)C(=O)[O-] 62a_100020610796_100000162199 [0,1,0,0,0,0|1,1,1]=4 1660 B15R1.8875 NC(=O)c1ccncc1OC(F)C(=O)N 7a_100012022987_100009813875 [0,1,0,0,0,0|2,0,0]=3 1661 B15R1.8875 NC(=O)c1ccncc1SC(F)C(=O)N 62a_100009813875_100010205435 [0,1,0,0,0,0|2,1,0]=4 1662 B15R1.8875 NC(=O)c1ccncc1SC(F)C(=O)N 62a_100010205435_100009813875 [0,1,0,0,0,0|2,1,0]=4 1663 B15R1.8875 NC(=O)c1ccncc1SC(F)C(=O)[O-] 62a_100010205435_100020610796 [0,1,0,0,0,0|1,1,1]=4 1664 B15R1.8875 NC(=O)c1ccncc1SC(F)C(=O)[O-] 62a_100020610796_100010205435 [0,1,0,0,0,0|1,1,1]=4 1665 B15R1.8875 NC(=O)c1cnccc1OC(F)C(=O)N 34a_200011998761_100009813875 [0,1,0,0,0,0|2,0,0]=3 1666 B15R1.8875 NC(=O)c1cnccc1OC(F)C(=O)[O-] 34a_200011998761_100020610796 [0,1,0,0,0,0|1,0,1]=3 1667 B15R1.8875 NC(=O)c1cnccc1SC(F)C(=O)N 62a_100000697804_100009813875 [0,1,0,0,0,0|2,1,0]=4 1668 B15R1.8875 NC(=O)c1cnccc1SC(F)C(=O)N 62a_100009813875_100000697804 [0,1,0,0,0,0|2,1,0]=4 1669 B15R1.8875 NC(=O)c1cnccc1SC(F)C(=O)[O-] 62a_100000697804_100020610796 [0,1,0,0,0,0|1,1,1]=4 1670 B15R1.8875 NC(=O)c1cnccc1SC(F)C(=O)[O-] 62a_100020610796_100000697804 [0,1,0,0,0,0|1,1,1]=4 1671 B15R1.8875 NC(=O)c1ncccc1OC(F)C(=O)N 34a_200011215183_100009813875 [0,1,0,0,0,0|2,0,0]=3 1672 B15R1.8875 NC(=O)c1ncccc1OC(F)C(=O)N 7a_200011215183_100009813875 [0,1,0,0,0,0|2,0,0]=3 1673 B15R1.8875 NC(=O)c1ncccc1OC(F)C(=O)[O-] 34a_200011215183_100020610796 [0,1,0,0,0,0|1,0,1]=3 1674 B15R1.8875 NC(=O)c1ncccc1SC(F)C(=O)N 62a_100009813875_200012359670 [0,1,0,0,0,0|2,1,0]=4 1675 B15R1.8875 NC(=O)c1ncccc1SC(F)C(=O)N 62a_200012359670_100009813875 [0,1,0,0,0,0|2,1,0]=4 1676 B15R1.8875 NC(=O)c1ncccc1SC(F)C(=O)[O-] 62a_100020610796_200012359670 [0,1,0,0,0,0|1,1,1]=4 1677 B15R1.8875 NC(=O)c1ncccc1SC(F)C(=O)[O-] 62a_200012359670_100020610796 [0,1,0,0,0,0|1,1,1]=4 1678 B15R1.8875 NC(=O)c1nccnc1OC(F)C(=O)N 34a_100011830332_100009813875 [0,1,0,0,0,0|3,0,0]=4 1679 B15R1.8875 NC(=O)c1nccnc1OC(F)C(=O)[O-] 34a_100011830332_100020610796 [0,1,0,0,0,0|2,0,1]=4 1680 B15R1.8875 O=C(O)c1ccccc1SC(F)C(=O)[O-] 62a_100020610796_100000734275 [0,1,0,0,0,0|1,1,1]=4 1681 B15R1.8875 O=C(O)c1ccccc1SC(F)C(=O)[O-] 62a_202125556159_100020610796 [0,1,0,0,0,0|1,1,1]=4 1682 B15R1.8875 O=C([O-])C(F)Oc1ccccc1[N+](=O)[O-] 34a_100000186319_100020610796 [0,1,0,0,0,0|2,0,1]=4 1683 B15R2.384 C=C(C)c1cccc2c1CCC(=O)O2 271570a_100000694244_200015620928 [0,0,0,1,0,0|3,0,0]=4 1684 B15R2.384 C=C(C)c1cccc2c1OCC(=O)N2 271570a_100000694244_100012355675 [0,0,0,1,0,0|3,0,0]=4 1685 B15R2.384 CC(=O)c1cccc2c1OCC(=O)N2 1458a_100000060354_200000210301 [0,0,0,1,0,0|2,0,0]=3 1686 B15R2.384 [13CH3]C(=O)c1cccc2c1OCC(=O)N2 1458a_100000060354_200025704644 [0,0,0,1,0,0|2,0,0]=3 1687 B15R2.16319 NC(=O)c1ccccc1NCC2CO2 34a_100000185089_102125554688 [0,0,0,1,0,0|2,0,1]=4 1688 B15R2.16319 NC(=O)c1ccccc1OCC2CC2 34a_100000192804_100000742324 [0,0,0,1,0,0|2,0,1]=4 1689 B15R2.16319 NC(=O)c1ccccc1OCC2CC2 7a_100000192804_100000742324 [0,0,0,1,0,0|2,0,1]=4 1690 B15R2.16319 NC(=O)c1ccccc1OCC2CO2 34a_100000192804_102125554688 [0,0,0,1,0,0|1,0,1]=3 1691 B15R2.16319 NC(=O)c1ccccc1OCC2CO2 7a_100000192804_102125554688 [0,0,0,1,0,0|1,0,1]=3 1692 B15R2.16319 NC(=O)c1ccccc1OCC2CS2 7a_100000192804_100000031435 [0,0,0,1,0,0|1,1,1]=4 1693 B15R2.16319 NC(=O)c1ccccc1OC[C@@H]2CO2 7a_100000192804_100000745022 [0,0,0,1,0,0|1,0,1]=3 1694 B15R2.16319 NC(=O)c1ccccc1SCC2CO2 62a_100000162227_102125554688 [0,0,0,1,0,0|1,1,1]=4 1695 B15R2.16319 NC(=O)c1ccccc1SCC2CO2 62a_102125554688_100000162227 [0,0,0,1,0,0|1,1,1]=4 1696 B15R2.16319 NC(=O)c1ccccc1SC[C@@H]2CO2 62a_100000162227_100000745022 [0,0,0,1,0,0|1,1,1]=4 1697 B15R2.16319 NC(=O)c1ccccc1SC[C@@H]2CO2 62a_100000745022_100000162227 [0,0,0,1,0,0|1,1,1]=4 1698 B15R2.16319 NC(=O)c1ccncc1OCC2CO2 7a_100012022987_102125554688 [0,0,0,1,0,0|2,0,1]=4 1699 B15R2.16319 NC(=O)c1ccncc1OC[C@@H]2CO2 7a_100012022987_100000745022 [0,0,0,1,0,0|2,0,1]=4 1700 B15R2.16319 NC(=O)c1cnccc1OCC2CO2 34a_200011998761_102125554688 [0,0,0,1,0,0|2,0,1]=4 1701 B15R2.16319 NC(=O)c1ncccc1OCC2CO2 34a_200011215183_102125554688 [0,0,0,1,0,0|2,0,1]=4 1702 B15R2.16319 NC(=O)c1ncccc1OCC2CO2 7a_200011215183_102125554688 [0,0,0,1,0,0|2,0,1]=4 1703 B15R2.16319 NC(=O)c1ncccc1OC[C@@H]2CO2 7a_200011215183_100000745022 [0,0,0,1,0,0|2,0,1]=4 1704 B15R2.16319 NC(=S)c1ccccc1OCC2CO2 7a_100000745089_102125554688 [0,0,0,1,0,0|1,1,1]=4 1705 B15R2.16319 NC(=S)c1ccccc1OC[C@@H]2CO2 7a_100000745089_100000745022 [0,0,0,1,0,0|1,1,1]=4 1706 B15R2.16319 O=C([O-])c1ccccc1OCC2CO2 7a_100015234032_102125554688 [0,0,0,1,0,0|2,0,1]=4 1707 B15R2.16319 O=C([O-])c1ccccc1OC[C@@H]2CO2 7a_100015234032_100000745022 [0,0,0,1,0,0|2,0,1]=4 1708 B15R2.53147 CC(=O)CC1NC(=O)c2c1cccc2 1458a_100000066322_200000210301 [0,0,0,1,0,0|2,0,0]=3 1709 B15R2.53147 CC(=O)CC1OC(=O)c2c1cccc2 1458a_100000185305_200000210301 [0,0,0,1,0,0|3,0,0]=4 1710 B15R2.53147 CC(=O)NC1NC(=O)c2c1cccc2 1626a_100016086272_100015343762 [0,0,0,1,0,0|3,0,0]=4 1711 B15R2.53147 CC(=O)NC1NC(=O)c2c1cccc2 240690a_100016086272_100015343762 [0,0,0,1,0,0|3,0,0]=4 1712 B15R2.53147 CC(=O)NC1NC(=O)c2c1cccc2 527a_100016086272_100103153847 [0,0,0,1,0,0|3,0,0]=4 1713 B15R2.53147 [13CH3]C(=O)CC1NC(=O)c2c1cccc2 1458a_100000066322_200025704644 [0,0,0,1,0,0|2,0,0]=3 1714 B15R2.53147 [13CH3]C(=O)CC1OC(=O)c2c1cccc2 1458a_100000185305_200025704644 [0,0,0,1,0,0|3,0,0]=4 1715 B13R1.589 C=C(C)c1ccccc1CC(=O)C 271570a_100000694244_100011350739 [0,0,0,0,1,0|3,0,0]=4 1716 B13R1.589 C=C(C)c1ccccc1CC(=O)N 271570a_100000694244_200009814924 [0,0,0,0,1,0|3,0,0]=4 1717 B13R1.589 C=C(C)c1ccccc1OC(=O)C 271570a_100000694244_100000051690 [0,0,0,0,1,0|3,0,0]=4 1718 B13R1.589 CC(=Cc1ccccc1C(=O)N)C 271570a_100102525489_100000162227 [0,0,0,0,1,0|2,0,1]=4 1719 B13R1.589 CC(=O)Cc1ccccc1[N+](=O)[O-] 1458a_100000070787_100000181388 [0,0,0,0,1,0|3,0,0]=4 1720 B13R1.589 CC(=O)Cc1ccccc1[N+](=O)[O-] 1458a_100000188737_200000210301 [0,0,0,0,1,0|3,0,0]=4 1721 B13R1.589 CC(=O)Nc1ccccc1C(=O)N 11a_100000185089_100015343762 [0,0,0,0,1,0|2,0,0]=3 1722 B13R1.589 CC(=O)Nc1ccccc1C(=O)N 1626a_100000185089_100015343762 [0,0,0,0,1,0|2,0,0]=3 1723 B13R1.589 CC(=O)Nc1ccccc1C(=O)N 22a_100000185089_100000070787 [0,0,0,0,1,0|2,0,0]=3 1724 B13R1.589 CC(=O)Nc1ccccc1C(=S)N 1626a_100000206033_100015343762 [0,0,0,0,1,0|2,1,0]=4 1725 B13R1.589 CC(C)Oc1ccccc1C(=O)N 34a_100000192804_100000210206 [0,0,0,0,1,0|2,0,1]=4 1726 B13R1.589 CC(C)Oc1ccccc1C(=O)N 7a_100000192804_100000210206 [0,0,0,0,1,0|2,0,1]=4 1727 B13R1.589 [13CH3]C(=O)Cc1ccccc1[N+](=O)[O-] 1458a_100000188737_200025704644 [0,0,0,0,1,0|3,0,0]=4 1728 B13R1.3576 NC(=O)CSc1cscc1C(=O)N 62a_100000747473_100009817205 [0,0,0,0,1,0|2,1,0]=4 1729 B13R1.3576 NC(=O)CSc1cscc1C(=O)N 62a_100009817205_100000747473 [0,0,0,0,1,0|2,1,0]=4 1730 B13R1.3576 NC(=O)c1cscc1SCC(=O)[O-] 62a_100009817205_100020667443 [0,0,0,0,1,0|1,1,1]=4 1731 B13R1.3576 NC(=O)c1cscc1SCC(=O)[O-] 62a_100020667443_100009817205 [0,0,0,0,1,0|1,1,1]=4 1732 B15R1.5914 C=C(C)COc1ccccc1NC(=O)C 11a_100000243823_100015343762 [0,0,0,0,0,1|3,0,0]=4 1733 B15R1.5914 C=C(C)COc1ccccc1NC(=O)C 1626a_100000243823_100015343762 [0,0,0,0,0,1|3,0,0]=4 1734 B15R1.5914 C=C(C)COc1ccccc1NC(=O)C 22a_100000243823_100000070787 [0,0,0,0,0,1|3,0,0]=4 1735 B15R1.5914 C=C(C)COc1ccccc1NC(=O)C 34a_100000185124_100000748629 [0,0,0,0,0,1|3,0,0]=4 1736 B15R1.5914 C=C(C)COc1ccccc1NC(=O)C 527a_100000243823_100103153847 [0,0,0,0,0,1|3,0,0]=4 1737 B15R1.5914 C=C(C)COc1ccccc1NC(=O)C 7a_100000185124_100000748629 [0,0,0,0,0,1|3,0,0]=4 1738 B15R1.5914 C=C(C)COc1ccccc1NC(=S)N 7a_200000011649_100000748629 [0,0,0,0,0,1|2,1,0]=4 1739 B15R1.5914 C=C(C)CSc1ccccc1CC(=O)N 62a_100000748629_200009814924 [0,0,0,0,0,1|2,1,0]=4 1740 B15R1.5914 C=C(C)CSc1ccccc1CC(=O)N 62a_200009814924_100000211660 [0,0,0,0,0,1|2,1,0]=4 1741 B15R1.5914 C=C(C)CSc1ccccc1NC(=O)N 62a_100000748629_100000742221 [0,0,0,0,0,1|2,1,0]=4 1742 B15R1.5914 C=C(F)COc1ccccc1NC(=O)C 34a_100000185124_100009893438 [0,0,0,0,0,1|3,0,0]=4 1743 B15R1.5914 C=C(F)COc1ccccc1NC(=O)C 7a_100000185124_100000042424 [0,0,0,0,0,1|3,0,0]=4 1744 B15R1.5914 C=C(F)COc1ccccc1NC(=S)N 7a_200000011649_100000042424 [0,0,0,0,0,1|2,1,0]=4 1745 B15R1.5914 C=C(F)CSc1ccccc1CC(=O)N 62a_100000042424_200009814924 [0,0,0,0,0,1|2,1,0]=4 1746 B15R1.5914 C=C(F)CSc1ccccc1CC(=O)N 62a_200009814924_100000042424 [0,0,0,0,0,1|2,1,0]=4 1747 B15R1.5914 C=C(F)CSc1ccccc1NC(=O)N 62a_100000042424_100000742221 [0,0,0,0,0,1|2,1,0]=4 1748 B15R1.5914 CC(=Cc1ccccc1OCC(=O)N)C 271570a_100102525489_200000148491 [0,0,0,0,0,1|3,0,0]=4 1749 B15R1.5914 CC(=O)COc1ccccc1NC(=O)C 1458a_100011204883_200000210301 [0,0,0,0,0,1|2,0,0]=3 1750 B15R1.5914 CC(=O)CSc1ccccc1NC(=O)C 1458a_100000027783_200000210301 [0,0,0,0,0,1|2,1,0]=4 1751 B15R1.5914 CC(=O)Cc1ccccc1SCC(=O)N 62a_100000747473_100011350739 [0,0,0,0,0,1|2,1,0]=4 1752 B15R1.5914 CC(=O)Cc1ccccc1SCC(=O)N 62a_100011350739_100000747473 [0,0,0,0,0,1|2,1,0]=4 1753 B15R1.5914 CC(=O)Cc1ccccc1SCC(=O)[O-] 62a_100011350739_100020667443 [0,0,0,0,0,1|1,1,1]=4 1754 B15R1.5914 CC(=O)Cc1ccccc1SCC(=O)[O-] 62a_100020667443_100011350739 [0,0,0,0,0,1|1,1,1]=4 1755 B15R1.5914 CC(=O)Nc1ccccc1NCC(=O)N 34a_100011193560_100000187820 [0,0,0,0,0,1|3,0,0]=4 1756 B15R1.5914 CC(=O)Nc1ccccc1NCC(=O)[O-] 34a_100011193560_100020667443 [0,0,0,0,0,1|2,0,1]=4 1757 B15R1.5914 CC(=O)Nc1ccccc1OCC(=O)N 34a_100000185124_100000187820 [0,0,0,0,0,1|2,0,0]=3 1758 B15R1.5914 CC(=O)Nc1ccccc1OCC(=O)N 7a_100000185124_100000187820 [0,0,0,0,0,1|2,0,0]=3 1759 B15R1.5914 CC(=O)Nc1ccccc1OCC(=O)[13CH3] 1458a_100011204883_200025704644 [0,0,0,0,0,1|2,0,0]=3 1760 B15R1.5914 CC(=O)Nc1ccccc1OCC(=O)[O-] 34a_100000185124_100020667443 [0,0,0,0,0,1|1,0,1]=3 1761 B15R1.5914 CC(=O)Nc1ccccc1OCC(C)O 34a_100000185124_100011218427 [0,0,0,0,0,1|2,0,1]=4 1762 B15R1.5914 CC(=O)Nc1ccccc1OCC(C)O 7a_100000185124_100011218427 [0,0,0,0,0,1|2,0,1]=4 1763 B15R1.5914 CC(=O)Nc1ccccc1OC[C@@H](C)O 34a_100000185124_100009817552 [0,0,0,0,0,1|2,0,1]=4 1764 B15R1.5914 CC(=O)Nc1ccccc1OC[C@@H](C)O 7a_100000185124_100009817552 [0,0,0,0,0,1|2,0,1]=4 1765 B15R1.5914 CC(=O)Nc1ccccc1OC[N+](=O)[O-] 34a_100000185124_100000761209 [0,0,0,0,0,1|2,0,1]=4 1766 B15R1.5914 CC(=O)Nc1ccccc1SCC(=O)N 11a_100000187061_100015343762 [0,0,0,0,0,1|2,1,0]=4 1767 B15R1.5914 CC(=O)Nc1ccccc1SCC(=O)N 22a_100000187061_100000070787 [0,0,0,0,0,1|2,1,0]=4 1768 B15R1.5914 CC(=O)Nc1ccccc1SCC(=O)N 62a_100000747473_100000153524 [0,0,0,0,0,1|2,1,0]=4 1769 B15R1.5914 CC(=O)Nc1ccccc1SCC(=O)[13CH3] 1458a_100000027783_200025704644 [0,0,0,0,0,1|2,1,0]=4 1770 B15R1.5914 CC(=O)Nc1ccccc1SCC(=O)[O-] 62a_100020667443_100000153524 [0,0,0,0,0,1|1,1,1]=4 1771 B15R1.5914 CC(=O)Nc1ncccc1OCC(=O)N 34a_200000022013_100000187820 [0,0,0,0,0,1|3,0,0]=4 1772 B15R1.5914 CC(=O)Nc1ncccc1OCC(=O)N 7a_200000022013_100000187820 [0,0,0,0,0,1|3,0,0]=4 1773 B15R1.5914 CC(=O)Nc1ncccc1OCC(=O)[O-] 34a_200000022013_100020667443 [0,0,0,0,0,1|2,0,1]=4 1774 B15R1.5914 CC(=O)Oc1ccccc1SCC(=O)N 62a_100000051690_100000747473 [0,0,0,0,0,1|2,1,0]=4 1775 B15R1.5914 CC(=O)Oc1ccccc1SCC(=O)N 62a_100000747473_100000051690 [0,0,0,0,0,1|2,1,0]=4 1776 B15R1.5914 CC(=O)Oc1ccccc1SCC(=O)[O-] 62a_100000051690_100020667443 [0,0,0,0,0,1|1,1,1]=4 1777 B15R1.5914 CC(=O)Oc1ccccc1SCC(=O)[O-] 62a_100020667443_100000051690 [0,0,0,0,0,1|1,1,1]=4 1778 B15R1.5914 CC(O)COc1ccccc1NC(=S)N 7a_200000011649_100011218427 [0,0,0,0,0,1|1,1,1]=4 1779 B15R1.5914 CC(O)CSc1ccccc1CC(=O)N 62a_100011218427_200009814924 [0,0,0,0,0,1|1,1,1]=4 1780 B15R1.5914 CC(O)CSc1ccccc1CC(=O)N 62a_200009814924_100011218427 [0,0,0,0,0,1|1,1,1]=4 1781 B15R1.5914 CC(O)CSc1ccccc1NC(=O)N 62a_100011218427_100000742221 [0,0,0,0,0,1|1,1,1]=4 1782 B15R1.5914 C[C@@H](O)COc1ccccc1NC(=S)N 7a_200000011649_100009817552 [0,0,0,0,0,1|1,1,1]=4 1783 B15R1.5914 C[C@@H](O)CSc1ccccc1CC(=O)N 62a_100009817552_200009814924 [0,0,0,0,0,1|1,1,1]=4 1784 B15R1.5914 C[C@@H](O)CSc1ccccc1CC(=O)N 62a_200009814924_100009817552 [0,0,0,0,0,1|1,1,1]=4 1785 B15R1.5914 C[C@@H](O)CSc1ccccc1NC(=O)N 62a_100009817552_100000742221 [0,0,0,0,0,1|1,1,1]=4 1786 B15R1.5914 NC(=O)COc1ccccc1NC(=S)N 7a_200000011649_100000187820 [0,0,0,0,0,1|1,1,0]=3 1787 B15R1.5914 NC(=O)CSc1ccccc1CC(=O)N 62a_100000747473_200009814924 [0,0,0,0,0,1|1,1,0]=3 1788 B15R1.5914 NC(=O)CSc1ccccc1CC(=O)N 62a_200009814924_100000747473 [0,0,0,0,0,1|1,1,0]=3 1789 B15R1.5914 NC(=O)CSc1ccccc1NC(=O)N 62a_100000747473_100000742221 [0,0,0,0,0,1|1,1,0]=3 1790 B15R1.5914 NC(=O)Cc1ccccc1SCC(=O)[O-] 62a_100020667443_200009814924 [0,0,0,0,0,1|0,1,1]=3 1791 B15R1.5914 NC(=O)Cc1ccccc1SCC(=O)[O-] 62a_200009814924_100020667443 [0,0,0,0,0,1|0,1,1]=3 1792 B15R1.5914 NC(=O)Cc1ccccc1SC[N+](=O)[O-] 62a_200009814924_100000761209 [0,0,0,0,0,1|1,1,1]=4 1793 B15R1.5914 NC(=O)Nc1ccccc1SCC(=O)[O-] 62a_100020667443_100000742221 [0,0,0,0,0,1|0,1,1]=3 1794 B15R1.8882 C=C(C)CCNc1ccccc1C(=O)N 34a_100000185089_100000730704 [0,0,0,0,0,1|3,0,0]=4 1795 B15R1.8882 C=C(C)CCOc1ccccc1C(=O)N 34a_100000192804_100000730704 [0,0,0,0,0,1|2,0,0]=3 1796 B15R1.8882 C=C(C)CCOc1ccccc1C(=O)N 7a_100000192804_100000730704 [0,0,0,0,0,1|2,0,0]=3 1797 B15R1.8882 C=C(C)CCOc1ccccc1C(=O)[O-] 7a_100015234032_100000730704 [0,0,0,0,0,1|3,0,0]=4 1798 B15R1.8882 C=C(C)CCOc1ccccc1C(=S)N 7a_100000745089_100000730704 [0,0,0,0,0,1|2,1,0]=4 1799 B15R1.8882 C=C(C)CCOc1cccnc1C(=O)N 34a_200011215183_100000730704 [0,0,0,0,0,1|3,0,0]=4 1800 B15R1.8882 C=C(C)CCOc1cccnc1C(=O)N 7a_200011215183_100000730704 [0,0,0,0,0,1|3,0,0]=4 1801 B15R1.8882 C=C(C)CCOc1ccncc1C(=O)N 34a_200011998761_100000730704 [0,0,0,0,0,1|3,0,0]=4 1802 B15R1.8882 C=C(C)CCOc1cnccc1C(=O)N 7a_100012022987_100000730704 [0,0,0,0,0,1|3,0,0]=4 1803 B15R1.8882 C=C(C)CCSc1ccccc1C(=O)N 62a_100000162227_100000730704 [0,0,0,0,0,1|2,1,0]=4 1804 B15R1.8882 C=C(C)CCSc1ccccc1C(=O)N 62a_100000730704_100000162227 [0,0,0,0,0,1|2,1,0]=4 1805 B15R1.8882 CC(=CCNc1ccccc1C(=O)N)C 34a_100000185089_100000761012 [0,0,0,0,0,1|3,0,0]=4 1806 B15R1.8882 CC(=CCOc1ccccc1C(=O)N)C 34a_100000192804_100000761012 [0,0,0,0,0,1|2,0,0]=3 1807 B15R1.8882 CC(=CCOc1ccccc1C(=O)N)C 7a_100000192804_100000761012 [0,0,0,0,0,1|2,0,0]=3 1808 B15R1.8882 CC(=CCOc1ccccc1C(=O)[O-])C 7a_100015234032_100000761012 [0,0,0,0,0,1|3,0,0]=4 1809 B15R1.8882 CC(=CCOc1ccccc1C(=S)N)C 7a_100000745089_100000761012 [0,0,0,0,0,1|2,1,0]=4 1810 B15R1.8882 CC(=CCOc1cccnc1C(=O)N)C 34a_200011215183_100000761012 [0,0,0,0,0,1|3,0,0]=4 1811 B15R1.8882 CC(=CCOc1cccnc1C(=O)N)C 7a_200011215183_100000761012 [0,0,0,0,0,1|3,0,0]=4 1812 B15R1.8882 CC(=CCOc1ccncc1C(=O)N)C 34a_200011998761_100000761012 [0,0,0,0,0,1|3,0,0]=4 1813 B15R1.8882 CC(=CCOc1cnccc1C(=O)N)C 7a_100012022987_100000761012 [0,0,0,0,0,1|3,0,0]=4 1814 B15R1.8882 CC(=CCSc1ccccc1C(=O)N)C 62a_100000162227_100000761012 [0,0,0,0,0,1|2,1,0]=4 1815 B15R1.8882 CC(=CCSc1ccccc1C(=O)N)C 62a_100000761012_100000162227 [0,0,0,0,0,1|2,1,0]=4 1816 B15R1.8882 CC(=O)CCOc1ccccc1C(=O)C 1458a_100000070787_100000184561 [0,0,0,0,0,1|2,0,0]=3 1817 B15R1.8882 CC(=O)CCOc1ccccc1C(=O)N 7a_100000192804_100000053229 [0,0,0,0,0,1|1,0,0]=2 1818 B15R1.8882 CC(=O)CCOc1ccccc1C(=O)[O-] 7a_100015234032_100000053229 [0,0,0,0,0,1|2,0,0]=3 1819 B15R1.8882 CC(=O)CCOc1ccccc1C(=S)N 7a_100000745089_100000053229 [0,0,0,0,0,1|1,1,0]=3 1820 B15R1.8882 CC(=O)CCOc1ccccc1[N+](=O)[O-] 1458a_100000070787_100000741959 [0,0,0,0,0,1|3,0,0]=4 1821 B15R1.8882 CC(=O)CCOc1ccccc1[N+](=O)[O-] 1458a_100000244353_200000210301 [0,0,0,0,0,1|3,0,0]=4 1822 B15R1.8882 CC(=O)CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000053229 [0,0,0,0,0,1|3,0,0]=4 1823 B15R1.8882 CC(=O)CCOc1cccnc1C(=O)C 7a_100000087166_100000053229 [0,0,0,0,0,1|3,0,0]=4 1824 B15R1.8882 CC(=O)CCOc1cccnc1C(=O)N 7a_200011215183_100000053229 [0,0,0,0,0,1|2,0,0]=3 1825 B15R1.8882 CC(=O)CCOc1cnccc1C(=O)C 7a_100009872882_100000053229 [0,0,0,0,0,1|3,0,0]=4 1826 B15R1.8882 CC(=O)CCOc1cnccc1C(=O)N 7a_100012022987_100000053229 [0,0,0,0,0,1|2,0,0]=3 1827 B15R1.8882 CC(=O)CCSc1ccccc1C(=O)C 62a_100000751169_100000053229 [0,0,0,0,0,1|2,1,0]=4 1828 B15R1.8882 CC(=O)CCSc1ccccc1C(=O)N 62a_100000053229_100000162227 [0,0,0,0,0,1|1,1,0]=3 1829 B15R1.8882 CC(=O)CCSc1ccccc1C(=O)N 62a_100000162227_100000053229 [0,0,0,0,0,1|1,1,0]=3 1830 B15R1.8882 CC(=O)CCSc1ccccc1C(=O)O 62a_100000053229_100000734275 [0,0,0,0,0,1|2,1,0]=4 1831 B15R1.8882 CC(=O)CCSc1ccccc1C(=O)O 62a_202125556159_100000053229 [0,0,0,0,0,1|2,1,0]=4 1832 B15R1.8882 CC(=O)CCSc1cccnc1C(=O)N 62a_100000053229_200012359670 [0,0,0,0,0,1|2,1,0]=4 1833 B15R1.8882 CC(=O)CCSc1cccnc1C(=O)N 62a_200012359670_100000053229 [0,0,0,0,0,1|2,1,0]=4 1834 B15R1.8882 CC(=O)CCSc1ccncc1C(=O)N 62a_100000053229_100000697804 [0,0,0,0,0,1|2,1,0]=4 1835 B15R1.8882 CC(=O)CCSc1ccncc1C(=O)N 62a_100000697804_100000053229 [0,0,0,0,0,1|2,1,0]=4 1836 B15R1.8882 CC(=O)CCSc1cnccc1C(=O)N 62a_100000053229_100010205435 [0,0,0,0,0,1|2,1,0]=4 1837 B15R1.8882 CC(=O)CCSc1cnccc1C(=O)N 62a_100010205435_100000053229 [0,0,0,0,0,1|2,1,0]=4 1838 B15R1.8882 CC(=O)CCSc1ncccc1C(=O)N 62a_100000053229_100000162199 [0,0,0,0,0,1|2,1,0]=4 1839 B15R1.8882 CC(=O)CCSc1ncccc1C(=O)N 62a_100000162199_100000053229 [0,0,0,0,0,1|2,1,0]=4 1840 B15R1.8882 CC(=O)COCc1ccccc1[N+](=O)[O-] 34a_100000211253_100000181388 [0,0,0,0,0,1|3,0,0]=4 1841 B15R1.8882 CC(=O)OCNc1ccccc1C(=O)N 34a_100000185089_100009813279 [0,0,0,0,0,1|2,0,0]=3 1842 B15R1.8882 CC(=O)OCOc1ccccc1C(=O)N 34a_100000192804_100009813279 [0,0,0,0,0,1|1,0,0]=2 1843 B15R1.8882 CC(=O)OCOc1ccccc1[C@@H](C)N 34a_100025703389_100009813279 [0,0,0,0,0,1|2,0,1]=4 1844 B15R1.8882 CC(=O)OCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100009813279 [0,0,0,0,0,1|3,0,0]=4 1845 B15R1.8882 CC(=O)OCOc1cccnc1C(=O)C 34a_100000087166_100009813279 [0,0,0,0,0,1|3,0,0]=4 1846 B15R1.8882 CC(=O)OCOc1cccnc1C(=O)N 34a_200011215183_100009813279 [0,0,0,0,0,1|2,0,0]=3 1847 B15R1.8882 CC(=O)OCOc1ccncc1C(=O)N 34a_200011998761_100009813279 [0,0,0,0,0,1|2,0,0]=3 1848 B15R1.8882 CC(=O)OCOc1nccnc1C(=O)N 34a_100011830332_100009813279 [0,0,0,0,0,1|3,0,0]=4 1849 B15R1.8882 CC(=O)OCSc1ccccc1C(=O)C 62a_100000751169_100000076356 [0,0,0,0,0,1|2,1,0]=4 1850 B15R1.8882 CC(=O)OCSc1ccccc1C(=O)N 62a_100000076356_100000162227 [0,0,0,0,0,1|1,1,0]=3 1851 B15R1.8882 CC(=O)OCSc1ccccc1C(=O)N 62a_100000162227_100000076356 [0,0,0,0,0,1|1,1,0]=3 1852 B15R1.8882 CC(=O)OCSc1ccccc1C(=O)O 62a_100000076356_100000734275 [0,0,0,0,0,1|2,1,0]=4 1853 B15R1.8882 CC(=O)OCSc1ccccc1C(=O)O 62a_202125556159_100000076356 [0,0,0,0,0,1|2,1,0]=4 1854 B15R1.8882 CC(=O)OCSc1cccnc1C(=O)N 62a_100000076356_200012359670 [0,0,0,0,0,1|2,1,0]=4 1855 B15R1.8882 CC(=O)OCSc1cccnc1C(=O)N 62a_200012359670_100000076356 [0,0,0,0,0,1|2,1,0]=4 1856 B15R1.8882 CC(=O)OCSc1ccncc1C(=O)N 62a_100000076356_100000697804 [0,0,0,0,0,1|2,1,0]=4 1857 B15R1.8882 CC(=O)OCSc1ccncc1C(=O)N 62a_100000697804_100000076356 [0,0,0,0,0,1|2,1,0]=4 1858 B15R1.8882 CC(=O)OCSc1cnccc1C(=O)N 62a_100000076356_100010205435 [0,0,0,0,0,1|2,1,0]=4 1859 B15R1.8882 CC(=O)OCSc1cnccc1C(=O)N 62a_100010205435_100000076356 [0,0,0,0,0,1|2,1,0]=4 1860 B15R1.8882 CC(=O)OCSc1ncccc1C(=O)N 62a_100000076356_100000162199 [0,0,0,0,0,1|2,1,0]=4 1861 B15R1.8882 CC(=O)OCSc1ncccc1C(=O)N 62a_100000162199_100000076356 [0,0,0,0,0,1|2,1,0]=4 1862 B15R1.8882 CC(=O)c1ccccc1SCCC(=O)N 62a_100000751169_100000744528 [0,0,0,0,0,1|2,1,0]=4 1863 B15R1.8882 CC(=O)c1ccncc1OCCC(=O)N 7a_100009872882_100000744528 [0,0,0,0,0,1|3,0,0]=4 1864 B15R1.8882 CC(=O)c1ncccc1OCCC(=O)N 34a_100000087166_100000731001 [0,0,0,0,0,1|3,0,0]=4 1865 B15R1.8882 CC(=O)c1ncccc1OCCC(=O)N 7a_100000087166_100000744528 [0,0,0,0,0,1|3,0,0]=4 1866 B15R1.8882 CC(C)CCOc1ccccc1C(=O)N 34a_100000192804_100000210312 [0,0,0,0,0,1|2,0,1]=4 1867 B15R1.8882 CC(C)CCOc1ccccc1C(=O)N 7a_100000192804_100000210626 [0,0,0,0,0,1|2,0,1]=4 1868 B15R1.8882 CC(C)OCOc1ccccc1C(=O)N 34a_100000192804_100000709892 [0,0,0,0,0,1|2,0,1]=4 1869 B15R1.8882 CC(O)CCNc1ccccc1C(=O)N 34a_100000185089_100012276601 [0,0,0,0,0,1|2,0,1]=4 1870 B15R1.8882 CC(O)CCOc1ccccc1C(=O)N 34a_100000192804_100012276601 [0,0,0,0,0,1|1,0,1]=3 1871 B15R1.8882 CC(O)CCOc1ccccc1C(=O)N 7a_100000192804_100012276601 [0,0,0,0,0,1|1,0,1]=3 1872 B15R1.8882 CC(O)CCOc1ccccc1C(=O)[O-] 7a_100015234032_100012276601 [0,0,0,0,0,1|2,0,1]=4 1873 B15R1.8882 CC(O)CCOc1ccccc1C(=S)N 7a_100000745089_100012276601 [0,0,0,0,0,1|1,1,1]=4 1874 B15R1.8882 CC(O)CCOc1cccnc1C(=O)N 34a_200011215183_100012276601 [0,0,0,0,0,1|2,0,1]=4 1875 B15R1.8882 CC(O)CCOc1cccnc1C(=O)N 7a_200011215183_100012276601 [0,0,0,0,0,1|2,0,1]=4 1876 B15R1.8882 CC(O)CCOc1ccncc1C(=O)N 34a_200011998761_100012276601 [0,0,0,0,0,1|2,0,1]=4 1877 B15R1.8882 CC(O)CCOc1cnccc1C(=O)N 7a_100012022987_100012276601 [0,0,0,0,0,1|2,0,1]=4 1878 B15R1.8882 CC(O)CCSc1ccccc1C(=O)N 62a_100000162227_100012276601 [0,0,0,0,0,1|1,1,1]=4 1879 B15R1.8882 CC(O)CCSc1ccccc1C(=O)N 62a_100012276601_100000162227 [0,0,0,0,0,1|1,1,1]=4 1880 B15R1.8882 CN(C)CCOc1ccccc1C(=O)N 7a_100000192804_100000755713 [0,0,0,0,0,1|3,0,0]=4 1881 B15R1.8882 C[C@@H](N)c1ccccc1OCCC(=O)N 34a_100025703389_100000731001 [0,0,0,0,0,1|2,0,1]=4 1882 B15R1.8882 NC(=O)CCNc1ccccc1C(=O)N 34a_100000185089_100000731001 [0,0,0,0,0,1|2,0,0]=3 1883 B15R1.8882 NC(=O)CCNc1cccnc1C(=O)N 27a_100000740010_200012359670 [0,0,0,0,0,1|3,0,0]=4 1884 B15R1.8882 NC(=O)CCNc1ccncc1C(=O)N 27a_100000740010_100000697804 [0,0,0,0,0,1|3,0,0]=4 1885 B15R1.8882 NC(=O)CCNc1ncccc1C(=O)N 27a_100000740010_100000162199 [0,0,0,0,0,1|3,0,0]=4 1886 B15R1.8882 NC(=O)CCOc1ccccc1C(=O)N 34a_100000192804_100000731001 [0,0,0,0,0,1|1,0,0]=2 1887 B15R1.8882 NC(=O)CCOc1ccccc1C(=O)N 7a_100000192804_100000744528 [0,0,0,0,0,1|1,0,0]=2 1888 B15R1.8882 NC(=O)CCOc1ccccc1C(=O)[O-] 7a_100015234032_100000744528 [0,0,0,0,0,1|2,0,0]=3 1889 B15R1.8882 NC(=O)CCOc1ccccc1C(=S)N 7a_100000745089_100000744528 [0,0,0,0,0,1|1,1,0]=3 1890 B15R1.8882 NC(=O)CCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000731001 [0,0,0,0,0,1|3,0,0]=4 1891 B15R1.8882 NC(=O)CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000744528 [0,0,0,0,0,1|3,0,0]=4 1892 B15R1.8882 NC(=O)CCOc1cccnc1C(=O)N 34a_200011215183_100000731001 [0,0,0,0,0,1|2,0,0]=3 1893 B15R1.8882 NC(=O)CCOc1cccnc1C(=O)N 7a_200011215183_100000744528 [0,0,0,0,0,1|2,0,0]=3 1894 B15R1.8882 NC(=O)CCOc1ccncc1C(=O)N 34a_200011998761_100000731001 [0,0,0,0,0,1|2,0,0]=3 1895 B15R1.8882 NC(=O)CCOc1cnccc1C(=O)N 7a_100012022987_100000744528 [0,0,0,0,0,1|2,0,0]=3 1896 B15R1.8882 NC(=O)CCOc1nccnc1C(=O)N 34a_100011830332_100000731001 [0,0,0,0,0,1|3,0,0]=4 1897 B15R1.8882 NC(=O)CCSc1ccccc1C(=O)N 62a_100000162227_100000744528 [0,0,0,0,0,1|1,1,0]=3 1898 B15R1.8882 NC(=O)CCSc1ccccc1C(=O)N 62a_100000744528_100000162227 [0,0,0,0,0,1|1,1,0]=3 1899 B15R1.8882 NC(=O)CCSc1ccccc1C(=O)O 62a_100000744528_100000734275 [0,0,0,0,0,1|2,1,0]=4 1900 B15R1.8882 NC(=O)CCSc1ccccc1C(=O)O 62a_202125556159_100000744528 [0,0,0,0,0,1|2,1,0]=4 1901 B15R1.8882 NC(=O)CCSc1cccnc1C(=O)N 62a_100000744528_200012359670 [0,0,0,0,0,1|2,1,0]=4 1902 B15R1.8882 NC(=O)CCSc1cccnc1C(=O)N 62a_200012359670_100000744528 [0,0,0,0,0,1|2,1,0]=4 1903 B15R1.8882 NC(=O)CCSc1ccncc1C(=O)N 62a_100000697804_100000744528 [0,0,0,0,0,1|2,1,0]=4 1904 B15R1.8882 NC(=O)CCSc1ccncc1C(=O)N 62a_100000744528_100000697804 [0,0,0,0,0,1|2,1,0]=4 1905 B15R1.8882 NC(=O)CCSc1cnccc1C(=O)N 62a_100000744528_100010205435 [0,0,0,0,0,1|2,1,0]=4 1906 B15R1.8882 NC(=O)CCSc1cnccc1C(=O)N 62a_100010205435_100000744528 [0,0,0,0,0,1|2,1,0]=4 1907 B15R1.8882 NC(=O)CCSc1ncccc1C(=O)N 62a_100000162199_100000744528 [0,0,0,0,0,1|2,1,0]=4 1908 B15R1.8882 NC(=O)CCSc1ncccc1C(=O)N 62a_100000744528_100000162199 [0,0,0,0,0,1|2,1,0]=4 1909 B15R1.8882 NC(=O)CNCc1ccccc1C(=O)O 269956a_100015183376_100000187820 [0,0,0,0,0,1|3,0,0]=4 1910 B15R1.8882 NC(=O)COCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000187820 [0,0,0,0,0,1|3,0,0]=4 1911 B15R1.8882 O=C(O)CNCc1ccccc1[N+](=O)[O-] 269956a_100016091260_100000181388 [0,0,0,0,0,1|3,0,0]=4 1912 B15R1.8882 O=C([O-])CNCc1ccccc1C(=O)O 269956a_100015183376_100020667443 [0,0,0,0,0,1|2,0,1]=4 1913 B15R1.8882 [13CH3]C(=O)CCOc1ccccc1[N+](=O)[O-] 1458a_100000244353_200025704644 [0,0,0,0,0,1|3,0,0]=4 1914 B12R1.121 C#Cc1ccccc1OCC=O 34a_200011470546_200009817547 [2,0,0,0,0,0|1,0,1]=4 1915 B12R1.121 C#Cc1ccccc1OCC=O 7a_200011470546_200015260668 [2,0,0,0,0,0|1,0,1]=4 1916 B12R1.121 C=CCOc1ccccc1CN 34a_100000185550_100015514636 [2,0,0,0,0,0|1,0,1]=4 1917 B12R1.121 C=CCSc1ccccc1C=O 62a_100000210073_100000210623 [2,0,0,0,0,0|1,1,0]=4 1918 B12R1.121 C=CCSc1ccccc1C=O 62a_100000210623_100000210073 [2,0,0,0,0,0|1,1,0]=4 1919 B12R1.121 C=Cc1ccccc1CCC=O 271570a_100011290941_100011713448 [2,0,0,0,0,0|2,0,0]=4 1920 B12R1.121 C=Cc1ccccc1NCC=O 34a_100012022501_200009817547 [2,0,0,0,0,0|2,0,0]=4 1921 B12R1.121 C=Cc1ccccc1OCCO 271570a_100011290941_100000230753 [2,0,0,0,0,0|1,0,1]=4 1922 B12R1.121 C=Cc1ccccc1SCC=O 62a_100011218376_200015260668 [2,0,0,0,0,0|1,1,0]=4 1923 B12R1.121 C=Cc1ccccc1SCC=O 62a_200015260668_100011218376 [2,0,0,0,0,0|1,1,0]=4 1924 B12R1.121 CCc1ccccc1OCC=O 34a_100000210936_200009817547 [2,0,0,0,0,0|1,0,1]=4 1925 B12R1.121 CCc1ccccc1OCC=O 7a_100000210936_200015260668 [2,0,0,0,0,0|1,0,1]=4 1926 B12R1.121 CNc1ccccc1OCC=O 34a_100000033821_200009817547 [2,0,0,0,0,0|2,0,0]=4 1927 B12R1.121 COc1ccccc1OCC=O 34a_100000210385_200009817547 [2,0,0,0,0,0|2,0,0]=4 1928 B12R1.121 CSc1ccccc1OCC=O 34a_100011216402_200009817547 [2,0,0,0,0,0|2,0,0]=4 1929 B12R1.121 N#Cc1ccccc1OCC=O 34a_100000211048_200009817547 [2,0,0,0,0,0|0,0,2]=4 1930 B12R1.121 N#Cc1ccccc1OCC=O 7a_100000211048_200015260668 [2,0,0,0,0,0|0,0,2]=4 1931 B12R1.121 NCc1ccccc1OCC=O 34a_100000185550_200009817547 [2,0,0,0,0,0|0,0,1]=3 1932 B12R1.121 NCc1ccccc1OCCO 34a_100000185550_100000211926 [2,0,0,0,0,0|0,0,2]=4 1933 B12R1.121 NCc1ccccc1SCC=O 62a_100000689332_200015260668 [2,0,0,0,0,0|0,1,1]=4 1934 B12R1.121 NCc1ccccc1SCC=O 62a_200015260668_100000689332 [2,0,0,0,0,0|0,1,1]=4 1935 B12R1.121 NNc1ccccc1SCC=O 62a_100000241748_200015260668 [2,0,0,0,0,0|1,1,0]=4 1936 B12R1.121 NNc1ccccc1SCC=O 62a_200015260668_100000241748 [2,0,0,0,0,0|1,1,0]=4 1937 B12R1.121 O=CCOc1ccccc1CO 34a_100011216872_200009817547 [2,0,0,0,0,0|0,0,2]=4 1938 B12R1.121 O=CCSc1ccccc1C=O 62a_100000210073_200015260668 [2,0,0,0,0,0|0,1,0]=3 1939 B12R1.121 O=CCSc1ccccc1C=O 62a_200015260668_100000210073 [2,0,0,0,0,0|0,1,0]=3 1940 B12R1.121 O=CCSc1cccnc1C=O 62a_100011934733_200015260668 [2,0,0,0,0,0|1,1,0]=4 1941 B12R1.121 O=CCSc1cccnc1C=O 62a_200015260668_100011934733 [2,0,0,0,0,0|1,1,0]=4 1942 B12R1.121 O=CCSc1ccncc1C=O 62a_100000050567_200015260668 [2,0,0,0,0,0|1,1,0]=4 1943 B12R1.121 O=CCSc1ccncc1C=O 62a_200015260668_100000050567 [2,0,0,0,0,0|1,1,0]=4 1944 B12R1.121 O=CCSc1cnccc1C=O 62a_100011934409_200015260668 [2,0,0,0,0,0|1,1,0]=4 1945 B12R1.121 O=CCSc1cnccc1C=O 62a_200015260668_100011934409 [2,0,0,0,0,0|1,1,0]=4 1946 B12R1.121 O=CCSc1ncccc1C=O 62a_100009816751_200015260668 [2,0,0,0,0,0|1,1,0]=4 1947 B12R1.121 O=CCSc1ncccc1C=O 62a_200015260668_100009816751 [2,0,0,0,0,0|1,1,0]=4 1948 B12R1.121 O=Cc1ccccc1SCCO 62a_100000210073_100000211926 [2,0,0,0,0,0|0,1,1]=4 1949 B12R1.121 O=Cc1ccccc1SCCO 62a_100000211926_100000210073 [2,0,0,0,0,0|0,1,1]=4 1950 B12R1.125 C=C(C)COc1ccccc1N 34a_100000185747_100000748629 [2,0,0,0,0,0|2,0,0]=4 1951 B12R1.125 C=C(C)COc1ccccc1N 7a_100000185747_100000748629 [2,0,0,0,0,0|2,0,0]=4 1952 B12R1.125 C=C(F)COc1ccccc1N 34a_100000185747_100009893438 [2,0,0,0,0,0|2,0,0]=4 1953 B12R1.125 C=C(F)COc1ccccc1N 7a_100000185747_100000042424 [2,0,0,0,0,0|2,0,0]=4 1954 B12R1.125 CC(=O)COc1ccccc1Br 1458a_100000216496_200000210301 [2,0,0,0,0,0|2,0,0]=4 1955 B12R1.125 CC(=O)COc1ccccc1C 1458a_100000182418_200000210301 [2,0,0,0,0,0|1,0,1]=4 1956 B12R1.125 CC(=O)COc1ccccc1Cl 1458a_100000185159_200000210301 [2,0,0,0,0,0|2,0,0]=4 1957 B12R1.125 CC(=O)COc1ccccc1F 1458a_100000182486_200000210301 [2,0,0,0,0,0|2,0,0]=4 1958 B12R1.125 CC(=O)COc1ccccc1O 1458a_100000183020_200000210301 [2,0,0,0,0,0|1,0,1]=4 1959 B12R1.125 CC(O)COc1ccccc1N 34a_100000185747_100011218427 [2,0,0,0,0,0|1,0,1]=4 1960 B12R1.125 CC(O)COc1ccccc1N 7a_100000185747_100011218427 [2,0,0,0,0,0|1,0,1]=4 1961 B12R1.125 C[C@@H](O)COc1ccccc1N 34a_100000185747_100009817552 [2,0,0,0,0,0|1,0,1]=4 1962 B12R1.125 C[C@@H](O)COc1ccccc1N 7a_100000185747_100009817552 [2,0,0,0,0,0|1,0,1]=4 1963 B12R1.125 Cc1ccccc1OCC(=O)N 34a_100000210338_100000187820 [2,0,0,0,0,0|1,0,1]=4 1964 B12R1.125 Cc1ccccc1OCC(=O)N 7a_100000210338_100000187820 [2,0,0,0,0,0|1,0,1]=4 1965 B12R1.125 Cc1ccccc1OCC(=O)[13CH3] 1458a_100000182418_200025704644 [2,0,0,0,0,0|1,0,1]=4 1966 B12R1.125 Cc1ccccc1OCC(=O)[O-] 34a_100000210338_100020667443 [2,0,0,0,0,0|0,0,2]=4 1967 B12R1.125 NC(=O)COc1ccccc1Br 34a_100000181306_100000187820 [2,0,0,0,0,0|2,0,0]=4 1968 B12R1.125 NC(=O)COc1ccccc1Br 7a_100000181306_100000187820 [2,0,0,0,0,0|2,0,0]=4 1969 B12R1.125 NC(=O)COc1ccccc1Cl 34a_100000210172_100000187820 [2,0,0,0,0,0|2,0,0]=4 1970 B12R1.125 NC(=O)COc1ccccc1Cl 7a_100000210172_100000187820 [2,0,0,0,0,0|2,0,0]=4 1971 B12R1.125 NC(=O)COc1ccccc1F 34a_100000210171_100000187820 [2,0,0,0,0,0|2,0,0]=4 1972 B12R1.125 NC(=O)COc1ccccc1F 7a_100000210171_100000187820 [2,0,0,0,0,0|2,0,0]=4 1973 B12R1.125 NC(=O)COc1ccccc1I 34a_100000739446_100000187820 [2,0,0,0,0,0|2,0,0]=4 1974 B12R1.125 NC(=O)COc1ccccc1I 7a_100000739446_100000187820 [2,0,0,0,0,0|2,0,0]=4 1975 B12R1.125 NC(=O)COc1ccccc1N 34a_100000185747_100000187820 [2,0,0,0,0,0|1,0,0]=3 1976 B12R1.125 NC(=O)COc1ccccc1N 7a_100000185747_100000187820 [2,0,0,0,0,0|1,0,0]=3 1977 B12R1.125 NC(=O)COc1ccccc1O 271570a_203496583355_200000148491 [2,0,0,0,0,0|1,0,1]=4 1978 B12R1.125 NC(=O)COc1cccnc1N 34a_100000211975_100000187820 [2,0,0,0,0,0|2,0,0]=4 1979 B12R1.125 NC(=O)COc1cccnc1N 7a_100000211975_100000187820 [2,0,0,0,0,0|2,0,0]=4 1980 B12R1.125 NC(=O)COc1cccoc1=O 34a_100000077404_100000187820 [2,0,0,0,0,0|2,0,0]=4 1981 B12R1.125 NC(=O)COc1cccoc1=O 7a_100000077404_100000187820 [2,0,0,0,0,0|2,0,0]=4 1982 B12R1.125 NC(=O)COc1cnccc1N 34a_100000753702_100000187820 [2,0,0,0,0,0|2,0,0]=4 1983 B12R1.125 NC(=O)COc1coccc1=O 34a_100000060831_100000187820 [2,0,0,0,0,0|2,0,0]=4 1984 B12R1.125 NC(=O)COc1ncccc1N 34a_100000746358_100000187820 [2,0,0,0,0,0|2,0,0]=4 1985 B12R1.125 NC(=O)CSc1ccccc1N 62a_100000210017_100000747473 [2,0,0,0,0,0|1,1,0]=4 1986 B12R1.125 NC(=O)CSc1ccccc1N 62a_100000747473_100000210017 [2,0,0,0,0,0|1,1,0]=4 1987 B12R1.125 Nc1ccccc1OCC(=O)[O-] 34a_100000185747_100020667443 [2,0,0,0,0,0|0,0,1]=3 1988 B12R1.125 Nc1ccccc1OC[N+](=O)[O-] 34a_100000185747_100000761209 [2,0,0,0,0,0|1,0,1]=4 1989 B12R1.125 Nc1ccccc1SCC(=O)[O-] 62a_100000210017_100020667443 [2,0,0,0,0,0|0,1,1]=4 1990 B12R1.125 Nc1ccccc1SCC(=O)[O-] 62a_100020667443_100000210017 [2,0,0,0,0,0|0,1,1]=4 1991 B12R1.125 Nc1cccnc1OCC(=O)[O-] 34a_100000746358_100020667443 [2,0,0,0,0,0|1,0,1]=4 1992 B12R1.125 Nc1ccncc1OCC(=O)[O-] 34a_100000753702_100020667443 [2,0,0,0,0,0|1,0,1]=4 1993 B12R1.125 Nc1ncccc1OCC(=O)[O-] 34a_100000211975_100020667443 [2,0,0,0,0,0|1,0,1]=4 1994 B12R1.125 O=C([O-])COc1ccccc1Br 34a_100000181306_100020667443 [2,0,0,0,0,0|1,0,1]=4 1995 B12R1.125 O=C([O-])COc1ccccc1Cl 34a_100000210172_100020667443 [2,0,0,0,0,0|1,0,1]=4 1996 B12R1.125 O=C([O-])COc1ccccc1F 34a_100000210171_100020667443 [2,0,0,0,0,0|1,0,1]=4 1997 B12R1.125 O=C([O-])COc1ccccc1I 34a_100000739446_100020667443 [2,0,0,0,0,0|1,0,1]=4 1998 B12R1.125 O=C([O-])COc1cccoc1=O 34a_100000077404_100020667443 [2,0,0,0,0,0|1,0,1]=4 1999 B12R1.125 O=C([O-])COc1coccc1=O 34a_100000060831_100020667443 [2,0,0,0,0,0|1,0,1]=4 2000 B12R1.125 [13CH3]C(=O)COc1ccccc1Br 1458a_100000216496_200025704644 [2,0,0,0,0,0|2,0,0]=4 2001 B12R1.125 [13CH3]C(=O)COc1ccccc1Cl 1458a_100000185159_200025704644 [2,0,0,0,0,0|2,0,0]=4 2002 B12R1.125 [13CH3]C(=O)COc1ccccc1F 1458a_100000182486_200025704644 [2,0,0,0,0,0|2,0,0]=4 2003 B12R1.125 [13CH3]C(=O)COc1ccccc1O 1458a_100000183020_200025704644 [2,0,0,0,0,0|1,0,1]=4 2004 B12R1.283 C=C=Cc1ccccc1C(=O)N 271570a_100015277604_100000162227 [2,0,0,0,0,0|1,0,1]=4 2005 B12R1.283 CC=Cc1ccccc1C(=O)N 271570a_100016259895_100000162227 [2,0,0,0,0,0|1,0,1]=4 2006 B12R1.283 CCNc1ccccc1C(=O)N 34a_100000185089_100000210202 [2,0,0,0,0,0|1,0,1]=4 2007 B12R1.283 CCOc1ccccc1C(=O)C 1458a_100000211144_200000210301 [2,0,0,0,0,0|1,0,1]=4 2008 B12R1.283 CCOc1ccccc1C(=O)N 34a_100000192804_100000210202 [2,0,0,0,0,0|0,0,1]=3 2009 B12R1.283 CCOc1ccccc1C(=O)N 7a_100000192804_100000210202 [2,0,0,0,0,0|0,0,1]=3 2010 B12R1.283 CCOc1ccccc1C(=O)[13CH3] 1458a_100000211144_200025704644 [2,0,0,0,0,0|1,0,1]=4 2011 B12R1.283 CCOc1ccccc1C(=O)[O-] 7a_100015234032_100000210202 [2,0,0,0,0,0|1,0,1]=4 2012 B12R1.283 CCOc1ccccc1C(=S)N 7a_100000745089_100000210202 [2,0,0,0,0,0|0,1,1]=4 2013 B12R1.283 CCOc1cccnc1C(=O)N 34a_200011215183_100000210202 [2,0,0,0,0,0|1,0,1]=4 2014 B12R1.283 CCOc1cccnc1C(=O)N 7a_200011215183_100000210202 [2,0,0,0,0,0|1,0,1]=4 2015 B12R1.283 CCOc1ccncc1C(=O)N 34a_200011998761_100000210202 [2,0,0,0,0,0|1,0,1]=4 2016 B12R1.283 CCOc1cnccc1C(=O)N 7a_100012022987_100000210202 [2,0,0,0,0,0|1,0,1]=4 2017 B12R1.283 CCSc1ccccc1C(=O)N 62a_100000162227_100000210202 [2,0,0,0,0,0|0,1,1]=4 2018 B12R1.283 CCSc1ccccc1C(=O)N 62a_100000210202_100000162227 [2,0,0,0,0,0|0,1,1]=4 2019 B12R1.283 NC(=O)c1ccccc1NCF 34a_100000185089_100015361967 [2,0,0,0,0,0|2,0,0]=4 2020 B12R1.283 NC(=O)c1ccccc1OCF 34a_100000192804_100015361967 [2,0,0,0,0,0|1,0,0]=3 2021 B12R1.283 NC(=O)c1ccccc1OCF 7a_100000192804_100015361967 [2,0,0,0,0,0|1,0,0]=3 2022 B12R1.283 NC(=O)c1ccccc1SCF 62a_100000162227_100015361967 [2,0,0,0,0,0|1,1,0]=4 2023 B12R1.283 NC(=O)c1ccccc1SCF 62a_100015361967_100000162227 [2,0,0,0,0,0|1,1,0]=4 2024 B12R1.283 NC(=O)c1ccncc1OCF 7a_100012022987_100015361967 [2,0,0,0,0,0|2,0,0]=4 2025 B12R1.283 NC(=O)c1cnccc1OCF 34a_200011998761_100015361967 [2,0,0,0,0,0|2,0,0]=4 2026 B12R1.283 NC(=O)c1ncccc1OCF 34a_200011215183_100015361967 [2,0,0,0,0,0|2,0,0]=4 2027 B12R1.283 NC(=O)c1ncccc1OCF 7a_200011215183_100015361967 [2,0,0,0,0,0|2,0,0]=4 2028 B12R1.283 NC(=S)c1ccccc1OCF 7a_100000745089_100015361967 [2,0,0,0,0,0|1,1,0]=4 2029 B12R1.283 O=C([O-])c1ccccc1OCF 7a_100015234032_100015361967 [2,0,0,0,0,0|2,0,0]=4 2030 B14R1.118 Cc1cccc(c1C=O)SCC(=O)N 62a_100000041122_100000747473 [1,1,0,0,0,0|1,1,0]=4 2031 B14R1.118 Cc1cccc(c1C=O)SCC(=O)N 62a_100000747473_100000041122 [1,1,0,0,0,0|1,1,0]=4 2032 B14R1.118 Cc1cccc(c1C=O)SCC(=O)[O-] 62a_100000041122_100020667443 [1,1,0,0,0,0|0,1,1]=4 2033 B14R1.118 Cc1cccc(c1C=O)SCC(=O)[O-] 62a_100020667443_100000041122 [1,1,0,0,0,0|0,1,1]=4 2034 B14R1.118 NC(=O)CSc1cccc(c1C=O)Cl 62a_100000747473_100010147682 [1,1,0,0,0,0|1,1,0]=4 2035 B14R1.118 NC(=O)CSc1cccc(c1C=O)Cl 62a_100010147682_100000747473 [1,1,0,0,0,0|1,1,0]=4 2036 B14R1.118 NC(=O)CSc1cccc(c1C=O)F 62a_100000210083_100000747473 [1,1,0,0,0,0|1,1,0]=4 2037 B14R1.118 NC(=O)CSc1cccc(c1C=O)F 62a_100000747473_100000210083 [1,1,0,0,0,0|1,1,0]=4 2038 B14R1.118 NC(=O)CSc1cccc(c1C=O)N 62a_100010232536_100000747473 [1,1,0,0,0,0|1,1,0]=4 2039 B14R1.118 NC(=O)CSc1cccc(c1C=O)O 62a_100000747473_100010193437 [1,1,0,0,0,0|1,1,0]=4 2040 B14R1.118 Nc1cccc(c1C=O)SCC(=O)[O-] 62a_100010232536_100020667443 [1,1,0,0,0,0|0,1,1]=4 2041 B14R1.118 O=Cc1c(cccc1SCC(=O)[O-])Cl 62a_100010147682_100020667443 [1,1,0,0,0,0|0,1,1]=4 2042 B14R1.118 O=Cc1c(cccc1SCC(=O)[O-])Cl 62a_100020667443_100010147682 [1,1,0,0,0,0|0,1,1]=4 2043 B14R1.118 O=Cc1c(cccc1SCC(=O)[O-])F 62a_100000210083_100020667443 [1,1,0,0,0,0|0,1,1]=4 2044 B14R1.118 O=Cc1c(cccc1SCC(=O)[O-])F 62a_100020667443_100000210083 [1,1,0,0,0,0|0,1,1]=4 2045 B14R1.118 O=Cc1c(cccc1SCC(=O)[O-])O 62a_100020667443_100010193437 [1,1,0,0,0,0|0,1,1]=4 2046 B14R1.482 C/C=C/c1ccccc1OCC(=O)N 34a_200000189419_100000187820 [1,1,0,0,0,0|2,0,0]=4 2047 B14R1.482 C/C=C/c1ccccc1OCC(=O)N 7a_200000189419_100000187820 [1,1,0,0,0,0|2,0,0]=4 2048 B14R1.482 C/C=C/c1ccccc1OCC(=O)[O-] 34a_200000189419_100020667443 [1,1,0,0,0,0|1,0,1]=4 2049 B14R1.482 C=C=Cc1ccccc1OCC(=O)N 271570a_100015277604_200000148491 [1,1,0,0,0,0|2,0,0]=4 2050 B14R1.482 C=CCc1ccccc1OCC(=O)N 34a_100000211836_100000187820 [1,1,0,0,0,0|2,0,0]=4 2051 B14R1.482 C=CCc1ccccc1OCC(=O)N 7a_100000211836_100000187820 [1,1,0,0,0,0|2,0,0]=4 2052 B14R1.482 C=CCc1ccccc1OCC(=O)[O-] 34a_100000211836_100020667443 [1,1,0,0,0,0|1,0,1]=4 2053 B14R1.482 CC=Cc1ccccc1OCC(=O)N 271570a_100016259895_200000148491 [1,1,0,0,0,0|2,0,0]=4 2054 B14R1.482 CNCc1ccccc1OCC(=O)N 207a_100102657272_100000150104 [1,1,0,0,0,0|1,0,1]=4 2055 B14R1.482 CNCc1ccccc1OCC(=O)N 270004a_106832991635_100000150104 [1,1,0,0,0,0|1,0,1]=4 2056 B14R1.482 CNCc1ccccc1OCC(=O)N 34a_100015189988_100000187820 [1,1,0,0,0,0|1,0,1]=4 2057 B14R1.482 CNCc1ccccc1OCC(=O)[O-] 34a_100015189988_100020667443 [1,1,0,0,0,0|0,0,2]=4 2058 B14R1.482 NC(=O)CSc1ccccc1NC=O 62a_100000747473_200020615051 [1,1,0,0,0,0|1,1,0]=4 2059 B14R1.482 NC(=O)CSc1ccccc1NC=O 62a_200020615051_100000747473 [1,1,0,0,0,0|1,1,0]=4 2060 B14R1.482 NCCc1ccccc1OCC(=O)N 34a_100011207237_100000187820 [1,1,0,0,0,0|1,0,1]=4 2061 B14R1.482 NCCc1ccccc1OCC(=O)[O-] 34a_100011207237_100020667443 [1,1,0,0,0,0|0,0,2]=4 2062 B14R1.482 O=CNc1ccccc1SCC(=O)[O-] 62a_100020667443_200020615051 [1,1,0,0,0,0|0,1,1]=4 2063 B14R1.482 O=CNc1ccccc1SCC(=O)[O-] 62a_200020615051_100020667443 [1,1,0,0,0,0|0,1,1]=4 2064 B14R1.863 C#CC(=O)CCc1ccccc1C=O 1458a_100000211873_100010186698 [1,1,0,0,0,0|2,0,0]=4 2065 B14R1.863 C#Cc1ccccc1OCC(=O)OC 34a_200011470546_100000747449 [1,1,0,0,0,0|1,0,1]=4 2066 B14R1.863 C#Cc1ccccc1OCC(=O)OC 7a_200011470546_100000747449 [1,1,0,0,0,0|1,0,1]=4 2067 B14R1.863 C=CC(=O)CCc1ccccc1C=O 1458a_100000185746_100010186698 [1,1,0,0,0,0|2,0,0]=4 2068 B14R1.863 C=Cc1ccccc1CCC(=O)OC 271570a_100011290941_100009815308 [1,1,0,0,0,0|2,0,0]=4 2069 B14R1.863 C=Cc1ccccc1NCC(=O)OC 34a_100012022501_100000747449 [1,1,0,0,0,0|2,0,0]=4 2070 B14R1.863 C=Cc1ccccc1OCC(=O)NC 271570a_100011290941_200000148481 [1,1,0,0,0,0|2,0,0]=4 2071 B14R1.863 C=Cc1ccccc1OCC(=O)NN 271570a_100011290941_100025785231 [1,1,0,0,0,0|2,0,0]=4 2072 B14R1.863 C=Cc1ccccc1OCC(=O)OC 271570a_100011290941_200000173920 [1,1,0,0,0,0|1,0,0]=3 2073 B14R1.863 C=Cc1ccccc1SCC(=O)OC 62a_100000747449_100011218376 [1,1,0,0,0,0|1,1,0]=4 2074 B14R1.863 C=Cc1ccccc1SCC(=O)OC 62a_100011218376_100000747449 [1,1,0,0,0,0|1,1,0]=4 2075 B14R1.863 CCC(=O)CCc1ccccc1C=O 1458a_100000210414_100010186698 [1,1,0,0,0,0|2,0,0]=4 2076 B14R1.863 CCC(=O)CSc1ccccc1C=O 62a_100000210073_100000747405 [1,1,0,0,0,0|1,1,0]=4 2077 B14R1.863 CCC(=O)CSc1ccccc1C=O 62a_100000747405_100000210073 [1,1,0,0,0,0|1,1,0]=4 2078 B14R1.863 CCc1ccccc1OCC(=O)OC 34a_100000210936_100000747449 [1,1,0,0,0,0|1,0,1]=4 2079 B14R1.863 CCc1ccccc1OCC(=O)OC 7a_100000210936_100000747449 [1,1,0,0,0,0|1,0,1]=4 2080 B14R1.863 CNC(=O)COc1ccccc1CN 34a_100000185550_100000183359 [1,1,0,0,0,0|1,0,1]=4 2081 B14R1.863 CNC(=O)CSc1ccccc1C=O 62a_100000183359_100000210073 [1,1,0,0,0,0|1,1,0]=4 2082 B14R1.863 CNC(=O)CSc1ccccc1C=O 62a_100000210073_100000183359 [1,1,0,0,0,0|1,1,0]=4 2083 B14R1.863 CNc1ccccc1OCC(=O)OC 34a_100000033821_100000747449 [1,1,0,0,0,0|2,0,0]=4 2084 B14R1.863 COC(=O)COc1ccccc1C#N 34a_100000211048_100000747449 [1,1,0,0,0,0|0,0,2]=4 2085 B14R1.863 COC(=O)COc1ccccc1C#N 7a_100000211048_100000747449 [1,1,0,0,0,0|0,0,2]=4 2086 B14R1.863 COC(=O)COc1ccccc1CN 34a_100000185550_100000747449 [1,1,0,0,0,0|0,0,1]=3 2087 B14R1.863 COC(=O)COc1ccccc1CO 34a_100011216872_100000747449 [1,1,0,0,0,0|0,0,2]=4 2088 B14R1.863 COC(=O)COc1ccccc1OC 34a_100000210385_100000747449 [1,1,0,0,0,0|2,0,0]=4 2089 B14R1.863 COC(=O)COc1ccccc1SC 34a_100011216402_100000747449 [1,1,0,0,0,0|2,0,0]=4 2090 B14R1.863 COC(=O)COc1ccccc1SC 62a_200000173920_200000210301 [1,1,0,0,0,0|2,0,0]=4 2091 B14R1.863 COC(=O)COc1ccccc1SC 62a_200000210301_200000173920 [1,1,0,0,0,0|2,0,0]=4 2092 B14R1.863 COC(=O)COc1ccccc1S[13CH3] 62a_200000173920_200025704644 [1,1,0,0,0,0|2,0,0]=4 2093 B14R1.863 COC(=O)COc1ccccc1S[13CH3] 62a_200025704644_200000173920 [1,1,0,0,0,0|2,0,0]=4 2094 B14R1.863 COC(=O)CSc1ccccc1C=O 62a_100000210073_100000747449 [1,1,0,0,0,0|0,1,0]=3 2095 B14R1.863 COC(=O)CSc1ccccc1C=O 62a_100000747449_100000210073 [1,1,0,0,0,0|0,1,0]=3 2096 B14R1.863 COC(=O)CSc1ccccc1CN 62a_100000689332_100000747449 [1,1,0,0,0,0|0,1,1]=4 2097 B14R1.863 COC(=O)CSc1ccccc1CN 62a_100000747449_100000689332 [1,1,0,0,0,0|0,1,1]=4 2098 B14R1.863 COC(=O)CSc1ccccc1NN 62a_100000241748_100000747449 [1,1,0,0,0,0|1,1,0]=4 2099 B14R1.863 COC(=O)CSc1ccccc1NN 62a_100000747449_100000241748 [1,1,0,0,0,0|1,1,0]=4 2100 B14R1.863 COC(=O)CSc1cccnc1C=O 62a_100000747449_100011934733 [1,1,0,0,0,0|1,1,0]=4 2101 B14R1.863 COC(=O)CSc1cccnc1C=O 62a_100011934733_100000747449 [1,1,0,0,0,0|1,1,0]=4 2102 B14R1.863 COC(=O)CSc1ccncc1C=O 62a_100000050567_100000747449 [1,1,0,0,0,0|1,1,0]=4 2103 B14R1.863 COC(=O)CSc1ccncc1C=O 62a_100000747449_100000050567 [1,1,0,0,0,0|1,1,0]=4 2104 B14R1.863 COC(=O)CSc1cnccc1C=O 62a_100000747449_100011934409 [1,1,0,0,0,0|1,1,0]=4 2105 B14R1.863 COC(=O)CSc1cnccc1C=O 62a_100011934409_100000747449 [1,1,0,0,0,0|1,1,0]=4 2106 B14R1.863 COC(=O)CSc1ncccc1C=O 62a_100000747449_100009816751 [1,1,0,0,0,0|1,1,0]=4 2107 B14R1.863 COC(=O)CSc1ncccc1C=O 62a_100009816751_100000747449 [1,1,0,0,0,0|1,1,0]=4 2108 B14R1.863 O=Cc1ccccc1CCC(=O)CO 1458a_100000210174_100010186698 [1,1,0,0,0,0|1,0,0]=3 2109 B14R1.1600 C=Cc1cc(ccc1OCC(=O)N)C 271570a_100011290941_200000148664 [1,1,0,0,0,0|2,0,0]=4 2110 B14R1.1600 Cc1ccc(c(c1)C=O)SCC(=O)N 62a_100000747473_100011551863 [1,1,0,0,0,0|1,1,0]=4 2111 B14R1.1600 Cc1ccc(c(c1)C=O)SCC(=O)N 62a_100011551863_100000747473 [1,1,0,0,0,0|1,1,0]=4 2112 B14R1.1600 Cc1ccc(c(c1)C=O)SCC(=O)[O-] 62a_100011551863_100020667443 [1,1,0,0,0,0|0,1,1]=4 2113 B14R1.1600 Cc1ccc(c(c1)C=O)SCC(=O)[O-] 62a_100020667443_100011551863 [1,1,0,0,0,0|0,1,1]=4 2114 B14R1.1600 NC(=O)CSc1ccc(cc1C=O)Br 62a_100000747473_100010185651 [1,1,0,0,0,0|1,1,0]=4 2115 B14R1.1600 NC(=O)CSc1ccc(cc1C=O)Br 62a_100010185651_100000747473 [1,1,0,0,0,0|1,1,0]=4 2116 B14R1.1600 NC(=O)CSc1ccc(cc1C=O)Cl 62a_100000747473_100010254386 [1,1,0,0,0,0|1,1,0]=4 2117 B14R1.1600 NC(=O)CSc1ccc(cc1C=O)Cl 62a_100010254386_100000747473 [1,1,0,0,0,0|1,1,0]=4 2118 B14R1.1600 NC(=O)CSc1ccc(cc1C=O)F 62a_100000747473_100011218309 [1,1,0,0,0,0|1,1,0]=4 2119 B14R1.1600 NC(=O)CSc1ccc(cc1C=O)F 62a_100011218309_100000747473 [1,1,0,0,0,0|1,1,0]=4 2120 B14R1.1600 NC(=O)CSc1ccc(cc1C=O)O 62a_100000690577_100000747473 [1,1,0,0,0,0|1,1,0]=4 2121 B14R1.1600 NC(=O)CSc1ccc(cc1C=O)O 62a_100000747473_100000690577 [1,1,0,0,0,0|1,1,0]=4 2122 B14R1.1600 NCc1cc(ccc1OCC(=O)N)Br 34a_100000730032_100000187820 [1,1,0,0,0,0|1,0,1]=4 2123 B14R1.1600 NCc1cc(ccc1OCC(=O)N)Cl 34a_100000238540_100000187820 [1,1,0,0,0,0|1,0,1]=4 2124 B14R1.1600 NCc1cc(ccc1OCC(=O)[O-])Br 34a_100000730032_100020667443 [1,1,0,0,0,0|0,0,2]=4 2125 B14R1.1600 NCc1cc(ccc1OCC(=O)[O-])Cl 34a_100000238540_100020667443 [1,1,0,0,0,0|0,0,2]=4 2126 B14R1.1600 O=Cc1cc(ccc1SCC(=O)[O-])Br 62a_100010185651_100020667443 [1,1,0,0,0,0|0,1,1]=4 2127 B14R1.1600 O=Cc1cc(ccc1SCC(=O)[O-])Br 62a_100020667443_100010185651 [1,1,0,0,0,0|0,1,1]=4 2128 B14R1.1600 O=Cc1cc(ccc1SCC(=O)[O-])Cl 62a_100010254386_100020667443 [1,1,0,0,0,0|0,1,1]=4 2129 B14R1.1600 O=Cc1cc(ccc1SCC(=O)[O-])Cl 62a_100020667443_100010254386 [1,1,0,0,0,0|0,1,1]=4 2130 B14R1.1600 O=Cc1cc(ccc1SCC(=O)[O-])F 62a_100011218309_100020667443 [1,1,0,0,0,0|0,1,1]=4 2131 B14R1.1600 O=Cc1cc(ccc1SCC(=O)[O-])F 62a_100020667443_100011218309 [1,1,0,0,0,0|0,1,1]=4 2132 B14R1.1600 O=Cc1cc(ccc1SCC(=O)[O-])O 62a_100000690577_100020667443 [1,1,0,0,0,0|0,1,1]=4 2133 B14R1.1600 O=Cc1cc(ccc1SCC(=O)[O-])O 62a_100020667443_100000690577 [1,1,0,0,0,0|0,1,1]=4 2134 B14R1.1865 Cc1ccc(c(c1)SCC(=O)N)C=O 62a_100000747473_100011935181 [1,1,0,0,0,0|1,1,0]=4 2135 B14R1.1865 Cc1ccc(c(c1)SCC(=O)N)C=O 62a_100011935181_100000747473 [1,1,0,0,0,0|1,1,0]=4 2136 B14R1.1865 Cc1ccc(c(c1)SCC(=O)[O-])C=O 62a_100011935181_100020667443 [1,1,0,0,0,0|0,1,1]=4 2137 B14R1.1865 Cc1ccc(c(c1)SCC(=O)[O-])C=O 62a_100020667443_100011935181 [1,1,0,0,0,0|0,1,1]=4 2138 B14R1.1865 NC(=O)CSc1cc(ccc1C=O)Br 62a_100000747473_100010146562 [1,1,0,0,0,0|1,1,0]=4 2139 B14R1.1865 NC(=O)CSc1cc(ccc1C=O)Br 62a_100010146562_100000747473 [1,1,0,0,0,0|1,1,0]=4 2140 B14R1.1865 NC(=O)CSc1cc(ccc1C=O)F 62a_100000747473_100000752949 [1,1,0,0,0,0|1,1,0]=4 2141 B14R1.1865 NC(=O)CSc1cc(ccc1C=O)F 62a_100000752949_100000747473 [1,1,0,0,0,0|1,1,0]=4 2142 B14R1.1865 NC(=O)CSc1cc(ccc1C=O)O 62a_100000747473_100011236494 [1,1,0,0,0,0|1,1,0]=4 2143 B14R1.1865 NC(=O)CSc1cc(ccc1C=O)O 62a_100011236494_100000747473 [1,1,0,0,0,0|1,1,0]=4 2144 B14R1.1865 O=Cc1ccc(cc1SCC(=O)[O-])Br 62a_100010146562_100020667443 [1,1,0,0,0,0|0,1,1]=4 2145 B14R1.1865 O=Cc1ccc(cc1SCC(=O)[O-])Br 62a_100020667443_100010146562 [1,1,0,0,0,0|0,1,1]=4 2146 B14R1.1865 O=Cc1ccc(cc1SCC(=O)[O-])F 62a_100000752949_100020667443 [1,1,0,0,0,0|0,1,1]=4 2147 B14R1.1865 O=Cc1ccc(cc1SCC(=O)[O-])F 62a_100020667443_100000752949 [1,1,0,0,0,0|0,1,1]=4 2148 B14R1.1865 O=Cc1ccc(cc1SCC(=O)[O-])O 62a_100011236494_100020667443 [1,1,0,0,0,0|0,1,1]=4 2149 B14R1.1865 O=Cc1ccc(cc1SCC(=O)[O-])O 62a_100020667443_100011236494 [1,1,0,0,0,0|0,1,1]=4 2150 B14R1.2172 Cc1cccc(c1OCC(=O)N)CN 34a_100020639391_100000187820 [1,1,0,0,0,0|1,0,1]=4 2151 B14R1.2172 Cc1cccc(c1OCC(=O)[O-])CN 34a_100020639391_100020667443 [1,1,0,0,0,0|0,0,2]=4 2152 B14R1.2172 Cc1cccc(c1SCC(=O)N)C=O 62a_100000747473_100012186367 [1,1,0,0,0,0|1,1,0]=4 2153 B14R1.2172 Cc1cccc(c1SCC(=O)N)C=O 62a_100012186367_100000747473 [1,1,0,0,0,0|1,1,0]=4 2154 B14R1.2172 Cc1cccc(c1SCC(=O)[O-])C=O 62a_100012186367_100020667443 [1,1,0,0,0,0|0,1,1]=4 2155 B14R1.2172 Cc1cccc(c1SCC(=O)[O-])C=O 62a_100020667443_100012186367 [1,1,0,0,0,0|0,1,1]=4 2156 B14R1.2172 NC(=O)CSc1c(cccc1C=O)F 62a_100000747473_100011934749 [1,1,0,0,0,0|1,1,0]=4 2157 B14R1.2172 NC(=O)CSc1c(cccc1C=O)F 62a_100011934749_100000747473 [1,1,0,0,0,0|1,1,0]=4 2158 B14R1.2172 NC(=O)CSc1c(cccc1C=O)O 62a_100000747473_100009816417 [1,1,0,0,0,0|1,1,0]=4 2159 B14R1.2172 NC(=O)CSc1c(cccc1C=O)O 62a_100009816417_100000747473 [1,1,0,0,0,0|1,1,0]=4 2160 B14R1.2172 O=Cc1cccc(c1SCC(=O)[O-])F 62a_100011934749_100020667443 [1,1,0,0,0,0|0,1,1]=4 2161 B14R1.2172 O=Cc1cccc(c1SCC(=O)[O-])F 62a_100020667443_100011934749 [1,1,0,0,0,0|0,1,1]=4 2162 B14R1.2172 O=Cc1cccc(c1SCC(=O)[O-])O 62a_100009816417_100020667443 [1,1,0,0,0,0|0,1,1]=4 2163 B14R1.2172 O=Cc1cccc(c1SCC(=O)[O-])O 62a_100020667443_100009816417 [1,1,0,0,0,0|0,1,1]=4 2164 B14R1.3135 C=Cc1ccccc1OC(C)C(=O)N 271570a_100011290941_100000148488 [1,1,0,0,0,0|2,0,0]=4 2165 B14R1.3135 CC(=O)C(C)Sc1ccccc1C=O 62a_100000210073_100009814033 [1,1,0,0,0,0|1,1,0]=4 2166 B14R1.3135 CC(=O)C(C)Sc1ccccc1C=O 62a_100009814033_100000210073 [1,1,0,0,0,0|1,1,0]=4 2167 B14R1.3135 CC(Oc1ccccc1CN)C(=O)N 34a_100000185550_100000702099 [1,1,0,0,0,0|1,0,1]=4 2168 B14R1.3135 CC(Sc1ccccc1C=O)C(=O)N 62a_100000210073_100000702099 [1,1,0,0,0,0|1,1,0]=4 2169 B14R1.3135 CC(Sc1ccccc1C=O)C(=O)N 62a_100000702099_100000210073 [1,1,0,0,0,0|1,1,0]=4 2170 B14R1.3135 NC(=O)C(F)Sc1ccccc1C=O 62a_100000210073_100009813875 [1,1,0,0,0,0|1,1,0]=4 2171 B14R1.3135 NC(=O)C(F)Sc1ccccc1C=O 62a_100009813875_100000210073 [1,1,0,0,0,0|1,1,0]=4 2172 B14R1.3135 NCc1ccccc1OC(F)C(=O)N 34a_100000185550_100009813875 [1,1,0,0,0,0|1,0,1]=4 2173 B14R1.3135 NCc1ccccc1OC(F)C(=O)[O-] 34a_100000185550_100020610796 [1,1,0,0,0,0|0,0,2]=4 2174 B14R1.3135 O=Cc1ccccc1SC(F)C(=O)[O-] 62a_100000210073_100020610796 [1,1,0,0,0,0|0,1,1]=4 2175 B14R1.3135 O=Cc1ccccc1SC(F)C(=O)[O-] 62a_100020610796_100000210073 [1,1,0,0,0,0|0,1,1]=4 2176 B14R1.67 C#CCOc1ccc(cc1C(=O)N)Br 34a_100000192807_100000184674 [1,1,0,0,0,0|1,0,1]=4 2177 B14R1.67 C#CCOc1ccc(cc1C(=O)N)Br 7a_100000192807_100000038162 [1,1,0,0,0,0|1,0,1]=4 2178 B14R1.67 C#CCOc1ccc(cc1C(=O)N)C 34a_200000192840_100000184674 [1,1,0,0,0,0|1,0,1]=4 2179 B14R1.67 C#CCOc1ccc(cc1C(=O)N)C 7a_200000192840_100000038162 [1,1,0,0,0,0|1,0,1]=4 2180 B14R1.67 C#CCOc1ccc(cc1C(=O)N)Cl 34a_100000185026_100000184674 [1,1,0,0,0,0|1,0,1]=4 2181 B14R1.67 C#CCOc1ccc(cc1C(=O)N)Cl 7a_100000185026_100000038162 [1,1,0,0,0,0|1,0,1]=4 2182 B14R1.67 C#CCOc1ccc(cc1C(=O)N)F 34a_100012186459_100000184674 [1,1,0,0,0,0|1,0,1]=4 2183 B14R1.67 C#CCOc1ccc(cc1C(=O)N)F 7a_100012186459_100000038162 [1,1,0,0,0,0|1,0,1]=4 2184 B14R1.67 C#CCOc1ccc(cc1C(=O)N)I 34a_100000192813_100000184674 [1,1,0,0,0,0|1,0,1]=4 2185 B14R1.67 C#CCOc1ccc(cc1C(=O)N)I 7a_100000192813_100000038162 [1,1,0,0,0,0|1,0,1]=4 2186 B14R1.67 C=CCNc1ccc(cc1C(=O)N)Br 27a_100020586998_200000162314 [1,1,0,0,0,0|2,0,0]=4 2187 B14R1.67 C=CCNc1ccc(cc1C(=O)N)Br 34a_100000740421_100015514636 [1,1,0,0,0,0|2,0,0]=4 2188 B14R1.67 C=CCNc1ccc(cc1C(=O)N)Br 7a_100000740421_100015514636 [1,1,0,0,0,0|2,0,0]=4 2189 B14R1.67 C=CCNc1ccc(cc1C(=O)N)C 34a_100011692829_100015514636 [1,1,0,0,0,0|2,0,0]=4 2190 B14R1.67 C=CCNc1ccc(cc1C(=O)N)Cl 34a_100000743835_100015514636 [1,1,0,0,0,0|2,0,0]=4 2191 B14R1.67 C=CCNc1ccc(cc1C(=O)N)Cl 7a_100000743835_100015514636 [1,1,0,0,0,0|2,0,0]=4 2192 B14R1.67 C=CCNc1ccc(cc1C(=O)N)F 34a_100000741173_100015514636 [1,1,0,0,0,0|2,0,0]=4 2193 B14R1.67 C=CCNc1ccc(cc1C(=O)N)F 7a_100000741173_100015514636 [1,1,0,0,0,0|2,0,0]=4 2194 B14R1.67 C=CCOc1ccc(cc1C(=O)C)Br 34a_100000212127_100015514636 [1,1,0,0,0,0|2,0,0]=4 2195 B14R1.67 C=CCOc1ccc(cc1C(=O)C)Br 7a_100000212127_100015514636 [1,1,0,0,0,0|2,0,0]=4 2196 B14R1.67 C=CCOc1ccc(cc1C(=O)C)C 34a_100000195442_100015514636 [1,1,0,0,0,0|2,0,0]=4 2197 B14R1.67 C=CCOc1ccc(cc1C(=O)C)C 7a_100000195442_100015514636 [1,1,0,0,0,0|2,0,0]=4 2198 B14R1.67 C=CCOc1ccc(cc1C(=O)C)Cl 34a_100000185566_100015514636 [1,1,0,0,0,0|2,0,0]=4 2199 B14R1.67 C=CCOc1ccc(cc1C(=O)C)Cl 7a_100000185566_100015514636 [1,1,0,0,0,0|2,0,0]=4 2200 B14R1.67 C=CCOc1ccc(cc1C(=O)C)F 7a_100000182812_100015514636 [1,1,0,0,0,0|2,0,0]=4 2201 B14R1.67 C=CCOc1ccc(cc1C(=O)C)I 7a_100010712555_100015514636 [1,1,0,0,0,0|2,0,0]=4 2202 B14R1.67 C=CCOc1ccc(cc1C(=O)C)N 34a_100011218865_100015514636 [1,1,0,0,0,0|2,0,0]=4 2203 B14R1.67 C=CCOc1ccc(cc1C(=O)N)Br 34a_100000192807_100015514636 [1,1,0,0,0,0|1,0,0]=3 2204 B14R1.67 C=CCOc1ccc(cc1C(=O)N)Br 7a_100000192807_100015514636 [1,1,0,0,0,0|1,0,0]=3 2205 B14R1.67 C=CCOc1ccc(cc1C(=O)N)C 34a_200000192840_100015514636 [1,1,0,0,0,0|1,0,0]=3 2206 B14R1.67 C=CCOc1ccc(cc1C(=O)N)C 7a_200000192840_100015514636 [1,1,0,0,0,0|1,0,0]=3 2207 B14R1.67 C=CCOc1ccc(cc1C(=O)N)Cl 34a_100000185026_100015514636 [1,1,0,0,0,0|1,0,0]=3 2208 B14R1.67 C=CCOc1ccc(cc1C(=O)N)Cl 7a_100000185026_100015514636 [1,1,0,0,0,0|1,0,0]=3 2209 B14R1.67 C=CCOc1ccc(cc1C(=O)N)F 34a_100012186459_100015514636 [1,1,0,0,0,0|1,0,0]=3 2210 B14R1.67 C=CCOc1ccc(cc1C(=O)N)F 7a_100012186459_100015514636 [1,1,0,0,0,0|1,0,0]=3 2211 B14R1.67 C=CCOc1ccc(cc1C(=O)N)I 34a_100000192813_100015514636 [1,1,0,0,0,0|1,0,0]=3 2212 B14R1.67 C=CCOc1ccc(cc1C(=O)N)I 7a_100000192813_100015514636 [1,1,0,0,0,0|1,0,0]=3 2213 B14R1.67 C=CCSc1ccc(cc1C(=O)N)Br 62a_200000162314_100000210623 [1,1,0,0,0,0|1,1,0]=4 2214 B14R1.67 C=CCSc1ccc(cc1C(=O)N)C 62a_100000210623_200012349609 [1,1,0,0,0,0|1,1,0]=4 2215 B14R1.67 C=CCSc1ccc(cc1C(=O)N)C 62a_200012349609_100000210623 [1,1,0,0,0,0|1,1,0]=4 2216 B14R1.67 C=CCSc1ccc(cc1C(=O)N)F 62a_100000206434_100000210623 [1,1,0,0,0,0|1,1,0]=4 2217 B14R1.67 C=CCSc1ccc(cc1C(=O)N)F 62a_100000210623_100000206434 [1,1,0,0,0,0|1,1,0]=4 2218 B14R1.67 C=CCSc1ccc(cc1C(=O)N)N 62a_100015186447_100000210623 [1,1,0,0,0,0|1,1,0]=4 2219 B14R1.67 CC(=O)c1cc(ccc1OCC=O)Br 34a_100000212127_200009817547 [1,1,0,0,0,0|1,0,0]=3 2220 B14R1.67 CC(=O)c1cc(ccc1OCC=O)Br 7a_100000212127_200015260668 [1,1,0,0,0,0|1,0,0]=3 2221 B14R1.67 CC(=O)c1cc(ccc1OCC=O)C 34a_100000195442_200009817547 [1,1,0,0,0,0|1,0,0]=3 2222 B14R1.67 CC(=O)c1cc(ccc1OCC=O)C 7a_100000195442_200015260668 [1,1,0,0,0,0|1,0,0]=3 2223 B14R1.67 CC(=O)c1cc(ccc1OCC=O)Cl 34a_100000185566_200009817547 [1,1,0,0,0,0|1,0,0]=3 2224 B14R1.67 CC(=O)c1cc(ccc1OCC=O)Cl 7a_100000185566_200015260668 [1,1,0,0,0,0|1,0,0]=3 2225 B14R1.67 CC(=O)c1cc(ccc1OCC=O)F 7a_100000182812_200015260668 [1,1,0,0,0,0|1,0,0]=3 2226 B14R1.67 CC(=O)c1cc(ccc1OCC=O)I 7a_100010712555_200015260668 [1,1,0,0,0,0|1,0,0]=3 2227 B14R1.67 CC(=O)c1cc(ccc1OCC=O)N 34a_100011218865_200009817547 [1,1,0,0,0,0|1,0,0]=3 2228 B14R1.67 CC(=O)c1cc(ccc1OCCO)Br 34a_100000212127_100000211926 [1,1,0,0,0,0|1,0,1]=4 2229 B14R1.67 CC(=O)c1cc(ccc1OCCO)Br 7a_100000212127_100000211926 [1,1,0,0,0,0|1,0,1]=4 2230 B14R1.67 CC(=O)c1cc(ccc1OCCO)C 34a_100000195442_100000211926 [1,1,0,0,0,0|1,0,1]=4 2231 B14R1.67 CC(=O)c1cc(ccc1OCCO)C 7a_100000195442_100000211926 [1,1,0,0,0,0|1,0,1]=4 2232 B14R1.67 CC(=O)c1cc(ccc1OCCO)Cl 34a_100000185566_100000211926 [1,1,0,0,0,0|1,0,1]=4 2233 B14R1.67 CC(=O)c1cc(ccc1OCCO)Cl 7a_100000185566_100000211926 [1,1,0,0,0,0|1,0,1]=4 2234 B14R1.67 CC(=O)c1cc(ccc1OCCO)F 7a_100000182812_100000211926 [1,1,0,0,0,0|1,0,1]=4 2235 B14R1.67 CC(=O)c1cc(ccc1OCCO)I 7a_100010712555_100000211926 [1,1,0,0,0,0|1,0,1]=4 2236 B14R1.67 CC(=O)c1cc(ccc1OCCO)N 34a_100011218865_100000211926 [1,1,0,0,0,0|1,0,1]=4 2237 B14R1.67 CC(=O)c1cc(ccc1SCC=O)Br 62a_100012349576_200015260668 [1,1,0,0,0,0|1,1,0]=4 2238 B14R1.67 CC(=O)c1cc(ccc1SCC=O)C 62a_100012361225_200015260668 [1,1,0,0,0,0|1,1,0]=4 2239 B14R1.67 CC(=O)c1cc(ccc1SCC=O)C 62a_200015260668_100012361225 [1,1,0,0,0,0|1,1,0]=4 2240 B14R1.67 CC(=O)c1cc(ccc1SCC=O)F 62a_100012353695_200015260668 [1,1,0,0,0,0|1,1,0]=4 2241 B14R1.67 CC(=O)c1cc(ccc1SCC=O)F 62a_200015260668_100010200798 [1,1,0,0,0,0|1,1,0]=4 2242 B14R1.67 CC(=O)c1cc(ccc1SCC=O)N 62a_100012349454_200015260668 [1,1,0,0,0,0|1,1,0]=4 2243 B14R1.67 CCCOc1ccc(cc1C(=O)N)Br 34a_100000192807_100000210303 [1,1,0,0,0,0|1,0,1]=4 2244 B14R1.67 CCCOc1ccc(cc1C(=O)N)Br 7a_100000192807_100000210303 [1,1,0,0,0,0|1,0,1]=4 2245 B14R1.67 CCCOc1ccc(cc1C(=O)N)C 34a_200000192840_100000210303 [1,1,0,0,0,0|1,0,1]=4 2246 B14R1.67 CCCOc1ccc(cc1C(=O)N)C 7a_200000192840_100000210303 [1,1,0,0,0,0|1,0,1]=4 2247 B14R1.67 CCCOc1ccc(cc1C(=O)N)Cl 34a_100000185026_100000210303 [1,1,0,0,0,0|1,0,1]=4 2248 B14R1.67 CCCOc1ccc(cc1C(=O)N)Cl 7a_100000185026_100000210303 [1,1,0,0,0,0|1,0,1]=4 2249 B14R1.67 CCCOc1ccc(cc1C(=O)N)F 34a_100012186459_100000210303 [1,1,0,0,0,0|1,0,1]=4 2250 B14R1.67 CCCOc1ccc(cc1C(=O)N)F 7a_100012186459_100000210303 [1,1,0,0,0,0|1,0,1]=4 2251 B14R1.67 CCCOc1ccc(cc1C(=O)N)I 34a_100000192813_100000210303 [1,1,0,0,0,0|1,0,1]=4 2252 B14R1.67 CCCOc1ccc(cc1C(=O)N)I 7a_100000192813_100000210303 [1,1,0,0,0,0|1,0,1]=4 2253 B14R1.67 CSCOc1ccc(cc1C(=O)N)Br 34a_100000192807_100011218213 [1,1,0,0,0,0|2,0,0]=4 2254 B14R1.67 CSCOc1ccc(cc1C(=O)N)C 34a_200000192840_100011218213 [1,1,0,0,0,0|2,0,0]=4 2255 B14R1.67 CSCOc1ccc(cc1C(=O)N)Cl 34a_100000185026_100011218213 [1,1,0,0,0,0|2,0,0]=4 2256 B14R1.67 CSCOc1ccc(cc1C(=O)N)F 34a_100012186459_100011218213 [1,1,0,0,0,0|2,0,0]=4 2257 B14R1.67 CSCOc1ccc(cc1C(=O)N)I 34a_100000192813_100011218213 [1,1,0,0,0,0|2,0,0]=4 2258 B14R1.67 C[C@@H](N)c1cc(ccc1OCC=O)Cl 34a_100011853016_200009817547 [1,1,0,0,0,0|1,0,1]=4 2259 B14R1.67 C[C@@H](N)c1cc(ccc1OCC=O)Cl 7a_100011853016_200015260668 [1,1,0,0,0,0|1,0,1]=4 2260 B14R1.67 C[C@H](N)c1cc(ccc1OCC=O)F 34a_100160469477_200009817547 [1,1,0,0,0,0|1,0,1]=4 2261 B14R1.67 C[C@H](N)c1cc(ccc1OCC=O)F 7a_100160469477_200015260668 [1,1,0,0,0,0|1,0,1]=4 2262 B14R1.67 Cc1ccc(c(c1)C(=O)N)NCC=O 34a_100011692829_200009817547 [1,1,0,0,0,0|1,0,0]=3 2263 B14R1.67 Cc1ccc(c(c1)C(=O)N)NCCO 34a_100011692829_100000211926 [1,1,0,0,0,0|1,0,1]=4 2264 B14R1.67 Cc1ccc(c(c1)C(=O)N)OCC#N 7a_200000192840_100011215382 [1,1,0,0,0,0|1,0,1]=4 2265 B14R1.67 Cc1ccc(c(c1)C(=O)N)OCC=O 34a_200000192840_200009817547 [1,1,0,0,0,0|0,0,0]=2 2266 B14R1.67 Cc1ccc(c(c1)C(=O)N)OCC=O 7a_200000192840_200015260668 [1,1,0,0,0,0|0,0,0]=2 2267 B14R1.67 Cc1ccc(c(c1)C(=O)N)OCCF 34a_200000192840_100011217306 [1,1,0,0,0,0|1,0,1]=4 2268 B14R1.67 Cc1ccc(c(c1)C(=O)N)OCCF 7a_200000192840_100011217306 [1,1,0,0,0,0|1,0,1]=4 2269 B14R1.67 Cc1ccc(c(c1)C(=O)N)OCCO 34a_200000192840_100000211926 [1,1,0,0,0,0|0,0,1]=3 2270 B14R1.67 Cc1ccc(c(c1)C(=O)N)OCCO 7a_200000192840_100000211926 [1,1,0,0,0,0|0,0,1]=3 2271 B14R1.67 Cc1ccc(c(c1)C(=O)N)SCC=O 62a_200012349609_200015260668 [1,1,0,0,0,0|0,1,0]=3 2272 B14R1.67 Cc1ccc(c(c1)C(=O)N)SCC=O 62a_200015260668_200012349609 [1,1,0,0,0,0|0,1,0]=3 2273 B14R1.67 Cc1ccc(c(c1)C(=O)N)SCCO 62a_100000211926_200012349609 [1,1,0,0,0,0|0,1,1]=4 2274 B14R1.67 Cc1ccc(c(c1)C(=O)N)SCCO 62a_200012349609_100000211926 [1,1,0,0,0,0|0,1,1]=4 2275 B14R1.67 Cc1ccc(c(c1)[N+](=O)[O-])OCC=O 34a_100000195567_200009817547 [1,1,0,0,0,0|2,0,0]=4 2276 B14R1.67 Cc1ccc(c(c1)[N+](=O)[O-])OCC=O 7a_100000195567_200015260668 [1,1,0,0,0,0|2,0,0]=4 2277 B14R1.67 N#CCOc1ccc(cc1C(=O)N)Br 7a_100000192807_100011215382 [1,1,0,0,0,0|1,0,1]=4 2278 B14R1.67 N#CCOc1ccc(cc1C(=O)N)Cl 7a_100000185026_100011215382 [1,1,0,0,0,0|1,0,1]=4 2279 B14R1.67 N#CCOc1ccc(cc1C(=O)N)F 7a_100012186459_100011215382 [1,1,0,0,0,0|1,0,1]=4 2280 B14R1.67 N#CCOc1ccc(cc1C(=O)N)I 7a_100000192813_100011215382 [1,1,0,0,0,0|1,0,1]=4 2281 B14R1.67 NC(=O)c1cc(ccc1NCC=O)Br 34a_100000740421_200009817547 [1,1,0,0,0,0|1,0,0]=3 2282 B14R1.67 NC(=O)c1cc(ccc1NCC=O)Br 7a_100000740421_200015260668 [1,1,0,0,0,0|1,0,0]=3 2283 B14R1.67 NC(=O)c1cc(ccc1NCC=O)Cl 34a_100000743835_200009817547 [1,1,0,0,0,0|1,0,0]=3 2284 B14R1.67 NC(=O)c1cc(ccc1NCC=O)Cl 7a_100000743835_200015260668 [1,1,0,0,0,0|1,0,0]=3 2285 B14R1.67 NC(=O)c1cc(ccc1NCC=O)F 34a_100000741173_200009817547 [1,1,0,0,0,0|1,0,0]=3 2286 B14R1.67 NC(=O)c1cc(ccc1NCC=O)F 7a_100000741173_200015260668 [1,1,0,0,0,0|1,0,0]=3 2287 B14R1.67 NC(=O)c1cc(ccc1NCCO)Br 27a_100000210304_200000162314 [1,1,0,0,0,0|1,0,1]=4 2288 B14R1.67 NC(=O)c1cc(ccc1NCCO)Br 34a_100000740421_100000211926 [1,1,0,0,0,0|1,0,1]=4 2289 B14R1.67 NC(=O)c1cc(ccc1NCCO)Br 7a_100000740421_100000211926 [1,1,0,0,0,0|1,0,1]=4 2290 B14R1.67 NC(=O)c1cc(ccc1NCCO)Cl 34a_100000743835_100000211926 [1,1,0,0,0,0|1,0,1]=4 2291 B14R1.67 NC(=O)c1cc(ccc1NCCO)Cl 7a_100000743835_100000211926 [1,1,0,0,0,0|1,0,1]=4 2292 B14R1.67 NC(=O)c1cc(ccc1NCCO)F 34a_100000741173_100000211926 [1,1,0,0,0,0|1,0,1]=4 2293 B14R1.67 NC(=O)c1cc(ccc1NCCO)F 7a_100000741173_100000211926 [1,1,0,0,0,0|1,0,1]=4 2294 B14R1.67 NC(=O)c1cc(ccc1OCC=O)Br 34a_100000192807_200009817547 [1,1,0,0,0,0|0,0,0]=2 2295 B14R1.67 NC(=O)c1cc(ccc1OCC=O)Br 7a_100000192807_200015260668 [1,1,0,0,0,0|0,0,0]=2 2296 B14R1.67 NC(=O)c1cc(ccc1OCC=O)Cl 34a_100000185026_200009817547 [1,1,0,0,0,0|0,0,0]=2 2297 B14R1.67 NC(=O)c1cc(ccc1OCC=O)Cl 7a_100000185026_200015260668 [1,1,0,0,0,0|0,0,0]=2 2298 B14R1.67 NC(=O)c1cc(ccc1OCC=O)F 34a_100012186459_200009817547 [1,1,0,0,0,0|0,0,0]=2 2299 B14R1.67 NC(=O)c1cc(ccc1OCC=O)F 7a_100012186459_200015260668 [1,1,0,0,0,0|0,0,0]=2 2300 B14R1.67 NC(=O)c1cc(ccc1OCC=O)I 34a_100000192813_200009817547 [1,1,0,0,0,0|0,0,0]=2 2301 B14R1.67 NC(=O)c1cc(ccc1OCC=O)I 7a_100000192813_200015260668 [1,1,0,0,0,0|0,0,0]=2 2302 B14R1.67 NC(=O)c1cc(ccc1OCCF)Br 34a_100000192807_100011217306 [1,1,0,0,0,0|1,0,1]=4 2303 B14R1.67 NC(=O)c1cc(ccc1OCCF)Br 7a_100000192807_100011217306 [1,1,0,0,0,0|1,0,1]=4 2304 B14R1.67 NC(=O)c1cc(ccc1OCCF)Cl 34a_100000185026_100011217306 [1,1,0,0,0,0|1,0,1]=4 2305 B14R1.67 NC(=O)c1cc(ccc1OCCF)Cl 7a_100000185026_100011217306 [1,1,0,0,0,0|1,0,1]=4 2306 B14R1.67 NC(=O)c1cc(ccc1OCCF)F 34a_100012186459_100011217306 [1,1,0,0,0,0|1,0,1]=4 2307 B14R1.67 NC(=O)c1cc(ccc1OCCF)F 7a_100012186459_100011217306 [1,1,0,0,0,0|1,0,1]=4 2308 B14R1.67 NC(=O)c1cc(ccc1OCCF)I 34a_100000192813_100011217306 [1,1,0,0,0,0|1,0,1]=4 2309 B14R1.67 NC(=O)c1cc(ccc1OCCF)I 7a_100000192813_100011217306 [1,1,0,0,0,0|1,0,1]=4 2310 B14R1.67 NC(=O)c1cc(ccc1OCCO)Br 34a_100000192807_100000211926 [1,1,0,0,0,0|0,0,1]=3 2311 B14R1.67 NC(=O)c1cc(ccc1OCCO)Br 7a_100000192807_100000211926 [1,1,0,0,0,0|0,0,1]=3 2312 B14R1.67 NC(=O)c1cc(ccc1OCCO)Cl 34a_100000185026_100000211926 [1,1,0,0,0,0|0,0,1]=3 2313 B14R1.67 NC(=O)c1cc(ccc1OCCO)Cl 7a_100000185026_100000211926 [1,1,0,0,0,0|0,0,1]=3 2314 B14R1.67 NC(=O)c1cc(ccc1OCCO)F 34a_100012186459_100000211926 [1,1,0,0,0,0|0,0,1]=3 2315 B14R1.67 NC(=O)c1cc(ccc1OCCO)F 7a_100012186459_100000211926 [1,1,0,0,0,0|0,0,1]=3 2316 B14R1.67 NC(=O)c1cc(ccc1OCCO)I 34a_100000192813_100000211926 [1,1,0,0,0,0|0,0,1]=3 2317 B14R1.67 NC(=O)c1cc(ccc1OCCO)I 7a_100000192813_100000211926 [1,1,0,0,0,0|0,0,1]=3 2318 B14R1.67 NC(=O)c1cc(ccc1SCC=O)Br 62a_200000162314_200015260668 [1,1,0,0,0,0|0,1,0]=3 2319 B14R1.67 NC(=O)c1cc(ccc1SCC=O)F 62a_100000206434_200015260668 [1,1,0,0,0,0|0,1,0]=3 2320 B14R1.67 NC(=O)c1cc(ccc1SCC=O)F 62a_200015260668_100000206434 [1,1,0,0,0,0|0,1,0]=3 2321 B14R1.67 NC(=O)c1cc(ccc1SCC=O)N 62a_100015186447_200015260668 [1,1,0,0,0,0|0,1,0]=3 2322 B14R1.67 NC(=O)c1cc(ccc1SCCO)Br 62a_200000162314_100000211926 [1,1,0,0,0,0|0,1,1]=4 2323 B14R1.67 NC(=O)c1cc(ccc1SCCO)F 62a_100000206434_100000211926 [1,1,0,0,0,0|0,1,1]=4 2324 B14R1.67 NC(=O)c1cc(ccc1SCCO)F 62a_100000211926_100000206434 [1,1,0,0,0,0|0,1,1]=4 2325 B14R1.67 NC(=O)c1cc(ccc1SCCO)N 62a_100015186447_100000211926 [1,1,0,0,0,0|0,1,1]=4 2326 B14R1.67 NC(=O)c1cc(cnc1SCC=O)F 62a_100012183597_200015260668 [1,1,0,0,0,0|1,1,0]=4 2327 B14R1.67 NC(=O)c1cc(cnc1SCC=O)F 62a_200015260668_100012183597 [1,1,0,0,0,0|1,1,0]=4 2328 B14R1.67 Nc1ccc(c(c1)[N+](=O)[O-])OCC=O 34a_100000032192_200009817547 [1,1,0,0,0,0|2,0,0]=4 2329 B14R1.67 Nc1ccc(c(c1)[N+](=O)[O-])OCC=O 7a_100000032192_200015260668 [1,1,0,0,0,0|2,0,0]=4 2330 B14R1.67 O=CCOc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_200009817547 [1,1,0,0,0,0|2,0,0]=4 2331 B14R1.67 O=CCOc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_200015260668 [1,1,0,0,0,0|2,0,0]=4 2332 B14R1.67 O=CCOc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_200009817547 [1,1,0,0,0,0|2,0,0]=4 2333 B14R1.67 O=CCOc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_200015260668 [1,1,0,0,0,0|2,0,0]=4 2334 B14R1.67 O=CCOc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_200009817547 [1,1,0,0,0,0|2,0,0]=4 2335 B14R1.67 O=CCOc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_200015260668 [1,1,0,0,0,0|2,0,0]=4 2336 B14R1.67 O=CCOc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_200015260668 [1,1,0,0,0,0|2,0,0]=4 2337 B14R1.67 O=CCSc1ccc(cc1C(=O)O)Br 62a_100011072988_200015260668 [1,1,0,0,0,0|1,1,0]=4 2338 B14R1.623 C=CCN(C)c1ccccc1C(=O)N 269982a_100000184419_100000210623 [1,1,0,0,0,0|2,0,0]=4 2339 B14R1.623 CN(CC=O)c1ccccc1C(=O)N 269982a_100000184419_200015260668 [1,1,0,0,0,0|1,0,0]=3 2340 B14R1.623 CN(CCO)c1ccccc1C(=O)N 269982a_100000184419_100000211926 [1,1,0,0,0,0|1,0,1]=4 2341 B14R1.760 C#CCOc1cc(ccc1C(=O)N)Br 34a_100011550861_100000184674 [1,1,0,0,0,0|1,0,1]=4 2342 B14R1.760 C#CCOc1cc(ccc1C(=O)N)Br 7a_100011550861_100000038162 [1,1,0,0,0,0|1,0,1]=4 2343 B14R1.760 C#CCOc1cc(ccc1C(=O)N)C 34a_100000192831_100000184674 [1,1,0,0,0,0|1,0,1]=4 2344 B14R1.760 C#CCOc1cc(ccc1C(=O)N)C 7a_100000192831_100000038162 [1,1,0,0,0,0|1,0,1]=4 2345 B14R1.760 C#CCOc1cc(ccc1C(=O)N)Cl 34a_100000192836_100000184674 [1,1,0,0,0,0|1,0,1]=4 2346 B14R1.760 C#CCOc1cc(ccc1C(=O)N)Cl 7a_100000192836_100000038162 [1,1,0,0,0,0|1,0,1]=4 2347 B14R1.760 C#CCOc1cc(ccc1C(=O)N)N 34a_100000223280_100000184674 [1,1,0,0,0,0|1,0,1]=4 2348 B14R1.760 C#CCOc1cc(ccc1C(=O)N)N 7a_100000223280_100000038162 [1,1,0,0,0,0|1,0,1]=4 2349 B14R1.760 C=CCNc1cc(ccc1C(=O)N)Br 27a_100020586998_100009815748 [1,1,0,0,0,0|2,0,0]=4 2350 B14R1.760 C=CCNc1cc(ccc1C(=O)N)Br 7a_100012349972_100015514636 [1,1,0,0,0,0|2,0,0]=4 2351 B14R1.760 C=CCNc1cc(ccc1C(=O)N)C 34a_100011219537_100015514636 [1,1,0,0,0,0|2,0,0]=4 2352 B14R1.760 C=CCNc1cc(ccc1C(=O)N)C 7a_100011219537_100015514636 [1,1,0,0,0,0|2,0,0]=4 2353 B14R1.760 C=CCNc1cc(ccc1C(=O)N)Cl 34a_100000738103_100015514636 [1,1,0,0,0,0|2,0,0]=4 2354 B14R1.760 C=CCNc1cc(ccc1C(=O)N)Cl 7a_100000738103_100015514636 [1,1,0,0,0,0|2,0,0]=4 2355 B14R1.760 C=CCNc1cc(ccc1C(=O)N)F 27a_100020586998_100000206404 [1,1,0,0,0,0|2,0,0]=4 2356 B14R1.760 C=CCNc1cc(ccc1C(=O)N)F 34a_100011298637_100015514636 [1,1,0,0,0,0|2,0,0]=4 2357 B14R1.760 C=CCOc1cc(ccc1C(=O)C)Br 7a_100000188348_100015514636 [1,1,0,0,0,0|2,0,0]=4 2358 B14R1.760 C=CCOc1cc(ccc1C(=O)C)C 34a_100000234885_100015514636 [1,1,0,0,0,0|2,0,0]=4 2359 B14R1.760 C=CCOc1cc(ccc1C(=O)C)C 7a_100000234885_100015514636 [1,1,0,0,0,0|2,0,0]=4 2360 B14R1.760 C=CCOc1cc(ccc1C(=O)C)Cl 34a_100000061402_100015514636 [1,1,0,0,0,0|2,0,0]=4 2361 B14R1.760 C=CCOc1cc(ccc1C(=O)C)Cl 7a_100000061402_100015514636 [1,1,0,0,0,0|2,0,0]=4 2362 B14R1.760 C=CCOc1cc(ccc1C(=O)C)F 7a_100011215782_100015514636 [1,1,0,0,0,0|2,0,0]=4 2363 B14R1.760 C=CCOc1cc(ccc1C(=O)N)Br 34a_100011550861_100015514636 [1,1,0,0,0,0|1,0,0]=3 2364 B14R1.760 C=CCOc1cc(ccc1C(=O)N)Br 7a_100011550861_100015514636 [1,1,0,0,0,0|1,0,0]=3 2365 B14R1.760 C=CCOc1cc(ccc1C(=O)N)C 34a_100000192831_100015514636 [1,1,0,0,0,0|1,0,0]=3 2366 B14R1.760 C=CCOc1cc(ccc1C(=O)N)C 7a_100000192831_100015514636 [1,1,0,0,0,0|1,0,0]=3 2367 B14R1.760 C=CCOc1cc(ccc1C(=O)N)Cl 34a_100000192836_100015514636 [1,1,0,0,0,0|1,0,0]=3 2368 B14R1.760 C=CCOc1cc(ccc1C(=O)N)Cl 7a_100000192836_100015514636 [1,1,0,0,0,0|1,0,0]=3 2369 B14R1.760 C=CCOc1cc(ccc1C(=O)N)N 34a_100000223280_100015514636 [1,1,0,0,0,0|1,0,0]=3 2370 B14R1.760 C=CCOc1cc(ccc1C(=O)N)N 7a_100000223280_100015514636 [1,1,0,0,0,0|1,0,0]=3 2371 B14R1.760 C=CCSc1cc(ccc1C(=O)N)Br 62a_100009815748_100000210623 [1,1,0,0,0,0|1,1,0]=4 2372 B14R1.760 C=CCSc1cc(ccc1C(=O)N)F 62a_100000206404_100000210623 [1,1,0,0,0,0|1,1,0]=4 2373 B14R1.760 C=CCSc1cc(ccc1C(=O)N)F 62a_100000210623_100000206404 [1,1,0,0,0,0|1,1,0]=4 2374 B14R1.760 CC(=O)c1ccc(cc1OCC=O)Br 7a_100000188348_200015260668 [1,1,0,0,0,0|1,0,0]=3 2375 B14R1.760 CC(=O)c1ccc(cc1OCC=O)C 34a_100000234885_200009817547 [1,1,0,0,0,0|1,0,0]=3 2376 B14R1.760 CC(=O)c1ccc(cc1OCC=O)C 7a_100000234885_200015260668 [1,1,0,0,0,0|1,0,0]=3 2377 B14R1.760 CC(=O)c1ccc(cc1OCC=O)Cl 34a_100000061402_200009817547 [1,1,0,0,0,0|1,0,0]=3 2378 B14R1.760 CC(=O)c1ccc(cc1OCC=O)Cl 7a_100000061402_200015260668 [1,1,0,0,0,0|1,0,0]=3 2379 B14R1.760 CC(=O)c1ccc(cc1OCC=O)F 7a_100011215782_200015260668 [1,1,0,0,0,0|1,0,0]=3 2380 B14R1.760 CC(=O)c1ccc(cc1OCCO)Br 7a_100000188348_100000211926 [1,1,0,0,0,0|1,0,1]=4 2381 B14R1.760 CC(=O)c1ccc(cc1OCCO)C 34a_100000234885_100000211926 [1,1,0,0,0,0|1,0,1]=4 2382 B14R1.760 CC(=O)c1ccc(cc1OCCO)C 7a_100000234885_100000211926 [1,1,0,0,0,0|1,0,1]=4 2383 B14R1.760 CC(=O)c1ccc(cc1OCCO)Cl 34a_100000061402_100000211926 [1,1,0,0,0,0|1,0,1]=4 2384 B14R1.760 CC(=O)c1ccc(cc1OCCO)Cl 7a_100000061402_100000211926 [1,1,0,0,0,0|1,0,1]=4 2385 B14R1.760 CC(=O)c1ccc(cc1OCCO)F 7a_100011215782_100000211926 [1,1,0,0,0,0|1,0,1]=4 2386 B14R1.760 CC(=O)c1ccc(cc1SCC=O)C 62a_100012353930_200015260668 [1,1,0,0,0,0|1,1,0]=4 2387 B14R1.760 CC(=O)c1ccc(cc1SCC=O)C 62a_200015260668_100012353930 [1,1,0,0,0,0|1,1,0]=4 2388 B14R1.760 CC(=O)c1ccc(cc1SCC=O)F 62a_100000686192_200015260668 [1,1,0,0,0,0|1,1,0]=4 2389 B14R1.760 CC(=O)c1ccc(cc1SCC=O)O 62a_100012340537_200015260668 [1,1,0,0,0,0|1,1,0]=4 2390 B14R1.760 CCCOc1cc(ccc1C(=O)N)Br 34a_100011550861_100000210303 [1,1,0,0,0,0|1,0,1]=4 2391 B14R1.760 CCCOc1cc(ccc1C(=O)N)Br 7a_100011550861_100000210303 [1,1,0,0,0,0|1,0,1]=4 2392 B14R1.760 CCCOc1cc(ccc1C(=O)N)C 34a_100000192831_100000210303 [1,1,0,0,0,0|1,0,1]=4 2393 B14R1.760 CCCOc1cc(ccc1C(=O)N)C 7a_100000192831_100000210303 [1,1,0,0,0,0|1,0,1]=4 2394 B14R1.760 CCCOc1cc(ccc1C(=O)N)Cl 34a_100000192836_100000210303 [1,1,0,0,0,0|1,0,1]=4 2395 B14R1.760 CCCOc1cc(ccc1C(=O)N)Cl 7a_100000192836_100000210303 [1,1,0,0,0,0|1,0,1]=4 2396 B14R1.760 CCCOc1cc(ccc1C(=O)N)N 34a_100000223280_100000210303 [1,1,0,0,0,0|1,0,1]=4 2397 B14R1.760 CCCOc1cc(ccc1C(=O)N)N 7a_100000223280_100000210303 [1,1,0,0,0,0|1,0,1]=4 2398 B14R1.760 CSCOc1cc(ccc1C(=O)N)Br 34a_100011550861_100011218213 [1,1,0,0,0,0|2,0,0]=4 2399 B14R1.760 CSCOc1cc(ccc1C(=O)N)C 34a_100000192831_100011218213 [1,1,0,0,0,0|2,0,0]=4 2400 B14R1.760 CSCOc1cc(ccc1C(=O)N)Cl 34a_100000192836_100011218213 [1,1,0,0,0,0|2,0,0]=4 2401 B14R1.760 CSCOc1cc(ccc1C(=O)N)N 34a_100000223280_100011218213 [1,1,0,0,0,0|2,0,0]=4 2402 B14R1.760 Cc1ccc(c(c1)NCC=O)C(=O)N 34a_100011219537_200009817547 [1,1,0,0,0,0|1,0,0]=3 2403 B14R1.760 Cc1ccc(c(c1)NCC=O)C(=O)N 7a_100011219537_200015260668 [1,1,0,0,0,0|1,0,0]=3 2404 B14R1.760 Cc1ccc(c(c1)NCCO)C(=O)N 34a_100011219537_100000211926 [1,1,0,0,0,0|1,0,1]=4 2405 B14R1.760 Cc1ccc(c(c1)NCCO)C(=O)N 7a_100011219537_100000211926 [1,1,0,0,0,0|1,0,1]=4 2406 B14R1.760 Cc1ccc(c(c1)OCC#N)C(=O)N 7a_100000192831_100011215382 [1,1,0,0,0,0|1,0,1]=4 2407 B14R1.760 Cc1ccc(c(c1)OCC=O)C(=O)N 34a_100000192831_200009817547 [1,1,0,0,0,0|0,0,0]=2 2408 B14R1.760 Cc1ccc(c(c1)OCC=O)C(=O)N 7a_100000192831_200015260668 [1,1,0,0,0,0|0,0,0]=2 2409 B14R1.760 Cc1ccc(c(c1)OCC=O)[N+](=O)[O-] 34a_100000195450_200009817547 [1,1,0,0,0,0|2,0,0]=4 2410 B14R1.760 Cc1ccc(c(c1)OCC=O)[N+](=O)[O-] 7a_100000195450_200015260668 [1,1,0,0,0,0|2,0,0]=4 2411 B14R1.760 Cc1ccc(c(c1)OCCF)C(=O)N 34a_100000192831_100011217306 [1,1,0,0,0,0|1,0,1]=4 2412 B14R1.760 Cc1ccc(c(c1)OCCF)C(=O)N 7a_100000192831_100011217306 [1,1,0,0,0,0|1,0,1]=4 2413 B14R1.760 Cc1ccc(c(c1)OCCO)C(=O)N 34a_100000192831_100000211926 [1,1,0,0,0,0|0,0,1]=3 2414 B14R1.760 Cc1ccc(c(c1)OCCO)C(=O)N 7a_100000192831_100000211926 [1,1,0,0,0,0|0,0,1]=3 2415 B14R1.760 Cc1ccc(c(n1)SCC=O)C(=O)N 62a_100000041523_200015260668 [1,1,0,0,0,0|1,1,0]=4 2416 B14R1.760 Cc1ccc(c(n1)SCC=O)C(=O)N 62a_200015260668_100000041523 [1,1,0,0,0,0|1,1,0]=4 2417 B14R1.760 N#CCOc1cc(ccc1C(=O)N)Br 7a_100011550861_100011215382 [1,1,0,0,0,0|1,0,1]=4 2418 B14R1.760 N#CCOc1cc(ccc1C(=O)N)Cl 7a_100000192836_100011215382 [1,1,0,0,0,0|1,0,1]=4 2419 B14R1.760 N#CCOc1cc(ccc1C(=O)N)N 7a_100000223280_100011215382 [1,1,0,0,0,0|1,0,1]=4 2420 B14R1.760 NC(=O)c1ccc(cc1NCC=O)Br 7a_100012349972_200015260668 [1,1,0,0,0,0|1,0,0]=3 2421 B14R1.760 NC(=O)c1ccc(cc1NCC=O)Cl 34a_100000738103_200009817547 [1,1,0,0,0,0|1,0,0]=3 2422 B14R1.760 NC(=O)c1ccc(cc1NCC=O)Cl 7a_100000738103_200015260668 [1,1,0,0,0,0|1,0,0]=3 2423 B14R1.760 NC(=O)c1ccc(cc1NCC=O)F 34a_100011298637_200009817547 [1,1,0,0,0,0|1,0,0]=3 2424 B14R1.760 NC(=O)c1ccc(cc1NCCO)Br 27a_100000210304_100009815748 [1,1,0,0,0,0|1,0,1]=4 2425 B14R1.760 NC(=O)c1ccc(cc1NCCO)Br 7a_100012349972_100000211926 [1,1,0,0,0,0|1,0,1]=4 2426 B14R1.760 NC(=O)c1ccc(cc1NCCO)Cl 34a_100000738103_100000211926 [1,1,0,0,0,0|1,0,1]=4 2427 B14R1.760 NC(=O)c1ccc(cc1NCCO)Cl 7a_100000738103_100000211926 [1,1,0,0,0,0|1,0,1]=4 2428 B14R1.760 NC(=O)c1ccc(cc1NCCO)F 27a_100000210304_100000206404 [1,1,0,0,0,0|1,0,1]=4 2429 B14R1.760 NC(=O)c1ccc(cc1NCCO)F 34a_100011298637_100000211926 [1,1,0,0,0,0|1,0,1]=4 2430 B14R1.760 NC(=O)c1ccc(cc1OCC=O)Br 34a_100011550861_200009817547 [1,1,0,0,0,0|0,0,0]=2 2431 B14R1.760 NC(=O)c1ccc(cc1OCC=O)Br 7a_100011550861_200015260668 [1,1,0,0,0,0|0,0,0]=2 2432 B14R1.760 NC(=O)c1ccc(cc1OCC=O)Cl 34a_100000192836_200009817547 [1,1,0,0,0,0|0,0,0]=2 2433 B14R1.760 NC(=O)c1ccc(cc1OCC=O)Cl 7a_100000192836_200015260668 [1,1,0,0,0,0|0,0,0]=2 2434 B14R1.760 NC(=O)c1ccc(cc1OCC=O)N 34a_100000223280_200009817547 [1,1,0,0,0,0|0,0,0]=2 2435 B14R1.760 NC(=O)c1ccc(cc1OCC=O)N 7a_100000223280_200015260668 [1,1,0,0,0,0|0,0,0]=2 2436 B14R1.760 NC(=O)c1ccc(cc1OCCF)Br 34a_100011550861_100011217306 [1,1,0,0,0,0|1,0,1]=4 2437 B14R1.760 NC(=O)c1ccc(cc1OCCF)Br 7a_100011550861_100011217306 [1,1,0,0,0,0|1,0,1]=4 2438 B14R1.760 NC(=O)c1ccc(cc1OCCF)Cl 34a_100000192836_100011217306 [1,1,0,0,0,0|1,0,1]=4 2439 B14R1.760 NC(=O)c1ccc(cc1OCCF)Cl 7a_100000192836_100011217306 [1,1,0,0,0,0|1,0,1]=4 2440 B14R1.760 NC(=O)c1ccc(cc1OCCF)N 34a_100000223280_100011217306 [1,1,0,0,0,0|1,0,1]=4 2441 B14R1.760 NC(=O)c1ccc(cc1OCCF)N 7a_100000223280_100011217306 [1,1,0,0,0,0|1,0,1]=4 2442 B14R1.760 NC(=O)c1ccc(cc1OCCO)Br 34a_100011550861_100000211926 [1,1,0,0,0,0|0,0,1]=3 2443 B14R1.760 NC(=O)c1ccc(cc1OCCO)Br 7a_100011550861_100000211926 [1,1,0,0,0,0|0,0,1]=3 2444 B14R1.760 NC(=O)c1ccc(cc1OCCO)Cl 34a_100000192836_100000211926 [1,1,0,0,0,0|0,0,1]=3 2445 B14R1.760 NC(=O)c1ccc(cc1OCCO)Cl 7a_100000192836_100000211926 [1,1,0,0,0,0|0,0,1]=3 2446 B14R1.760 NC(=O)c1ccc(cc1OCCO)N 34a_100000223280_100000211926 [1,1,0,0,0,0|0,0,1]=3 2447 B14R1.760 NC(=O)c1ccc(cc1OCCO)N 7a_100000223280_100000211926 [1,1,0,0,0,0|0,0,1]=3 2448 B14R1.760 NC(=O)c1ccc(cc1SCC=O)Br 62a_100009815748_200015260668 [1,1,0,0,0,0|0,1,0]=3 2449 B14R1.760 NC(=O)c1ccc(cc1SCC=O)F 62a_100000206404_200015260668 [1,1,0,0,0,0|0,1,0]=3 2450 B14R1.760 NC(=O)c1ccc(cc1SCC=O)F 62a_200015260668_100000206404 [1,1,0,0,0,0|0,1,0]=3 2451 B14R1.760 NC(=O)c1ccc(cc1SCCO)Br 62a_100009815748_100000211926 [1,1,0,0,0,0|0,1,1]=4 2452 B14R1.760 NC(=O)c1ccc(cc1SCCO)F 62a_100000206404_100000211926 [1,1,0,0,0,0|0,1,1]=4 2453 B14R1.760 NC(=O)c1ccc(cc1SCCO)F 62a_100000211926_100000206404 [1,1,0,0,0,0|0,1,1]=4 2454 B14R1.760 O=CCOc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_200015260668 [1,1,0,0,0,0|2,0,0]=4 2455 B14R1.760 O=CCOc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_200009817547 [1,1,0,0,0,0|2,0,0]=4 2456 B14R1.760 O=CCOc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_200015260668 [1,1,0,0,0,0|2,0,0]=4 2457 B14R1.760 O=CCOc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_200009817547 [1,1,0,0,0,0|2,0,0]=4 2458 B14R1.760 O=CCOc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_200015260668 [1,1,0,0,0,0|2,0,0]=4 2459 B14R1.760 O=CCOc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_200015260668 [1,1,0,0,0,0|2,0,0]=4 2460 B14R1.788 CS(=O)(=O)c1ccccc1OCC=O 34a_100000054562_200009817547 [1,1,0,0,0,0|2,0,0]=4 2461 B14R1.788 CS(=O)(=O)c1ccccc1OCC=O 7a_100000054562_200015260668 [1,1,0,0,0,0|2,0,0]=4 2462 B14R1.788 NS(=O)(=O)c1ccccc1NCC=O 34a_100011204920_200009817547 [1,1,0,0,0,0|2,0,0]=4 2463 B14R1.788 NS(=O)(=O)c1ccccc1SCC=O 62a_100000164562_200015260668 [1,1,0,0,0,0|1,1,0]=4 2464 B14R1.789 C#CCOc1ccccc1C(=O)NC 11a_106832991635_100000217172 [1,1,0,0,0,0|1,0,1]=4 2465 B14R1.789 C#CCOc1ccccc1C(=O)NC 1626a_100102657272_100000217172 [1,1,0,0,0,0|1,0,1]=4 2466 B14R1.789 C#CCOc1ccccc1C(=O)NC 240690a_100102657272_100000217172 [1,1,0,0,0,0|1,0,1]=4 2467 B14R1.789 C#CCOc1ccccc1C(=O)NC 34a_100000185920_100000184674 [1,1,0,0,0,0|1,0,1]=4 2468 B14R1.789 C#CCOc1ccccc1C(=O)NC 527a_100102657272_100000217172 [1,1,0,0,0,0|1,0,1]=4 2469 B14R1.789 C#CCOc1ccccc1C(=O)NC 7a_100000185920_100000038162 [1,1,0,0,0,0|1,0,1]=4 2470 B14R1.789 C#CCOc1ccccc1C(=O)NN 34a_100000186518_100000184674 [1,1,0,0,0,0|1,0,1]=4 2471 B14R1.789 C#CCOc1ccccc1C(=O)NO 34a_100000188472_100000184674 [1,1,0,0,0,0|1,0,1]=4 2472 B14R1.789 C=CCNc1ccccc1C(=O)NC 27a_100020586998_100000155073 [1,1,0,0,0,0|2,0,0]=4 2473 B14R1.789 C=CCNc1ccccc1C(=O)NC 34a_100000185696_100015514636 [1,1,0,0,0,0|2,0,0]=4 2474 B14R1.789 C=CCOc1ccccc1C(=O)CBr 7a_100000188908_100015514636 [1,1,0,0,0,0|2,0,0]=4 2475 B14R1.789 C=CCOc1ccccc1C(=O)CC 1458a_100000189412_100000210202 [1,1,0,0,0,0|2,0,0]=4 2476 B14R1.789 C=CCOc1ccccc1C(=O)CC 7a_100000184720_100015514636 [1,1,0,0,0,0|2,0,0]=4 2477 B14R1.789 C=CCOc1ccccc1C(=O)CF 1458a_100000189412_100015361967 [1,1,0,0,0,0|2,0,0]=4 2478 B14R1.789 C=CCOc1ccccc1C(=O)NC 11a_106832991635_100000189412 [1,1,0,0,0,0|1,0,0]=3 2479 B14R1.789 C=CCOc1ccccc1C(=O)NC 1626a_100102657272_100000189412 [1,1,0,0,0,0|1,0,0]=3 2480 B14R1.789 C=CCOc1ccccc1C(=O)NC 240690a_100102657272_100000189412 [1,1,0,0,0,0|1,0,0]=3 2481 B14R1.789 C=CCOc1ccccc1C(=O)NC 34a_100000185920_100015514636 [1,1,0,0,0,0|1,0,0]=3 2482 B14R1.789 C=CCOc1ccccc1C(=O)NC 527a_100102657272_100000189412 [1,1,0,0,0,0|1,0,0]=3 2483 B14R1.789 C=CCOc1ccccc1C(=O)NC 7a_100000185920_100015514636 [1,1,0,0,0,0|1,0,0]=3 2484 B14R1.789 C=CCOc1ccccc1C(=O)NN 34a_100000186518_100015514636 [1,1,0,0,0,0|1,0,0]=3 2485 B14R1.789 C=CCOc1ccccc1C(=O)NO 34a_100000188472_100015514636 [1,1,0,0,0,0|1,0,0]=3 2486 B14R1.789 C=CCOc1ccccc1C(=O)OC 7a_100000150335_100015514636 [1,1,0,0,0,0|2,0,0]=4 2487 B14R1.789 C=CCOc1cccnc1C(=O)NC 34a_100011376092_100015514636 [1,1,0,0,0,0|2,0,0]=4 2488 B14R1.789 C=CCOc1cccnc1C(=O)NC 7a_100011376092_100015514636 [1,1,0,0,0,0|2,0,0]=4 2489 B14R1.789 C=CCSc1ccccc1C(=O)NC 62a_100000155073_100000210623 [1,1,0,0,0,0|1,1,0]=4 2490 B14R1.789 C=CCSc1ccccc1C(=O)NC 62a_100000210623_100000155073 [1,1,0,0,0,0|1,1,0]=4 2491 B14R1.789 C=CCSc1ccccc1C(=O)NN 62a_100000190081_100000210623 [1,1,0,0,0,0|1,1,0]=4 2492 B14R1.789 C=CCSc1ccccc1C(=O)NN 62a_100000210623_100000190081 [1,1,0,0,0,0|1,1,0]=4 2493 B14R1.789 CC(=NO)c1ccccc1OCC=O 34a_100000164216_200009817547 [1,1,0,0,0,0|1,0,1]=4 2494 B14R1.789 CCC(=O)c1ccccc1OCC=O 7a_100000184720_200015260668 [1,1,0,0,0,0|1,0,0]=3 2495 B14R1.789 CCC(=O)c1ccccc1OCCO 1458a_200000217288_100000210202 [1,1,0,0,0,0|1,0,1]=4 2496 B14R1.789 CCC(=O)c1ccccc1OCCO 7a_100000184720_100000211926 [1,1,0,0,0,0|1,0,1]=4 2497 B14R1.789 CCCOc1ccccc1C(=O)NC 11a_106832991635_100000215688 [1,1,0,0,0,0|1,0,1]=4 2498 B14R1.789 CCCOc1ccccc1C(=O)NC 1626a_100102657272_100000215688 [1,1,0,0,0,0|1,0,1]=4 2499 B14R1.789 CCCOc1ccccc1C(=O)NC 240690a_100102657272_100000215688 [1,1,0,0,0,0|1,0,1]=4 2500 B14R1.789 CCCOc1ccccc1C(=O)NC 34a_100000185920_100000210303 [1,1,0,0,0,0|1,0,1]=4 2501 B14R1.789 CCCOc1ccccc1C(=O)NC 527a_100102657272_100000215688 [1,1,0,0,0,0|1,0,1]=4 2502 B14R1.789 CCCOc1ccccc1C(=O)NC 7a_100000185920_100000210303 [1,1,0,0,0,0|1,0,1]=4 2503 B14R1.789 CCCOc1ccccc1C(=O)NN 34a_100000186518_100000210303 [1,1,0,0,0,0|1,0,1]=4 2504 B14R1.789 CCCOc1ccccc1C(=O)NO 34a_100000188472_100000210303 [1,1,0,0,0,0|1,0,1]=4 2505 B14R1.789 CNC(=O)c1ccccc1NCC=O 34a_100000185696_200009817547 [1,1,0,0,0,0|1,0,0]=3 2506 B14R1.789 CNC(=O)c1ccccc1NCCO 27a_100000210304_100000155073 [1,1,0,0,0,0|1,0,1]=4 2507 B14R1.789 CNC(=O)c1ccccc1NCCO 34a_100000185696_100000211926 [1,1,0,0,0,0|1,0,1]=4 2508 B14R1.789 CNC(=O)c1ccccc1OCC#N 7a_100000185920_100011215382 [1,1,0,0,0,0|1,0,1]=4 2509 B14R1.789 CNC(=O)c1ccccc1OCC=O 34a_100000185920_200009817547 [1,1,0,0,0,0|0,0,0]=2 2510 B14R1.789 CNC(=O)c1ccccc1OCC=O 7a_100000185920_200015260668 [1,1,0,0,0,0|0,0,0]=2 2511 B14R1.789 CNC(=O)c1ccccc1OCCF 34a_100000185920_100011217306 [1,1,0,0,0,0|1,0,1]=4 2512 B14R1.789 CNC(=O)c1ccccc1OCCF 7a_100000185920_100011217306 [1,1,0,0,0,0|1,0,1]=4 2513 B14R1.789 CNC(=O)c1ccccc1OCCO 240690a_100102657272_200000217288 [1,1,0,0,0,0|0,0,1]=3 2514 B14R1.789 CNC(=O)c1ccccc1OCCO 34a_100000185920_100000211926 [1,1,0,0,0,0|0,0,1]=3 2515 B14R1.789 CNC(=O)c1ccccc1OCCO 7a_100000185920_100000211926 [1,1,0,0,0,0|0,0,1]=3 2516 B14R1.789 CNC(=O)c1ccccc1OCSC 34a_100000185920_100011218213 [1,1,0,0,0,0|2,0,0]=4 2517 B14R1.789 CNC(=O)c1ccccc1SCC=O 62a_100000155073_200015260668 [1,1,0,0,0,0|0,1,0]=3 2518 B14R1.789 CNC(=O)c1ccccc1SCC=O 62a_200015260668_100000155073 [1,1,0,0,0,0|0,1,0]=3 2519 B14R1.789 CNC(=O)c1ccccc1SCCO 62a_100000155073_100000211926 [1,1,0,0,0,0|0,1,1]=4 2520 B14R1.789 CNC(=O)c1ccccc1SCCO 62a_100000211926_100000155073 [1,1,0,0,0,0|0,1,1]=4 2521 B14R1.789 CNC(=O)c1cccnc1SCC=O 62a_100000159833_200015260668 [1,1,0,0,0,0|1,1,0]=4 2522 B14R1.789 CNC(=O)c1cccnc1SCC=O 62a_200015260668_100000159833 [1,1,0,0,0,0|1,1,0]=4 2523 B14R1.789 CNC(=O)c1ncccc1OCC=O 34a_100011376092_200009817547 [1,1,0,0,0,0|1,0,0]=3 2524 B14R1.789 CNC(=O)c1ncccc1OCC=O 7a_100011376092_200015260668 [1,1,0,0,0,0|1,0,0]=3 2525 B14R1.789 CNC(=O)c1ncccc1OCCO 34a_100011376092_100000211926 [1,1,0,0,0,0|1,0,1]=4 2526 B14R1.789 CNC(=O)c1ncccc1OCCO 7a_100011376092_100000211926 [1,1,0,0,0,0|1,0,1]=4 2527 B14R1.789 COC(=O)c1ccccc1OCC=O 7a_100000150335_200015260668 [1,1,0,0,0,0|1,0,0]=3 2528 B14R1.789 COC(=O)c1ccccc1OCCO 7a_100000150335_100000211926 [1,1,0,0,0,0|1,0,1]=4 2529 B14R1.789 COC(=O)c1ccccc1SCC=O 62a_100000148710_200015260668 [1,1,0,0,0,0|1,1,0]=4 2530 B14R1.789 COC(=O)c1ccccc1SCC=O 62a_200015260668_100000148710 [1,1,0,0,0,0|1,1,0]=4 2531 B14R1.789 COC(=O)c1ncccc1OCC=O 34a_100000744052_200009817547 [1,1,0,0,0,0|2,0,0]=4 2532 B14R1.789 COC(=O)c1ncccc1OCC=O 7a_100000744052_200015260668 [1,1,0,0,0,0|2,0,0]=4 2533 B14R1.789 CSCOc1ccccc1C(=O)NN 34a_100000186518_100011218213 [1,1,0,0,0,0|2,0,0]=4 2534 B14R1.789 CSCOc1ccccc1C(=O)NO 34a_100000188472_100011218213 [1,1,0,0,0,0|2,0,0]=4 2535 B14R1.789 NNC(=O)c1ccccc1OCC=O 34a_100000186518_200009817547 [1,1,0,0,0,0|0,0,0]=2 2536 B14R1.789 NNC(=O)c1ccccc1OCCF 34a_100000186518_100011217306 [1,1,0,0,0,0|1,0,1]=4 2537 B14R1.789 NNC(=O)c1ccccc1OCCO 34a_100000186518_100000211926 [1,1,0,0,0,0|0,0,1]=3 2538 B14R1.789 NNC(=O)c1ccccc1SCC=O 62a_100000190081_200015260668 [1,1,0,0,0,0|0,1,0]=3 2539 B14R1.789 NNC(=O)c1ccccc1SCC=O 62a_200015260668_100000190081 [1,1,0,0,0,0|0,1,0]=3 2540 B14R1.789 NNC(=O)c1ccccc1SCCO 62a_100000190081_100000211926 [1,1,0,0,0,0|0,1,1]=4 2541 B14R1.789 NNC(=O)c1ccccc1SCCO 62a_100000211926_100000190081 [1,1,0,0,0,0|0,1,1]=4 2542 B14R1.789 O=C(CBr)c1ccccc1OCCO 7a_100000188908_100000211926 [1,1,0,0,0,0|1,0,1]=4 2543 B14R1.789 O=C(CF)c1ccccc1OCCO 1458a_200000217288_100015361967 [1,1,0,0,0,0|1,0,1]=4 2544 B14R1.789 O=C(NO)c1ccccc1OCCF 34a_100000188472_100011217306 [1,1,0,0,0,0|1,0,1]=4 2545 B14R1.789 O=C(NO)c1ccccc1OCCO 34a_100000188472_100000211926 [1,1,0,0,0,0|0,0,1]=3 2546 B14R1.789 O=CCOc1ccccc1C(=O)CBr 7a_100000188908_200015260668 [1,1,0,0,0,0|1,0,0]=3 2547 B14R1.789 O=CCOc1ccccc1C(=O)NO 34a_100000188472_200009817547 [1,1,0,0,0,0|0,0,0]=2 2548 B14R1.789 O=CCSc1ccccc1C(=O)O[Na] 62a_200015260668_114855342371 [1,1,0,0,0,0|1,1,0]=4 2549 B14R1.903 C#CCCOc1ccccc1C(=O)N 34a_100000192804_100000688953 [1,1,0,0,0,0|1,0,1]=4 2550 B14R1.903 C#CCCOc1ccccc1C(=O)N 7a_100000192804_100000688953 [1,1,0,0,0,0|1,0,1]=4 2551 B14R1.903 C/C=C/CNc1ccccc1C(=O)N 34a_100000185089_100102629194 [1,1,0,0,0,0|2,0,0]=4 2552 B14R1.903 C/C=C/COc1ccccc1C(=O)N 34a_100000192804_100102629194 [1,1,0,0,0,0|1,0,0]=3 2553 B14R1.903 C/C=C/COc1ccccc1C(=O)N 7a_100000192804_100102629194 [1,1,0,0,0,0|1,0,0]=3 2554 B14R1.903 C/C=C/COc1ccccc1C(=O)[O-] 7a_100015234032_100102629194 [1,1,0,0,0,0|2,0,0]=4 2555 B14R1.903 C/C=C/COc1ccccc1C(=S)N 7a_100000745089_100102629194 [1,1,0,0,0,0|1,1,0]=4 2556 B14R1.903 C/C=C/COc1cccnc1C(=O)N 34a_200011215183_100102629194 [1,1,0,0,0,0|2,0,0]=4 2557 B14R1.903 C/C=C/COc1cccnc1C(=O)N 7a_200011215183_100102629194 [1,1,0,0,0,0|2,0,0]=4 2558 B14R1.903 C/C=C/COc1ccncc1C(=O)N 34a_200011998761_100102629194 [1,1,0,0,0,0|2,0,0]=4 2559 B14R1.903 C/C=C/COc1cnccc1C(=O)N 7a_100012022987_100102629194 [1,1,0,0,0,0|2,0,0]=4 2560 B14R1.903 C/C=C/CSc1ccccc1C(=O)N 62a_100000162227_100102629194 [1,1,0,0,0,0|1,1,0]=4 2561 B14R1.903 C/C=C/CSc1ccccc1C(=O)N 62a_100102629194_100000162227 [1,1,0,0,0,0|1,1,0]=4 2562 B14R1.903 C=CCCNc1ccccc1C(=O)N 34a_100000185089_100000754431 [1,1,0,0,0,0|2,0,0]=4 2563 B14R1.903 C=CCCOc1ccccc1C(=O)N 34a_100000192804_100000754431 [1,1,0,0,0,0|1,0,0]=3 2564 B14R1.903 C=CCCOc1ccccc1C(=O)N 7a_100000192804_100000754431 [1,1,0,0,0,0|1,0,0]=3 2565 B14R1.903 C=CCCOc1ccccc1C(=O)[O-] 7a_100015234032_100000754431 [1,1,0,0,0,0|2,0,0]=4 2566 B14R1.903 C=CCCOc1ccccc1C(=S)N 7a_100000745089_100000754431 [1,1,0,0,0,0|1,1,0]=4 2567 B14R1.903 C=CCCOc1cccnc1C(=O)N 34a_200011215183_100000754431 [1,1,0,0,0,0|2,0,0]=4 2568 B14R1.903 C=CCCOc1cccnc1C(=O)N 7a_200011215183_100000754431 [1,1,0,0,0,0|2,0,0]=4 2569 B14R1.903 C=CCCOc1ccncc1C(=O)N 34a_200011998761_100000754431 [1,1,0,0,0,0|2,0,0]=4 2570 B14R1.903 C=CCCOc1cnccc1C(=O)N 7a_100012022987_100000754431 [1,1,0,0,0,0|2,0,0]=4 2571 B14R1.903 C=CCCSc1ccccc1C(=O)N 62a_100000162227_100000754431 [1,1,0,0,0,0|1,1,0]=4 2572 B14R1.903 C=CCCSc1ccccc1C(=O)N 62a_100000754431_100000162227 [1,1,0,0,0,0|1,1,0]=4 2573 B14R1.903 CC#CCOc1ccccc1C(=O)N 34a_100000192804_100000748600 [1,1,0,0,0,0|1,0,1]=4 2574 B14R1.903 CC#CCOc1ccccc1C(=O)N 7a_100000192804_100000748600 [1,1,0,0,0,0|1,0,1]=4 2575 B14R1.903 CC=CCNc1ccccc1C(=O)N 34a_100000185089_100000070051 [1,1,0,0,0,0|2,0,0]=4 2576 B14R1.903 CC=CCOc1ccccc1C(=O)N 34a_100000192804_100000070051 [1,1,0,0,0,0|1,0,0]=3 2577 B14R1.903 CC=CCOc1ccccc1C(=O)N 7a_100000192804_100000070051 [1,1,0,0,0,0|1,0,0]=3 2578 B14R1.903 CC=CCOc1ccccc1C(=O)[O-] 7a_100015234032_100000070051 [1,1,0,0,0,0|2,0,0]=4 2579 B14R1.903 CC=CCOc1ccccc1C(=S)N 7a_100000745089_100000070051 [1,1,0,0,0,0|1,1,0]=4 2580 B14R1.903 CC=CCOc1cccnc1C(=O)N 34a_200011215183_100000070051 [1,1,0,0,0,0|2,0,0]=4 2581 B14R1.903 CC=CCOc1cccnc1C(=O)N 7a_200011215183_100000070051 [1,1,0,0,0,0|2,0,0]=4 2582 B14R1.903 CC=CCOc1ccncc1C(=O)N 34a_200011998761_100000070051 [1,1,0,0,0,0|2,0,0]=4 2583 B14R1.903 CC=CCOc1cnccc1C(=O)N 7a_100012022987_100000070051 [1,1,0,0,0,0|2,0,0]=4 2584 B14R1.903 CC=CCSc1ccccc1C(=O)N 62a_100000070051_100000162227 [1,1,0,0,0,0|1,1,0]=4 2585 B14R1.903 CC=CCSc1ccccc1C(=O)N 62a_100000162227_100000070051 [1,1,0,0,0,0|1,1,0]=4 2586 B14R1.903 CCCCOc1ccccc1C(=O)N 34a_100000192804_100000210210 [1,1,0,0,0,0|1,0,1]=4 2587 B14R1.903 CCCCOc1ccccc1C(=O)N 7a_100000192804_100000210211 [1,1,0,0,0,0|1,0,1]=4 2588 B14R1.903 COCCNc1ccccc1C(=O)N 34a_100000185089_100011201679 [1,1,0,0,0,0|1,0,1]=4 2589 B14R1.903 COCCOc1ccccc1C(=O)C 1458a_100000244650_200000210301 [1,1,0,0,0,0|1,0,1]=4 2590 B14R1.903 COCCOc1ccccc1C(=O)C 34a_100138415774_100000184561 [1,1,0,0,0,0|1,0,1]=4 2591 B14R1.903 COCCOc1ccccc1C(=O)N 34a_100000192804_100011201679 [1,1,0,0,0,0|0,0,1]=3 2592 B14R1.903 COCCOc1ccccc1C(=O)N 7a_100000192804_100000233755 [1,1,0,0,0,0|0,0,1]=3 2593 B14R1.903 COCCOc1ccccc1C(=O)[13CH3] 1458a_100000244650_200025704644 [1,1,0,0,0,0|1,0,1]=4 2594 B14R1.903 COCCOc1ccccc1C(=O)[O-] 7a_100015234032_100000233755 [1,1,0,0,0,0|1,0,1]=4 2595 B14R1.903 COCCOc1ccccc1C(=S)N 7a_100000745089_100000233755 [1,1,0,0,0,0|0,1,1]=4 2596 B14R1.903 COCCOc1cccnc1C(=O)N 34a_200011215183_100011201679 [1,1,0,0,0,0|1,0,1]=4 2597 B14R1.903 COCCOc1cccnc1C(=O)N 7a_200011215183_100000233755 [1,1,0,0,0,0|1,0,1]=4 2598 B14R1.903 COCCOc1ccncc1C(=O)N 34a_200011998761_100011201679 [1,1,0,0,0,0|1,0,1]=4 2599 B14R1.903 COCCOc1cnccc1C(=O)N 7a_100012022987_100000233755 [1,1,0,0,0,0|1,0,1]=4 2600 B14R1.903 COCCSc1ccccc1C(=O)N 62a_100000162227_100000233755 [1,1,0,0,0,0|0,1,1]=4 2601 B14R1.903 COCCSc1ccccc1C(=O)N 62a_100000233755_100000162227 [1,1,0,0,0,0|0,1,1]=4 2602 B14R1.903 CSCCOc1ccccc1C(=O)N 34a_100000192804_100000212216 [1,1,0,0,0,0|0,1,1]=4 2603 B14R1.903 CSCCOc1ccccc1C(=O)N 7a_100000192804_100000212216 [1,1,0,0,0,0|0,1,1]=4 2604 B14R1.903 N#CCCOc1ccccc1C(=O)N 7a_100000192804_100000184422 [1,1,0,0,0,0|1,0,1]=4 2605 B14R1.903 NC(=O)c1ccccc1NCCCO 34a_100000185089_100000230001 [1,1,0,0,0,0|1,0,1]=4 2606 B14R1.903 NC(=O)c1ccccc1OCCCF 34a_100000192804_100011934791 [1,1,0,0,0,0|1,0,1]=4 2607 B14R1.903 NC(=O)c1ccccc1OCCCF 7a_100000192804_100011934791 [1,1,0,0,0,0|1,0,1]=4 2608 B14R1.903 NC(=O)c1ccccc1OCCCO 34a_100000192804_100000230001 [1,1,0,0,0,0|0,0,1]=3 2609 B14R1.903 NC(=O)c1ccccc1OCCCO 7a_100000192804_100011215043 [1,1,0,0,0,0|0,0,1]=3 2610 B14R1.903 NC(=O)c1ccccc1SCCCO 62a_100000162227_100011215043 [1,1,0,0,0,0|0,1,1]=4 2611 B14R1.903 NC(=O)c1ccccc1SCCCO 62a_100011215043_100000162227 [1,1,0,0,0,0|0,1,1]=4 2612 B14R1.903 NC(=O)c1ccncc1OCCCO 7a_100012022987_100011215043 [1,1,0,0,0,0|1,0,1]=4 2613 B14R1.903 NC(=O)c1cnccc1OCCCO 34a_200011998761_100000230001 [1,1,0,0,0,0|1,0,1]=4 2614 B14R1.903 NC(=O)c1ncccc1OCCCO 34a_200011215183_100000230001 [1,1,0,0,0,0|1,0,1]=4 2615 B14R1.903 NC(=O)c1ncccc1OCCCO 7a_200011215183_100011215043 [1,1,0,0,0,0|1,0,1]=4 2616 B14R1.903 NC(=S)c1ccccc1OCCCO 7a_100000745089_100011215043 [1,1,0,0,0,0|0,1,1]=4 2617 B14R1.903 O=C([O-])c1ccccc1OCCCO 7a_100015234032_100011215043 [1,1,0,0,0,0|1,0,1]=4 2618 B14R1.903 O=CCNCc1ccccc1C(=O)O 269956a_100015183376_200015260668 [1,1,0,0,0,0|2,0,0]=4 2619 B14R1.903 O=CCOCc1ccccc1[N+](=O)[O-] 7a_100011218404_200015260668 [1,1,0,0,0,0|2,0,0]=4 2620 B14R1.3302 C#CC(C)Oc1ccccc1C(=O)N 34a_100000192804_200000035995 [1,1,0,0,0,0|1,0,1]=4 2621 B14R1.3302 C=CC(C)Sc1ccccc1C(=O)N 62a_100011215867_100000162227 [1,1,0,0,0,0|1,1,0]=4 2622 B14R1.3302 CC(C#N)Oc1ccccc1C(=O)N 7a_100000192804_100000703298 [1,1,0,0,0,0|1,0,1]=4 2623 B14R1.3302 CC(CO)Nc1ccccc1C(=O)N 34a_100000185089_100012180447 [1,1,0,0,0,0|1,0,1]=4 2624 B14R1.3302 CC(CO)Oc1ccccc1C(=O)N 34a_100000192804_100012180447 [1,1,0,0,0,0|0,0,1]=3 2625 B14R1.3302 CC(CO)Oc1ccccc1C(=O)N 7a_100000192804_100012180447 [1,1,0,0,0,0|0,0,1]=3 2626 B14R1.3302 CC(CO)Oc1ccccc1C(=O)[O-] 7a_100015234032_100012180447 [1,1,0,0,0,0|1,0,1]=4 2627 B14R1.3302 CC(CO)Oc1ccccc1C(=S)N 7a_100000745089_100012180447 [1,1,0,0,0,0|0,1,1]=4 2628 B14R1.3302 CC(CO)Oc1cccnc1C(=O)N 34a_200011215183_100012180447 [1,1,0,0,0,0|1,0,1]=4 2629 B14R1.3302 CC(CO)Oc1cccnc1C(=O)N 7a_200011215183_100012180447 [1,1,0,0,0,0|1,0,1]=4 2630 B14R1.3302 CC(CO)Oc1ccncc1C(=O)N 34a_200011998761_100012180447 [1,1,0,0,0,0|1,0,1]=4 2631 B14R1.3302 CC(CO)Oc1cnccc1C(=O)N 7a_100012022987_100012180447 [1,1,0,0,0,0|1,0,1]=4 2632 B14R1.3302 CC(CO)Sc1ccccc1C(=O)N 62a_100012180447_100000162227 [1,1,0,0,0,0|0,1,1]=4 2633 B14R1.3302 CCC(C)Oc1ccccc1C(=O)N 34a_100000192804_100011215416 [1,1,0,0,0,0|1,0,1]=4 2634 B14R1.3302 CCC(C)Oc1ccccc1C(=O)N 7a_100000192804_100000758301 [1,1,0,0,0,0|1,0,1]=4 2635 B14R1.3302 C[C@H](CO)Sc1ccccc1C(=O)N 62a_100000162227_100016084084 [1,1,0,0,0,0|0,1,1]=4 2636 B14R1.3302 C[C@H](CO)Sc1ccccc1C(=O)N 62a_100016084084_100000162227 [1,1,0,0,0,0|0,1,1]=4 2637 B14R1.4432 C#CCOc1cccc(c1C(=O)N)F 34a_100000701607_100000184674 [1,1,0,0,0,0|1,0,1]=4 2638 B14R1.4432 C#CCOc1cccc(c1C(=O)N)F 7a_100000701607_100000038162 [1,1,0,0,0,0|1,0,1]=4 2639 B14R1.4432 C=CCNc1cccc(c1C(=O)N)C 34a_100102558177_100015514636 [1,1,0,0,0,0|2,0,0]=4 2640 B14R1.4432 C=CCNc1cccc(c1C(=O)N)C 7a_100102558177_100015514636 [1,1,0,0,0,0|2,0,0]=4 2641 B14R1.4432 C=CCNc1cccc(c1C(=O)N)Cl 34a_100000764435_100015514636 [1,1,0,0,0,0|2,0,0]=4 2642 B14R1.4432 C=CCNc1cccc(c1C(=O)N)Cl 7a_100000764435_100015514636 [1,1,0,0,0,0|2,0,0]=4 2643 B14R1.4432 C=CCNc1cccc(c1C(=O)N)F 27a_100020586998_100011219063 [1,1,0,0,0,0|2,0,0]=4 2644 B14R1.4432 C=CCNc1cccc(c1C(=O)N)F 34a_100000036109_100015514636 [1,1,0,0,0,0|2,0,0]=4 2645 B14R1.4432 C=CCNc1cccc(c1C(=O)N)F 7a_100000036109_100015514636 [1,1,0,0,0,0|2,0,0]=4 2646 B14R1.4432 C=CCOc1cccc(c1C(=O)C)Br 34a_100010174959_100015514636 [1,1,0,0,0,0|2,0,0]=4 2647 B14R1.4432 C=CCOc1cccc(c1C(=O)C)Br 7a_100010174959_100015514636 [1,1,0,0,0,0|2,0,0]=4 2648 B14R1.4432 C=CCOc1cccc(c1C(=O)C)C 34a_100009860897_100015514636 [1,1,0,0,0,0|2,0,0]=4 2649 B14R1.4432 C=CCOc1cccc(c1C(=O)C)C 7a_100009860897_100015514636 [1,1,0,0,0,0|2,0,0]=4 2650 B14R1.4432 C=CCOc1cccc(c1C(=O)C)Cl 34a_100000730630_100015514636 [1,1,0,0,0,0|2,0,0]=4 2651 B14R1.4432 C=CCOc1cccc(c1C(=O)C)Cl 7a_100000730630_100015514636 [1,1,0,0,0,0|2,0,0]=4 2652 B14R1.4432 C=CCOc1cccc(c1C(=O)C)F 34a_100011216272_100015514636 [1,1,0,0,0,0|2,0,0]=4 2653 B14R1.4432 C=CCOc1cccc(c1C(=O)C)F 7a_100011216272_100015514636 [1,1,0,0,0,0|2,0,0]=4 2654 B14R1.4432 C=CCOc1cccc(c1C(=O)N)F 34a_100000701607_100015514636 [1,1,0,0,0,0|1,0,0]=3 2655 B14R1.4432 C=CCOc1cccc(c1C(=O)N)F 7a_100000701607_100015514636 [1,1,0,0,0,0|1,0,0]=3 2656 B14R1.4432 C=CCSc1cccc(c1C(=O)N)Cl 62a_100010147686_100000210623 [1,1,0,0,0,0|1,1,0]=4 2657 B14R1.4432 C=CCSc1cccc(c1C(=O)N)F 62a_100011219063_100000210623 [1,1,0,0,0,0|1,1,0]=4 2658 B14R1.4432 CC(=O)c1c(cccc1OCC=O)Br 34a_100010174959_200009817547 [1,1,0,0,0,0|1,0,0]=3 2659 B14R1.4432 CC(=O)c1c(cccc1OCC=O)Br 7a_100010174959_200015260668 [1,1,0,0,0,0|1,0,0]=3 2660 B14R1.4432 CC(=O)c1c(cccc1OCC=O)C 34a_100009860897_200009817547 [1,1,0,0,0,0|1,0,0]=3 2661 B14R1.4432 CC(=O)c1c(cccc1OCC=O)C 7a_100009860897_200015260668 [1,1,0,0,0,0|1,0,0]=3 2662 B14R1.4432 CC(=O)c1c(cccc1OCC=O)Cl 34a_100000730630_200009817547 [1,1,0,0,0,0|1,0,0]=3 2663 B14R1.4432 CC(=O)c1c(cccc1OCC=O)Cl 7a_100000730630_200015260668 [1,1,0,0,0,0|1,0,0]=3 2664 B14R1.4432 CC(=O)c1c(cccc1OCC=O)F 34a_100011216272_200009817547 [1,1,0,0,0,0|1,0,0]=3 2665 B14R1.4432 CC(=O)c1c(cccc1OCC=O)F 7a_100011216272_200015260668 [1,1,0,0,0,0|1,0,0]=3 2666 B14R1.4432 CC(=O)c1c(cccc1OCCO)Br 34a_100010174959_100000211926 [1,1,0,0,0,0|1,0,1]=4 2667 B14R1.4432 CC(=O)c1c(cccc1OCCO)Br 7a_100010174959_100000211926 [1,1,0,0,0,0|1,0,1]=4 2668 B14R1.4432 CC(=O)c1c(cccc1OCCO)C 34a_100009860897_100000211926 [1,1,0,0,0,0|1,0,1]=4 2669 B14R1.4432 CC(=O)c1c(cccc1OCCO)C 7a_100009860897_100000211926 [1,1,0,0,0,0|1,0,1]=4 2670 B14R1.4432 CC(=O)c1c(cccc1OCCO)Cl 34a_100000730630_100000211926 [1,1,0,0,0,0|1,0,1]=4 2671 B14R1.4432 CC(=O)c1c(cccc1OCCO)Cl 7a_100000730630_100000211926 [1,1,0,0,0,0|1,0,1]=4 2672 B14R1.4432 CC(=O)c1c(cccc1OCCO)F 34a_100011216272_100000211926 [1,1,0,0,0,0|1,0,1]=4 2673 B14R1.4432 CC(=O)c1c(cccc1OCCO)F 7a_100011216272_100000211926 [1,1,0,0,0,0|1,0,1]=4 2674 B14R1.4432 CC(=O)c1c(cccc1SCC=O)F 62a_100012351873_200015260668 [1,1,0,0,0,0|1,1,0]=4 2675 B14R1.4432 CCCOc1cccc(c1C(=O)N)F 34a_100000701607_100000210303 [1,1,0,0,0,0|1,0,1]=4 2676 B14R1.4432 CCCOc1cccc(c1C(=O)N)F 7a_100000701607_100000210303 [1,1,0,0,0,0|1,0,1]=4 2677 B14R1.4432 CSCOc1cccc(c1C(=O)N)F 34a_100000701607_100011218213 [1,1,0,0,0,0|2,0,0]=4 2678 B14R1.4432 Cc1cccc(c1C(=O)N)NCC=O 34a_100102558177_200009817547 [1,1,0,0,0,0|1,0,0]=3 2679 B14R1.4432 Cc1cccc(c1C(=O)N)NCC=O 7a_100102558177_200015260668 [1,1,0,0,0,0|1,0,0]=3 2680 B14R1.4432 Cc1cccc(c1C(=O)N)NCCO 34a_100102558177_100000211926 [1,1,0,0,0,0|1,0,1]=4 2681 B14R1.4432 Cc1cccc(c1C(=O)N)NCCO 7a_100102558177_100000211926 [1,1,0,0,0,0|1,0,1]=4 2682 B14R1.4432 Cc1cccc(c1[N+](=O)[O-])OCC=O 34a_100000740142_200009817547 [1,1,0,0,0,0|2,0,0]=4 2683 B14R1.4432 Cc1cccc(c1[N+](=O)[O-])OCC=O 7a_100000740142_200015260668 [1,1,0,0,0,0|2,0,0]=4 2684 B14R1.4432 N#CCOc1cccc(c1C(=O)N)F 7a_100000701607_100011215382 [1,1,0,0,0,0|1,0,1]=4 2685 B14R1.4432 NC(=O)c1c(cccc1NCC=O)Cl 34a_100000764435_200009817547 [1,1,0,0,0,0|1,0,0]=3 2686 B14R1.4432 NC(=O)c1c(cccc1NCC=O)Cl 7a_100000764435_200015260668 [1,1,0,0,0,0|1,0,0]=3 2687 B14R1.4432 NC(=O)c1c(cccc1NCC=O)F 34a_100000036109_200009817547 [1,1,0,0,0,0|1,0,0]=3 2688 B14R1.4432 NC(=O)c1c(cccc1NCC=O)F 7a_100000036109_200015260668 [1,1,0,0,0,0|1,0,0]=3 2689 B14R1.4432 NC(=O)c1c(cccc1NCCO)Cl 34a_100000764435_100000211926 [1,1,0,0,0,0|1,0,1]=4 2690 B14R1.4432 NC(=O)c1c(cccc1NCCO)Cl 7a_100000764435_100000211926 [1,1,0,0,0,0|1,0,1]=4 2691 B14R1.4432 NC(=O)c1c(cccc1NCCO)F 27a_100000210304_100011219063 [1,1,0,0,0,0|1,0,1]=4 2692 B14R1.4432 NC(=O)c1c(cccc1NCCO)F 34a_100000036109_100000211926 [1,1,0,0,0,0|1,0,1]=4 2693 B14R1.4432 NC(=O)c1c(cccc1NCCO)F 7a_100000036109_100000211926 [1,1,0,0,0,0|1,0,1]=4 2694 B14R1.4432 NC(=O)c1c(cccc1OCC=O)F 34a_100000701607_200009817547 [1,1,0,0,0,0|0,0,0]=2 2695 B14R1.4432 NC(=O)c1c(cccc1OCC=O)F 7a_100000701607_200015260668 [1,1,0,0,0,0|0,0,0]=2 2696 B14R1.4432 NC(=O)c1c(cccc1OCCF)F 34a_100000701607_100011217306 [1,1,0,0,0,0|1,0,1]=4 2697 B14R1.4432 NC(=O)c1c(cccc1OCCF)F 7a_100000701607_100011217306 [1,1,0,0,0,0|1,0,1]=4 2698 B14R1.4432 NC(=O)c1c(cccc1OCCO)F 34a_100000701607_100000211926 [1,1,0,0,0,0|0,0,1]=3 2699 B14R1.4432 NC(=O)c1c(cccc1OCCO)F 7a_100000701607_100000211926 [1,1,0,0,0,0|0,0,1]=3 2700 B14R1.4432 NC(=O)c1c(cccc1SCC=O)Cl 62a_100010147686_200015260668 [1,1,0,0,0,0|0,1,0]=3 2701 B14R1.4432 NC(=O)c1c(cccc1SCC=O)F 62a_100011219063_200015260668 [1,1,0,0,0,0|0,1,0]=3 2702 B14R1.4432 NC(=O)c1c(cccc1SCCO)Cl 62a_100010147686_100000211926 [1,1,0,0,0,0|0,1,1]=4 2703 B14R1.4432 NC(=O)c1c(cccc1SCCO)F 62a_100011219063_100000211926 [1,1,0,0,0,0|0,1,1]=4 2704 B14R1.4432 NC(=O)c1c(cncc1SCC=O)F 62a_100010271514_200015260668 [1,1,0,0,0,0|1,1,0]=4 2705 B14R1.4432 NC(=O)c1c(cncc1SCC=O)F 62a_200015260668_100010271514 [1,1,0,0,0,0|1,1,0]=4 2706 B14R1.4432 O=CCOc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_200009817547 [1,1,0,0,0,0|2,0,0]=4 2707 B14R1.4432 O=CCOc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_200015260668 [1,1,0,0,0,0|2,0,0]=4 2708 B14R1.4432 O=CCOc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_200009817547 [1,1,0,0,0,0|2,0,0]=4 2709 B14R1.4432 O=CCOc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_200015260668 [1,1,0,0,0,0|2,0,0]=4 2710 B14R1.4432 O=CCOc1cccc(c1[N+](=O)[O-])F 34a_100011217962_200009817547 [1,1,0,0,0,0|2,0,0]=4 2711 B14R1.4432 O=CCOc1cccc(c1[N+](=O)[O-])F 7a_100011217962_200015260668 [1,1,0,0,0,0|2,0,0]=4 2712 B14R1.4432 O=CCOc1cccc(c1[N+](=O)[O-])I 7a_100010150324_200015260668 [1,1,0,0,0,0|2,0,0]=4 2713 B14R1.7480 C#CCOc1c(cccc1C(=O)N)Cl 34a_100009868166_100000184674 [1,1,0,0,0,0|1,0,1]=4 2714 B14R1.7480 C#CCOc1c(cccc1C(=O)N)Cl 7a_100009868166_100000038162 [1,1,0,0,0,0|1,0,1]=4 2715 B14R1.7480 C#CCOc1c(cccc1C(=O)N)F 34a_100009886295_100000184674 [1,1,0,0,0,0|1,0,1]=4 2716 B14R1.7480 C#CCOc1c(cccc1C(=O)N)F 7a_100009886295_100000038162 [1,1,0,0,0,0|1,0,1]=4 2717 B14R1.7480 C=CCNc1c(cccc1C(=O)N)C 34a_100000223273_100015514636 [1,1,0,0,0,0|2,0,0]=4 2718 B14R1.7480 C=CCNc1c(cccc1C(=O)N)Cl 34a_200011997947_100015514636 [1,1,0,0,0,0|2,0,0]=4 2719 B14R1.7480 C=CCNc1c(cccc1C(=O)N)F 34a_100011722151_100015514636 [1,1,0,0,0,0|2,0,0]=4 2720 B14R1.7480 C=CCOc1c(cccc1C(=O)C)C 34a_100009847209_100015514636 [1,1,0,0,0,0|2,0,0]=4 2721 B14R1.7480 C=CCOc1c(cccc1C(=O)C)C 7a_100009847209_100015514636 [1,1,0,0,0,0|2,0,0]=4 2722 B14R1.7480 C=CCOc1c(cccc1C(=O)C)Cl 34a_100000043392_100015514636 [1,1,0,0,0,0|2,0,0]=4 2723 B14R1.7480 C=CCOc1c(cccc1C(=O)C)Cl 7a_100000043392_100015514636 [1,1,0,0,0,0|2,0,0]=4 2724 B14R1.7480 C=CCOc1c(cccc1C(=O)C)F 34a_100011246037_100015514636 [1,1,0,0,0,0|2,0,0]=4 2725 B14R1.7480 C=CCOc1c(cccc1C(=O)C)F 7a_100011246037_100015514636 [1,1,0,0,0,0|2,0,0]=4 2726 B14R1.7480 C=CCOc1c(cccc1C(=O)N)Cl 34a_100009868166_100015514636 [1,1,0,0,0,0|1,0,0]=3 2727 B14R1.7480 C=CCOc1c(cccc1C(=O)N)Cl 7a_100009868166_100015514636 [1,1,0,0,0,0|1,0,0]=3 2728 B14R1.7480 C=CCOc1c(cccc1C(=O)N)F 34a_100009886295_100015514636 [1,1,0,0,0,0|1,0,0]=3 2729 B14R1.7480 C=CCOc1c(cccc1C(=O)N)F 7a_100009886295_100015514636 [1,1,0,0,0,0|1,0,0]=3 2730 B14R1.7480 C=CCSc1c(cccc1C(=O)N)C 62a_100000210623_200011409216 [1,1,0,0,0,0|1,1,0]=4 2731 B14R1.7480 C=CCSc1c(cccc1C(=O)N)C 62a_200011409216_100000210623 [1,1,0,0,0,0|1,1,0]=4 2732 B14R1.7480 C=CCSc1c(cccc1C(=O)N)F 62a_100000210623_200012351544 [1,1,0,0,0,0|1,1,0]=4 2733 B14R1.7480 C=CCSc1c(cccc1C(=O)N)F 62a_200012351544_100000210623 [1,1,0,0,0,0|1,1,0]=4 2734 B14R1.7480 CC(=O)c1cccc(c1OCC=O)C 34a_100009847209_200009817547 [1,1,0,0,0,0|1,0,0]=3 2735 B14R1.7480 CC(=O)c1cccc(c1OCC=O)C 7a_100009847209_200015260668 [1,1,0,0,0,0|1,0,0]=3 2736 B14R1.7480 CC(=O)c1cccc(c1OCC=O)Cl 34a_100000043392_200009817547 [1,1,0,0,0,0|1,0,0]=3 2737 B14R1.7480 CC(=O)c1cccc(c1OCC=O)Cl 7a_100000043392_200015260668 [1,1,0,0,0,0|1,0,0]=3 2738 B14R1.7480 CC(=O)c1cccc(c1OCC=O)F 34a_100011246037_200009817547 [1,1,0,0,0,0|1,0,0]=3 2739 B14R1.7480 CC(=O)c1cccc(c1OCC=O)F 7a_100011246037_200015260668 [1,1,0,0,0,0|1,0,0]=3 2740 B14R1.7480 CC(=O)c1cccc(c1OCCO)C 34a_100009847209_100000211926 [1,1,0,0,0,0|1,0,1]=4 2741 B14R1.7480 CC(=O)c1cccc(c1OCCO)C 7a_100009847209_100000211926 [1,1,0,0,0,0|1,0,1]=4 2742 B14R1.7480 CC(=O)c1cccc(c1OCCO)Cl 34a_100000043392_100000211926 [1,1,0,0,0,0|1,0,1]=4 2743 B14R1.7480 CC(=O)c1cccc(c1OCCO)Cl 7a_100000043392_100000211926 [1,1,0,0,0,0|1,0,1]=4 2744 B14R1.7480 CC(=O)c1cccc(c1OCCO)F 34a_100011246037_100000211926 [1,1,0,0,0,0|1,0,1]=4 2745 B14R1.7480 CC(=O)c1cccc(c1OCCO)F 7a_100011246037_100000211926 [1,1,0,0,0,0|1,0,1]=4 2746 B14R1.7480 CC(=O)c1cccc(c1SCC=O)F 62a_100012362612_200015260668 [1,1,0,0,0,0|1,1,0]=4 2747 B14R1.7480 CC(=O)c1cccc(c1SCC=O)F 62a_200015260668_100012362612 [1,1,0,0,0,0|1,1,0]=4 2748 B14R1.7480 CCCOc1c(cccc1C(=O)N)Cl 34a_100009868166_100000210303 [1,1,0,0,0,0|1,0,1]=4 2749 B14R1.7480 CCCOc1c(cccc1C(=O)N)Cl 7a_100009868166_100000210303 [1,1,0,0,0,0|1,0,1]=4 2750 B14R1.7480 CCCOc1c(cccc1C(=O)N)F 34a_100009886295_100000210303 [1,1,0,0,0,0|1,0,1]=4 2751 B14R1.7480 CCCOc1c(cccc1C(=O)N)F 7a_100009886295_100000210303 [1,1,0,0,0,0|1,0,1]=4 2752 B14R1.7480 CSCOc1c(cccc1C(=O)N)Cl 34a_100009868166_100011218213 [1,1,0,0,0,0|2,0,0]=4 2753 B14R1.7480 CSCOc1c(cccc1C(=O)N)F 34a_100009886295_100011218213 [1,1,0,0,0,0|2,0,0]=4 2754 B14R1.7480 Cc1cccc(c1NCC=O)C(=O)N 34a_100000223273_200009817547 [1,1,0,0,0,0|1,0,0]=3 2755 B14R1.7480 Cc1cccc(c1NCCO)C(=O)N 34a_100000223273_100000211926 [1,1,0,0,0,0|1,0,1]=4 2756 B14R1.7480 Cc1cccc(c1OCC=O)[N+](=O)[O-] 34a_100000763257_200009817547 [1,1,0,0,0,0|2,0,0]=4 2757 B14R1.7480 Cc1cccc(c1OCC=O)[N+](=O)[O-] 7a_100000763257_200015260668 [1,1,0,0,0,0|2,0,0]=4 2758 B14R1.7480 Cc1cccc(c1SCC=O)C(=O)N 62a_200011409216_200015260668 [1,1,0,0,0,0|0,1,0]=3 2759 B14R1.7480 Cc1cccc(c1SCC=O)C(=O)N 62a_200015260668_200011409216 [1,1,0,0,0,0|0,1,0]=3 2760 B14R1.7480 Cc1cccc(c1SCCO)C(=O)N 62a_100000211926_200011409216 [1,1,0,0,0,0|0,1,1]=4 2761 B14R1.7480 Cc1cccc(c1SCCO)C(=O)N 62a_200011409216_100000211926 [1,1,0,0,0,0|0,1,1]=4 2762 B14R1.7480 N#CCOc1c(cccc1C(=O)N)Cl 7a_100009868166_100011215382 [1,1,0,0,0,0|1,0,1]=4 2763 B14R1.7480 N#CCOc1c(cccc1C(=O)N)F 7a_100009886295_100011215382 [1,1,0,0,0,0|1,0,1]=4 2764 B14R1.7480 NC(=O)c1cccc(c1NCC=O)Cl 34a_200011997947_200009817547 [1,1,0,0,0,0|1,0,0]=3 2765 B14R1.7480 NC(=O)c1cccc(c1NCC=O)F 34a_100011722151_200009817547 [1,1,0,0,0,0|1,0,0]=3 2766 B14R1.7480 NC(=O)c1cccc(c1NCCO)Cl 34a_200011997947_100000211926 [1,1,0,0,0,0|1,0,1]=4 2767 B14R1.7480 NC(=O)c1cccc(c1NCCO)F 34a_100011722151_100000211926 [1,1,0,0,0,0|1,0,1]=4 2768 B14R1.7480 NC(=O)c1cccc(c1OCC=O)Cl 34a_100009868166_200009817547 [1,1,0,0,0,0|0,0,0]=2 2769 B14R1.7480 NC(=O)c1cccc(c1OCC=O)Cl 7a_100009868166_200015260668 [1,1,0,0,0,0|0,0,0]=2 2770 B14R1.7480 NC(=O)c1cccc(c1OCC=O)F 34a_100009886295_200009817547 [1,1,0,0,0,0|0,0,0]=2 2771 B14R1.7480 NC(=O)c1cccc(c1OCC=O)F 7a_100009886295_200015260668 [1,1,0,0,0,0|0,0,0]=2 2772 B14R1.7480 NC(=O)c1cccc(c1OCCF)Cl 34a_100009868166_100011217306 [1,1,0,0,0,0|1,0,1]=4 2773 B14R1.7480 NC(=O)c1cccc(c1OCCF)Cl 7a_100009868166_100011217306 [1,1,0,0,0,0|1,0,1]=4 2774 B14R1.7480 NC(=O)c1cccc(c1OCCF)F 34a_100009886295_100011217306 [1,1,0,0,0,0|1,0,1]=4 2775 B14R1.7480 NC(=O)c1cccc(c1OCCF)F 7a_100009886295_100011217306 [1,1,0,0,0,0|1,0,1]=4 2776 B14R1.7480 NC(=O)c1cccc(c1OCCO)Cl 34a_100009868166_100000211926 [1,1,0,0,0,0|0,0,1]=3 2777 B14R1.7480 NC(=O)c1cccc(c1OCCO)Cl 7a_100009868166_100000211926 [1,1,0,0,0,0|0,0,1]=3 2778 B14R1.7480 NC(=O)c1cccc(c1OCCO)F 34a_100009886295_100000211926 [1,1,0,0,0,0|0,0,1]=3 2779 B14R1.7480 NC(=O)c1cccc(c1OCCO)F 7a_100009886295_100000211926 [1,1,0,0,0,0|0,0,1]=3 2780 B14R1.7480 NC(=O)c1cccc(c1SCC=O)F 62a_200012351544_200015260668 [1,1,0,0,0,0|0,1,0]=3 2781 B14R1.7480 NC(=O)c1cccc(c1SCC=O)F 62a_200015260668_200012351544 [1,1,0,0,0,0|0,1,0]=3 2782 B14R1.7480 NC(=O)c1cccc(c1SCCO)F 62a_100000211926_200012351544 [1,1,0,0,0,0|0,1,1]=4 2783 B14R1.7480 NC(=O)c1cccc(c1SCCO)F 62a_200012351544_100000211926 [1,1,0,0,0,0|0,1,1]=4 2784 B14R1.7480 O=CCOc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_200009817547 [1,1,0,0,0,0|2,0,0]=4 2785 B14R1.7480 O=CCOc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_200009817547 [1,1,0,0,0,0|2,0,0]=4 2786 B14R1.7480 O=CCOc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_200015260668 [1,1,0,0,0,0|2,0,0]=4 2787 B14R1.7480 O=CCOc1c(cccc1[N+](=O)[O-])F 34a_100000690172_200009817547 [1,1,0,0,0,0|2,0,0]=4 2788 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)N)Br 1626a_100012349972_100015343762 [0,1,0,0,1,0|2,0,0]=4 2789 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)N)C 11a_100011219537_100015343762 [0,1,0,0,1,0|2,0,0]=4 2790 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)N)C 1626a_100011219537_100015343762 [0,1,0,0,1,0|2,0,0]=4 2791 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)N)C 22a_100011219537_100000070787 [0,1,0,0,1,0|2,0,0]=4 2792 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)N)Cl 11a_100000738103_100015343762 [0,1,0,0,1,0|2,0,0]=4 2793 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)N)Cl 1626a_100000738103_100015343762 [0,1,0,0,1,0|2,0,0]=4 2794 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)N)F 11a_100011298637_100015343762 [0,1,0,0,1,0|2,0,0]=4 2795 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)N)F 1626a_100011298637_100015343762 [0,1,0,0,1,0|2,0,0]=4 2796 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)N)F 22a_100011298637_100000070787 [0,1,0,0,1,0|2,0,0]=4 2797 B14R1.164 CC(=O)Nc1cc(ccc1C(=O)N)O 22a_100012186684_100000070787 [0,1,0,0,1,0|2,0,0]=4 2798 B14R1.429 CC(=O)N(C)c1ccccc1C(=O)N 11a_100000184419_100015343762 [0,1,0,0,1,0|2,0,0]=4 2799 B14R1.429 CC(=O)N(C)c1ccccc1C(=O)N 1626a_100000184419_100015343762 [0,1,0,0,1,0|2,0,0]=4 2800 B14R1.744 CNC(=O)c1ccccc1NC(=O)C 11a_100000185696_100015343762 [0,1,0,0,1,0|2,0,0]=4 2801 B14R1.744 CNC(=O)c1ccccc1NC(=O)C 1626a_100000185696_100015343762 [0,1,0,0,1,0|2,0,0]=4 2802 B14R1.744 CNC(=O)c1ccccc1NC(=O)C 22a_100000185696_100000070787 [0,1,0,0,1,0|2,0,0]=4 2803 B14R1.744 CNC(=O)c1ccccc1OC(=O)C 240690a_100102657272_100000210466 [0,1,0,0,1,0|1,0,0]=3 2804 B14R1.744 COC(=O)c1ccccc1CC(=O)C 1458a_100000070787_100000744672 [0,1,0,0,1,0|2,0,0]=4 2805 B14R1.744 COC(=O)c1ccccc1CC(=O)C 1458a_100000695166_200000210301 [0,1,0,0,1,0|2,0,0]=4 2806 B14R1.744 COC(=O)c1ccccc1CC(=O)[13CH3] 1458a_100000695166_200025704644 [0,1,0,0,1,0|2,0,0]=4 2807 B14R1.815 CC(=O)Cc1ccccc1S(=O)(=O)N 1458a_100000070787_200137420970 [0,1,0,0,1,0|2,0,0]=4 2808 B14R1.4894 CC(=O)Nc1c(cccc1C(=O)N)Br 1626a_100010144993_100015343762 [0,1,0,0,1,0|2,0,0]=4 2809 B14R1.4894 CC(=O)Nc1c(cccc1C(=O)N)C 1626a_100000223273_100015343762 [0,1,0,0,1,0|2,0,0]=4 2810 B14R1.4894 CC(=O)Nc1c(cccc1C(=O)N)Cl 1626a_200011997947_100015343762 [0,1,0,0,1,0|2,0,0]=4 2811 B14R1.4894 CC(=O)Nc1c(cccc1C(=O)N)F 1626a_100011722151_100015343762 [0,1,0,0,1,0|2,0,0]=4 2812 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)N)C 11a_100102558177_100015343762 [0,1,0,0,1,0|2,0,0]=4 2813 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)N)C 1626a_100102558177_100015343762 [0,1,0,0,1,0|2,0,0]=4 2814 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)N)C 22a_100102558177_100000070787 [0,1,0,0,1,0|2,0,0]=4 2815 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)N)Cl 11a_100000764435_100015343762 [0,1,0,0,1,0|2,0,0]=4 2816 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)N)Cl 1626a_100000764435_100015343762 [0,1,0,0,1,0|2,0,0]=4 2817 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)N)F 11a_100000036109_100015343762 [0,1,0,0,1,0|2,0,0]=4 2818 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)N)F 1626a_100000036109_100015343762 [0,1,0,0,1,0|2,0,0]=4 2819 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)N)F 22a_100000036109_100000070787 [0,1,0,0,1,0|2,0,0]=4 2820 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)Br 11a_100000740421_100015343762 [0,1,0,0,1,0|2,0,0]=4 2821 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)Br 1626a_100000740421_100015343762 [0,1,0,0,1,0|2,0,0]=4 2822 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)Br 22a_100000740421_100000070787 [0,1,0,0,1,0|2,0,0]=4 2823 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)C 11a_100011692829_100015343762 [0,1,0,0,1,0|2,0,0]=4 2824 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)C 1626a_100011692829_100015343762 [0,1,0,0,1,0|2,0,0]=4 2825 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)C 22a_100011692829_100000070787 [0,1,0,0,1,0|2,0,0]=4 2826 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)Cl 11a_100000743835_100015343762 [0,1,0,0,1,0|2,0,0]=4 2827 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)Cl 1626a_100000743835_100015343762 [0,1,0,0,1,0|2,0,0]=4 2828 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)Cl 22a_100000743835_100000070787 [0,1,0,0,1,0|2,0,0]=4 2829 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)F 11a_100000741173_100015343762 [0,1,0,0,1,0|2,0,0]=4 2830 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)F 1626a_100000741173_100015343762 [0,1,0,0,1,0|2,0,0]=4 2831 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)N)F 22a_100000741173_100000070787 [0,1,0,0,1,0|2,0,0]=4 2832 B14R1.834 COC(=O)CSc1cscc1C(=O)N 62a_100000747449_100009817205 [0,1,0,0,1,0|1,1,0]=4 2833 B14R1.834 COC(=O)CSc1cscc1C(=O)N 62a_100009817205_100000747449 [0,1,0,0,1,0|1,1,0]=4 2834 B16R1.1330 CC(=O)Nc1ccccc1OCC(=O)CF 1458a_100011204883_100015361967 [0,1,0,0,0,1|2,0,0]=4 2835 B16R1.1330 CCC(=O)COc1ccccc1NC(=O)C 1458a_100011204883_100000210202 [0,1,0,0,0,1|2,0,0]=4 2836 B16R1.1330 CCC(=O)COc1ccccc1NC(=O)C 7a_100000185124_100000747405 [0,1,0,0,0,1|2,0,0]=4 2837 B16R1.1330 CCC(=O)COc1ccccc1NC(=S)N 7a_200000011649_100000747405 [0,1,0,0,0,1|1,1,0]=4 2838 B16R1.1330 CCC(=O)CSc1ccccc1CC(=O)N 62a_100000747405_200009814924 [0,1,0,0,0,1|1,1,0]=4 2839 B16R1.1330 CCC(=O)CSc1ccccc1CC(=O)N 62a_200009814924_100000747405 [0,1,0,0,0,1|1,1,0]=4 2840 B16R1.1330 CCC(=O)CSc1ccccc1NC(=O)N 62a_100000747405_100000742221 [0,1,0,0,0,1|1,1,0]=4 2841 B16R1.1330 CNC(=O)COc1ccccc1NC(=O)C 240690a_100102657272_100011204883 [0,1,0,0,0,1|2,0,0]=4 2842 B16R1.1330 CNC(=O)COc1ccccc1NC(=O)C 34a_100000185124_100000183359 [0,1,0,0,0,1|2,0,0]=4 2843 B16R1.1330 CNC(=O)COc1ccccc1NC(=O)C 527a_100102657272_100011204883 [0,1,0,0,0,1|2,0,0]=4 2844 B16R1.1330 CNC(=O)COc1ccccc1NC(=O)C 7a_100000185124_100000183359 [0,1,0,0,0,1|2,0,0]=4 2845 B16R1.1330 CNC(=O)COc1ccccc1NC(=S)N 7a_200000011649_100000183359 [0,1,0,0,0,1|1,1,0]=4 2846 B16R1.1330 CNC(=O)CSc1ccccc1CC(=O)N 62a_100000183359_200009814924 [0,1,0,0,0,1|1,1,0]=4 2847 B16R1.1330 CNC(=O)CSc1ccccc1CC(=O)N 62a_200009814924_100000183359 [0,1,0,0,0,1|1,1,0]=4 2848 B16R1.1330 CNC(=O)CSc1ccccc1NC(=O)N 62a_100000183359_100000742221 [0,1,0,0,0,1|1,1,0]=4 2849 B16R1.1330 COC(=O)CNc1ccccc1NC(=O)C 34a_100011193560_100000747449 [0,1,0,0,0,1|2,0,0]=4 2850 B16R1.1330 COC(=O)COc1ccccc1C=C(C)C 271570a_100102525489_200000173920 [0,1,0,0,0,1|2,0,0]=4 2851 B16R1.1330 COC(=O)COc1ccccc1NC(=O)C 34a_100000185124_100000747449 [0,1,0,0,0,1|1,0,0]=3 2852 B16R1.1330 COC(=O)COc1ccccc1NC(=O)C 7a_100000185124_100000747449 [0,1,0,0,0,1|1,0,0]=3 2853 B16R1.1330 COC(=O)COc1ccccc1NC(=S)N 7a_200000011649_100000747449 [0,1,0,0,0,1|0,1,0]=3 2854 B16R1.1330 COC(=O)COc1cccnc1NC(=O)C 34a_200000022013_100000747449 [0,1,0,0,0,1|2,0,0]=4 2855 B16R1.1330 COC(=O)COc1cccnc1NC(=O)C 7a_200000022013_100000747449 [0,1,0,0,0,1|2,0,0]=4 2856 B16R1.1330 COC(=O)CSc1ccccc1CC(=O)C 62a_100000747449_100011350739 [0,1,0,0,0,1|1,1,0]=4 2857 B16R1.1330 COC(=O)CSc1ccccc1CC(=O)C 62a_100011350739_100000747449 [0,1,0,0,0,1|1,1,0]=4 2858 B16R1.1330 COC(=O)CSc1ccccc1CC(=O)N 62a_100000747449_200009814924 [0,1,0,0,0,1|0,1,0]=3 2859 B16R1.1330 COC(=O)CSc1ccccc1CC(=O)N 62a_200009814924_100000747449 [0,1,0,0,0,1|0,1,0]=3 2860 B16R1.1330 COC(=O)CSc1ccccc1NC(=O)C 62a_100000747449_100000153524 [0,1,0,0,0,1|1,1,0]=4 2861 B16R1.1330 COC(=O)CSc1ccccc1NC(=O)N 62a_100000747449_100000742221 [0,1,0,0,0,1|0,1,0]=3 2862 B16R1.1330 COC(=O)CSc1ccccc1OC(=O)C 62a_100000051690_100000747449 [0,1,0,0,0,1|1,1,0]=4 2863 B16R1.1330 COC(=O)CSc1ccccc1OC(=O)C 62a_100000747449_100000051690 [0,1,0,0,0,1|1,1,0]=4 2864 B16R1.4413 C=C(C)COc1ccccc1CC(=O)NN 34a_200012021708_100000748629 [0,1,0,0,0,1|2,0,0]=4 2865 B16R1.4413 C=C(C)COc1ccccc1NC(=O)NC 2430a_100000243823_100102657272 [0,1,0,0,0,1|2,0,0]=4 2866 B16R1.4413 C=C(C)COc1ccccc1NC(=O)NC 512a_100000243823_100102657272 [0,1,0,0,0,1|2,0,0]=4 2867 B16R1.4413 C=C(F)COc1ccccc1CC(=O)NN 34a_200012021708_100009893438 [0,1,0,0,0,1|2,0,0]=4 2868 B16R1.4413 CC(O)COc1ccccc1CC(=O)NN 34a_200012021708_100011218427 [0,1,0,0,0,1|1,0,1]=4 2869 B16R1.4413 CNC(=O)Cc1ccccc1NCC(=O)N 2230a_100000738506_100000747473 [0,1,0,0,0,1|2,0,0]=4 2870 B16R1.4413 CNC(=O)Cc1ccccc1NCC(=O)N 34a_100000738506_100000187820 [0,1,0,0,0,1|2,0,0]=4 2871 B16R1.4413 CNC(=O)Cc1ccccc1NCC(=O)[O-] 34a_100000738506_100020667443 [0,1,0,0,0,1|1,0,1]=4 2872 B16R1.4413 CNC(=O)Cc1ccccc1SCC(=O)N 62a_100000747473_200009816160 [0,1,0,0,0,1|1,1,0]=4 2873 B16R1.4413 CNC(=O)Cc1ccccc1SCC(=O)N 62a_200009816160_100000747473 [0,1,0,0,0,1|1,1,0]=4 2874 B16R1.4413 CNC(=O)Cc1ccccc1SCC(=O)[O-] 62a_100020667443_200009816160 [0,1,0,0,0,1|0,1,1]=4 2875 B16R1.4413 CNC(=O)Cc1ccccc1SCC(=O)[O-] 62a_200009816160_100020667443 [0,1,0,0,0,1|0,1,1]=4 2876 B16R1.4413 CNC(=O)Nc1ccccc1SCC(=O)N 2430a_100000187061_100102657272 [0,1,0,0,0,1|1,1,0]=4 2877 B16R1.4413 CNC(=O)Nc1ccccc1SCC(=O)N 512a_100000187061_100102657272 [0,1,0,0,0,1|1,1,0]=4 2878 B16R1.4413 COC(=O)Cc1ccccc1OCC(=O)N 7a_100000758901_100000187820 [0,1,0,0,0,1|2,0,0]=4 2879 B16R1.4413 C[C@@H](O)COc1ccccc1CC(=O)NN 34a_200012021708_100009817552 [0,1,0,0,0,1|1,0,1]=4 2880 B16R1.4413 NC(=O)COc1ccccc1NC(=O)CCl 7a_100000014494_100000187820 [0,1,0,0,0,1|2,0,0]=4 2881 B16R1.4413 NCC(=O)Nc1ccccc1SCC(=O)N 62a_100000747473_100000683505 [0,1,0,0,0,1|1,1,0]=4 2882 B16R1.4413 NCC(=O)Nc1ccccc1SCC(=O)[O-] 62a_100020667443_100000683505 [0,1,0,0,0,1|0,1,1]=4 2883 B16R1.4413 NNC(=O)Cc1ccccc1OCC(=O)N 34a_200012021708_100000187820 [0,1,0,0,0,1|1,0,0]=3 2884 B16R1.4413 NNC(=O)Cc1ccccc1OCC(=O)[O-] 34a_200012021708_100020667443 [0,1,0,0,0,1|0,0,1]=3 2885 B16R1.4413 NNC(=O)Cc1ccccc1OC[N+](=O)[O-] 34a_200012021708_100000761209 [0,1,0,0,0,1|1,0,1]=4 2886 B16R1.4413 NNC(=O)Cc1ccccc1SCC(=O)N 62a_100000747473_200010210069 [0,1,0,0,0,1|1,1,0]=4 2887 B16R1.4413 NNC(=O)Cc1ccccc1SCC(=O)N 62a_200010210069_100000747473 [0,1,0,0,0,1|1,1,0]=4 2888 B16R1.4413 NNC(=O)Cc1ccccc1SCC(=O)[O-] 62a_100020667443_200010210069 [0,1,0,0,0,1|0,1,1]=4 2889 B16R1.4413 NNC(=O)Cc1ccccc1SCC(=O)[O-] 62a_200010210069_100020667443 [0,1,0,0,0,1|0,1,1]=4 2890 B16R1.8798 Cc1cccc(c1SCC(=O)N)CC(=O)N 62a_100000747473_100011096275 [0,1,0,0,0,1|1,1,0]=4 2891 B16R1.8798 Cc1cccc(c1SCC(=O)N)CC(=O)N 62a_100011096275_100000747473 [0,1,0,0,0,1|1,1,0]=4 2892 B16R1.8798 Cc1cccc(c1SCC(=O)[O-])CC(=O)N 62a_100011096275_100020667443 [0,1,0,0,0,1|0,1,1]=4 2893 B16R1.8798 Cc1cccc(c1SCC(=O)[O-])CC(=O)N 62a_100020667443_100011096275 [0,1,0,0,0,1|0,1,1]=4 2894 B16R1.11203 CC(=O)Nc1c(cccc1OCC(=O)N)C 34a_100000103797_100000187820 [0,1,0,0,0,1|2,0,0]=4 2895 B16R1.11203 CC(=O)Nc1c(cccc1OCC(=O)N)C 7a_100000103797_100000187820 [0,1,0,0,0,1|2,0,0]=4 2896 B16R1.11203 CC(=O)Nc1c(cccc1OCC(=O)[O-])C 34a_100000103797_100020667443 [0,1,0,0,0,1|1,0,1]=4 2897 B16R1.11406 CC(=O)Nc1ccc(cc1OCC(=O)N)C 34a_100000161862_100000187820 [0,1,0,0,0,1|2,0,0]=4 2898 B16R1.11406 CC(=O)Nc1ccc(cc1OCC(=O)N)C 7a_100000161862_100000187820 [0,1,0,0,0,1|2,0,0]=4 2899 B16R1.11406 CC(=O)Nc1ccc(cc1OCC(=O)[O-])C 34a_100000161862_100020667443 [0,1,0,0,0,1|1,0,1]=4 2900 B16R1.11434 CC(=O)Cc1cc(ccc1OCC(=O)N)Br 34a_200010006938_100000187820 [0,1,0,0,0,1|2,0,0]=4 2901 B16R1.11434 CC(=O)Cc1cc(ccc1OCC(=O)N)Br 7a_200010006938_100000187820 [0,1,0,0,0,1|2,0,0]=4 2902 B16R1.11434 CC(=O)Cc1cc(ccc1OCC(=O)[O-])Br 34a_200010006938_100020667443 [0,1,0,0,0,1|1,0,1]=4 2903 B16R1.11434 CC(=O)Nc1cc(ccc1OCC(=O)N)C 34a_100000035807_100000187820 [0,1,0,0,0,1|2,0,0]=4 2904 B16R1.11434 CC(=O)Nc1cc(ccc1OCC(=O)N)C 7a_100000035807_100000187820 [0,1,0,0,0,1|2,0,0]=4 2905 B16R1.11434 CC(=O)Nc1cc(ccc1OCC(=O)N)Cl 34a_100000012038_100000187820 [0,1,0,0,0,1|2,0,0]=4 2906 B16R1.11434 CC(=O)Nc1cc(ccc1OCC(=O)N)Cl 7a_100000012038_100000187820 [0,1,0,0,0,1|2,0,0]=4 2907 B16R1.11434 CC(=O)Nc1cc(ccc1OCC(=O)N)N 34a_100000070259_100000187820 [0,1,0,0,0,1|2,0,0]=4 2908 B16R1.11434 CC(=O)Nc1cc(ccc1OCC(=O)N)N 7a_100000070259_100000187820 [0,1,0,0,0,1|2,0,0]=4 2909 B16R1.11434 CC(=O)Nc1cc(ccc1OCC(=O)[O-])C 34a_100000035807_100020667443 [0,1,0,0,0,1|1,0,1]=4 2910 B16R1.11434 CC(=O)Nc1cc(ccc1OCC(=O)[O-])Cl 34a_100000012038_100020667443 [0,1,0,0,0,1|1,0,1]=4 2911 B16R1.11434 CC(=O)Nc1cc(ccc1OCC(=O)[O-])N 34a_100000070259_100020667443 [0,1,0,0,0,1|1,0,1]=4 2912 B16R1.12518 CC(=O)C(C)Oc1ccccc1NC(=S)N 7a_200000011649_100000179758 [0,1,0,0,0,1|1,1,0]=4 2913 B16R1.12518 CC(=O)C(C)Sc1ccccc1CC(=O)N 62a_100009814033_200009814924 [0,1,0,0,0,1|1,1,0]=4 2914 B16R1.12518 CC(=O)C(C)Sc1ccccc1CC(=O)N 62a_200009814924_100009814033 [0,1,0,0,0,1|1,1,0]=4 2915 B16R1.12518 CC(=O)C(C)Sc1ccccc1NC(=O)N 62a_100009814033_100000742221 [0,1,0,0,0,1|1,1,0]=4 2916 B16R1.12518 CC(=O)Nc1ccccc1OC(C)C(=O)C 7a_100000185124_100000179758 [0,1,0,0,0,1|2,0,0]=4 2917 B16R1.12518 CC(=O)Nc1ccccc1OC(C)C(=O)N 34a_100000185124_100000702099 [0,1,0,0,0,1|2,0,0]=4 2918 B16R1.12518 CC(=O)Nc1ccccc1OC(C)C(=O)N 7a_100000185124_100000702099 [0,1,0,0,0,1|2,0,0]=4 2919 B16R1.12518 CC(=O)Nc1ccccc1OC(F)C(=O)N 34a_100000185124_100009813875 [0,1,0,0,0,1|2,0,0]=4 2920 B16R1.12518 CC(=O)Nc1ccccc1OC(F)C(=O)N 7a_100000185124_100009813875 [0,1,0,0,0,1|2,0,0]=4 2921 B16R1.12518 CC(=O)Nc1ccccc1OC(F)C(=O)[O-] 34a_100000185124_100020610796 [0,1,0,0,0,1|1,0,1]=4 2922 B16R1.12518 CC(Oc1ccccc1NC(=S)N)C(=O)N 7a_200000011649_100000702099 [0,1,0,0,0,1|1,1,0]=4 2923 B16R1.12518 CC(Sc1ccccc1CC(=O)N)C(=O)N 62a_100000702099_200009814924 [0,1,0,0,0,1|1,1,0]=4 2924 B16R1.12518 CC(Sc1ccccc1CC(=O)N)C(=O)N 62a_200009814924_100000702099 [0,1,0,0,0,1|1,1,0]=4 2925 B16R1.12518 CC(Sc1ccccc1NC(=O)N)C(=O)N 62a_100000702099_100000742221 [0,1,0,0,0,1|1,1,0]=4 2926 B16R1.12518 NC(=O)C(F)Oc1ccccc1NC(=S)N 7a_200000011649_100009813875 [0,1,0,0,0,1|1,1,0]=4 2927 B16R1.12518 NC(=O)Cc1ccccc1SC(F)C(=O)N 62a_100009813875_200009814924 [0,1,0,0,0,1|1,1,0]=4 2928 B16R1.12518 NC(=O)Cc1ccccc1SC(F)C(=O)N 62a_200009814924_100009813875 [0,1,0,0,0,1|1,1,0]=4 2929 B16R1.12518 NC(=O)Cc1ccccc1SC(F)C(=O)[O-] 62a_100020610796_200009814924 [0,1,0,0,0,1|0,1,1]=4 2930 B16R1.12518 NC(=O)Cc1ccccc1SC(F)C(=O)[O-] 62a_200009814924_100020610796 [0,1,0,0,0,1|0,1,1]=4 2931 B16R1.12518 NC(=O)Nc1ccccc1SC(F)C(=O)N 62a_100009813875_100000742221 [0,1,0,0,0,1|1,1,0]=4 2932 B16R1.12518 NC(=O)Nc1ccccc1SC(F)C(=O)[O-] 62a_100020610796_100000742221 [0,1,0,0,0,1|0,1,1]=4 2933 B16R1.611 CC(=O)C(=O)CNc1ccccc1C(=O)N 34a_100000185089_100011261029 [0,1,0,0,0,1|2,0,0]=4 2934 B16R1.611 CC(=O)C(=O)COc1ccccc1C(=O)N 34a_100000192804_100011261029 [0,1,0,0,0,1|1,0,0]=3 2935 B16R1.611 CC(=O)C(=O)COc1cccnc1C(=O)N 34a_200011215183_100011261029 [0,1,0,0,0,1|2,0,0]=4 2936 B16R1.611 CC(=O)C(=O)COc1ccncc1C(=O)N 34a_200011998761_100011261029 [0,1,0,0,0,1|2,0,0]=4 2937 B16R1.611 CC(=O)C(=O)CSc1ccccc1C(=O)N 62a_100000162227_100011261029 [0,1,0,0,0,1|1,1,0]=4 2938 B16R1.611 CC(=O)C(=O)CSc1ccccc1C(=O)N 62a_100011261029_100000162227 [0,1,0,0,0,1|1,1,0]=4 2939 B16R1.1178 C=C(C)CCOc1ccccc1C(=O)NC 34a_100000185920_100000730704 [0,1,0,0,0,1|2,0,0]=4 2940 B16R1.1178 C=C(C)CCOc1ccccc1C(=O)NC 7a_100000185920_100000730704 [0,1,0,0,0,1|2,0,0]=4 2941 B16R1.1178 C=C(C)CCOc1ccccc1C(=O)NN 34a_100000186518_100000730704 [0,1,0,0,0,1|2,0,0]=4 2942 B16R1.1178 C=C(C)CCOc1ccccc1C(=O)NO 34a_100000188472_100000730704 [0,1,0,0,0,1|2,0,0]=4 2943 B16R1.1178 C=C(C)COCc1ccccc1C(=O)NC 34a_100009855793_100000748629 [0,1,0,0,0,1|2,0,0]=4 2944 B16R1.1178 C=C(C)COCc1ccccc1C(=O)NC 7a_100009855793_100000748629 [0,1,0,0,0,1|2,0,0]=4 2945 B16R1.1178 C=C(F)COCc1ccccc1C(=O)NC 34a_100009855793_100009893438 [0,1,0,0,0,1|2,0,0]=4 2946 B16R1.1178 C=C(F)COCc1ccccc1C(=O)NC 7a_100009855793_100000042424 [0,1,0,0,0,1|2,0,0]=4 2947 B16R1.1178 CC(=CCOc1ccccc1C(=O)NN)C 34a_100000186518_100000761012 [0,1,0,0,0,1|2,0,0]=4 2948 B16R1.1178 CC(=CCOc1ccccc1C(=O)NO)C 34a_100000188472_100000761012 [0,1,0,0,0,1|2,0,0]=4 2949 B16R1.1178 CC(=O)CCOc1ccccc1C(=O)CBr 7a_100000188908_100000053229 [0,1,0,0,0,1|2,0,0]=4 2950 B16R1.1178 CC(=O)CCSc1ccccc1C(=O)NN 62a_100000053229_100000190081 [0,1,0,0,0,1|1,1,0]=4 2951 B16R1.1178 CC(=O)CCSc1ccccc1C(=O)NN 62a_100000190081_100000053229 [0,1,0,0,0,1|1,1,0]=4 2952 B16R1.1178 CC(=O)OCOc1ccccc1C(=O)NN 34a_100000186518_100009813279 [0,1,0,0,0,1|1,0,0]=3 2953 B16R1.1178 CC(=O)OCOc1ccccc1C(=O)NO 34a_100000188472_100009813279 [0,1,0,0,0,1|1,0,0]=3 2954 B16R1.1178 CC(=O)OCSc1ccccc1C(=O)NN 62a_100000076356_100000190081 [0,1,0,0,0,1|1,1,0]=4 2955 B16R1.1178 CC(=O)OCSc1ccccc1C(=O)NN 62a_100000190081_100000076356 [0,1,0,0,0,1|1,1,0]=4 2956 B16R1.1178 CC(O)CCOc1ccccc1C(=O)NN 34a_100000186518_100012276601 [0,1,0,0,0,1|1,0,1]=4 2957 B16R1.1178 CC(O)CCOc1ccccc1C(=O)NO 34a_100000188472_100012276601 [0,1,0,0,0,1|1,0,1]=4 2958 B16R1.1178 CCC(=O)c1ccccc1OCCC(=O)C 7a_100000184720_100000053229 [0,1,0,0,0,1|2,0,0]=4 2959 B16R1.1178 CCC(=O)c1ccccc1OCCC(=O)N 7a_100000184720_100000744528 [0,1,0,0,0,1|2,0,0]=4 2960 B16R1.1178 CNC(=O)c1ccccc1COCC(=O)N 34a_100009855793_100000187820 [0,1,0,0,0,1|1,0,0]=3 2961 B16R1.1178 CNC(=O)c1ccccc1COCC(=O)N 7a_100009855793_100000187820 [0,1,0,0,0,1|1,0,0]=3 2962 B16R1.1178 CNC(=O)c1ccccc1COCC(=O)[O-] 34a_100009855793_100020667443 [0,1,0,0,0,1|0,0,1]=3 2963 B16R1.1178 CNC(=O)c1ccccc1COCC(C)O 34a_100009855793_100011218427 [0,1,0,0,0,1|1,0,1]=4 2964 B16R1.1178 CNC(=O)c1ccccc1COCC(C)O 7a_100009855793_100011218427 [0,1,0,0,0,1|1,0,1]=4 2965 B16R1.1178 CNC(=O)c1ccccc1COC[C@@H](C)O 34a_100009855793_100009817552 [0,1,0,0,0,1|1,0,1]=4 2966 B16R1.1178 CNC(=O)c1ccccc1COC[C@@H](C)O 7a_100009855793_100009817552 [0,1,0,0,0,1|1,0,1]=4 2967 B16R1.1178 CNC(=O)c1ccccc1COC[N+](=O)[O-] 34a_100009855793_100000761209 [0,1,0,0,0,1|1,0,1]=4 2968 B16R1.1178 CNC(=O)c1ccccc1NCCC(=O)N 27a_100000740010_100000155073 [0,1,0,0,0,1|2,0,0]=4 2969 B16R1.1178 CNC(=O)c1ccccc1NCCC(=O)N 34a_100000185696_100000731001 [0,1,0,0,0,1|2,0,0]=4 2970 B16R1.1178 CNC(=O)c1ccccc1NCOC(=O)C 34a_100000185696_100009813279 [0,1,0,0,0,1|2,0,0]=4 2971 B16R1.1178 CNC(=O)c1ccccc1OCC=C(C)C 34a_100000185920_100000761012 [0,1,0,0,0,1|2,0,0]=4 2972 B16R1.1178 CNC(=O)c1ccccc1OCC=C(C)C 7a_100000185920_100000761012 [0,1,0,0,0,1|2,0,0]=4 2973 B16R1.1178 CNC(=O)c1ccccc1OCCC(=O)C 7a_100000185920_100000053229 [0,1,0,0,0,1|1,0,0]=3 2974 B16R1.1178 CNC(=O)c1ccccc1OCCC(=O)N 34a_100000185920_100000731001 [0,1,0,0,0,1|1,0,0]=3 2975 B16R1.1178 CNC(=O)c1ccccc1OCCC(=O)N 7a_100000185920_100000744528 [0,1,0,0,0,1|1,0,0]=3 2976 B16R1.1178 CNC(=O)c1ccccc1OCCC(C)O 34a_100000185920_100012276601 [0,1,0,0,0,1|1,0,1]=4 2977 B16R1.1178 CNC(=O)c1ccccc1OCCC(C)O 7a_100000185920_100012276601 [0,1,0,0,0,1|1,0,1]=4 2978 B16R1.1178 CNC(=O)c1ccccc1OCOC(=O)C 34a_100000185920_100009813279 [0,1,0,0,0,1|1,0,0]=3 2979 B16R1.1178 CNC(=O)c1ccccc1SCCC(=O)C 62a_100000053229_100000155073 [0,1,0,0,0,1|1,1,0]=4 2980 B16R1.1178 CNC(=O)c1ccccc1SCCC(=O)C 62a_100000155073_100000053229 [0,1,0,0,0,1|1,1,0]=4 2981 B16R1.1178 CNC(=O)c1ccccc1SCCC(=O)N 62a_100000155073_100000744528 [0,1,0,0,0,1|1,1,0]=4 2982 B16R1.1178 CNC(=O)c1ccccc1SCCC(=O)N 62a_100000744528_100000155073 [0,1,0,0,0,1|1,1,0]=4 2983 B16R1.1178 CNC(=O)c1ccccc1SCOC(=O)C 62a_100000076356_100000155073 [0,1,0,0,0,1|1,1,0]=4 2984 B16R1.1178 CNC(=O)c1ccccc1SCOC(=O)C 62a_100000155073_100000076356 [0,1,0,0,0,1|1,1,0]=4 2985 B16R1.1178 CNC(=O)c1ncccc1OCCC(=O)C 7a_100011376092_100000053229 [0,1,0,0,0,1|2,0,0]=4 2986 B16R1.1178 CNC(=O)c1ncccc1OCCC(=O)N 34a_100011376092_100000731001 [0,1,0,0,0,1|2,0,0]=4 2987 B16R1.1178 CNC(=O)c1ncccc1OCCC(=O)N 7a_100011376092_100000744528 [0,1,0,0,0,1|2,0,0]=4 2988 B16R1.1178 CNC(=O)c1ncccc1OCOC(=O)C 34a_100011376092_100009813279 [0,1,0,0,0,1|2,0,0]=4 2989 B16R1.1178 COC(=O)c1ccccc1CNCC(=O)O 269956a_100016091260_100000744672 [0,1,0,0,0,1|2,0,0]=4 2990 B16R1.1178 COC(=O)c1ccccc1COCC(=O)C 34a_100000211253_100000744672 [0,1,0,0,0,1|2,0,0]=4 2991 B16R1.1178 COC(=O)c1ccccc1OCCC(=O)C 7a_100000150335_100000053229 [0,1,0,0,0,1|2,0,0]=4 2992 B16R1.1178 COC(=O)c1ccccc1OCCC(=O)N 7a_100000150335_100000744528 [0,1,0,0,0,1|2,0,0]=4 2993 B16R1.1178 NC(=O)CCOc1ccccc1C(=O)CBr 7a_100000188908_100000744528 [0,1,0,0,0,1|2,0,0]=4 2994 B16R1.1178 NC(=O)CCOc1ccccc1C(=O)NO 34a_100000188472_100000731001 [0,1,0,0,0,1|1,0,0]=3 2995 B16R1.1178 NNC(=O)c1ccccc1OCCC(=O)N 34a_100000186518_100000731001 [0,1,0,0,0,1|1,0,0]=3 2996 B16R1.1178 NNC(=O)c1ccccc1SCCC(=O)N 62a_100000190081_100000744528 [0,1,0,0,0,1|1,1,0]=4 2997 B16R1.1178 NNC(=O)c1ccccc1SCCC(=O)N 62a_100000744528_100000190081 [0,1,0,0,0,1|1,1,0]=4 2998 B16R1.3262 C#CC(=O)CCOc1ccccc1C(=O)C 1458a_100000211873_100000184561 [0,1,0,0,0,1|2,0,0]=4 2999 B16R1.3262 C=CC(=O)CCOc1ccccc1C(=O)C 1458a_100000185746_100000184561 [0,1,0,0,0,1|2,0,0]=4 3000 B16R1.3262 CC(=O)c1ccccc1OCCC(=O)CO 1458a_100000210174_100000184561 [0,1,0,0,0,1|1,0,0]=3 3001 B16R1.3262 CCC(=O)CCOc1ccccc1C(=O)C 1458a_100000210414_100000184561 [0,1,0,0,0,1|2,0,0]=4 3002 B16R1.3262 CNC(=O)CCNc1ccccc1C(=O)N 34a_100000185089_100012179268 [0,1,0,0,0,1|2,0,0]=4 3003 B16R1.3262 CNC(=O)CCOc1ccccc1C(=O)N 34a_100000192804_100012179268 [0,1,0,0,0,1|1,0,0]=3 3004 B16R1.3262 CNC(=O)CCOc1ccccc1C(=O)N 7a_100000192804_100000737683 [0,1,0,0,0,1|1,0,0]=3 3005 B16R1.3262 CNC(=O)CCOc1ccccc1C(=O)[O-] 7a_100015234032_100000737683 [0,1,0,0,0,1|2,0,0]=4 3006 B16R1.3262 CNC(=O)CCOc1ccccc1C(=S)N 7a_100000745089_100000737683 [0,1,0,0,0,1|1,1,0]=4 3007 B16R1.3262 CNC(=O)CCOc1cccnc1C(=O)N 34a_200011215183_100012179268 [0,1,0,0,0,1|2,0,0]=4 3008 B16R1.3262 CNC(=O)CCOc1cccnc1C(=O)N 7a_200011215183_100000737683 [0,1,0,0,0,1|2,0,0]=4 3009 B16R1.3262 CNC(=O)CCOc1ccncc1C(=O)N 34a_200011998761_100012179268 [0,1,0,0,0,1|2,0,0]=4 3010 B16R1.3262 CNC(=O)CCOc1cnccc1C(=O)N 7a_100012022987_100000737683 [0,1,0,0,0,1|2,0,0]=4 3011 B16R1.3262 CNC(=O)CCSc1ccccc1C(=O)N 62a_100000162227_100000737683 [0,1,0,0,0,1|1,1,0]=4 3012 B16R1.3262 CNC(=O)CCSc1ccccc1C(=O)N 62a_100000737683_100000162227 [0,1,0,0,0,1|1,1,0]=4 3013 B16R1.3262 COC(=O)CCNc1ccccc1C(=O)N 34a_100000185089_100000742370 [0,1,0,0,0,1|1,0,0]=3 3014 B16R1.3262 COC(=O)CCOc1ccccc1C(=O)N 34a_100000192804_100000742370 [0,1,0,0,0,1|0,0,0]=2 3015 B16R1.3262 COC(=O)CCOc1ccccc1C(=O)N 7a_100000192804_100000204255 [0,1,0,0,0,1|0,0,0]=2 3016 B16R1.3262 COC(=O)CCOc1ccccc1C(=O)[O-] 7a_100015234032_100000204255 [0,1,0,0,0,1|1,0,0]=3 3017 B16R1.3262 COC(=O)CCOc1ccccc1C(=S)N 7a_100000745089_100000204255 [0,1,0,0,0,1|0,1,0]=3 3018 B16R1.3262 COC(=O)CCOc1ccccc1[C@@H](C)N 34a_100025703389_100000742370 [0,1,0,0,0,1|1,0,1]=4 3019 B16R1.3262 COC(=O)CCOc1ccccc1[N+](=O)[O-] 34a_100000186319_100000742370 [0,1,0,0,0,1|2,0,0]=4 3020 B16R1.3262 COC(=O)CCOc1ccccc1[N+](=O)[O-] 7a_100000186319_100000204255 [0,1,0,0,0,1|2,0,0]=4 3021 B16R1.3262 COC(=O)CCOc1cccnc1C(=O)C 34a_100000087166_100000742370 [0,1,0,0,0,1|2,0,0]=4 3022 B16R1.3262 COC(=O)CCOc1cccnc1C(=O)C 7a_100000087166_100000204255 [0,1,0,0,0,1|2,0,0]=4 3023 B16R1.3262 COC(=O)CCOc1cccnc1C(=O)N 34a_200011215183_100000742370 [0,1,0,0,0,1|1,0,0]=3 3024 B16R1.3262 COC(=O)CCOc1cccnc1C(=O)N 7a_200011215183_100000204255 [0,1,0,0,0,1|1,0,0]=3 3025 B16R1.3262 COC(=O)CCOc1ccncc1C(=O)N 34a_200011998761_100000742370 [0,1,0,0,0,1|1,0,0]=3 3026 B16R1.3262 COC(=O)CCOc1cnccc1C(=O)C 7a_100009872882_100000204255 [0,1,0,0,0,1|2,0,0]=4 3027 B16R1.3262 COC(=O)CCOc1cnccc1C(=O)N 7a_100012022987_100000204255 [0,1,0,0,0,1|1,0,0]=3 3028 B16R1.3262 COC(=O)CCOc1nccnc1C(=O)N 34a_100011830332_100000742370 [0,1,0,0,0,1|2,0,0]=4 3029 B16R1.3262 COC(=O)CCSc1ccccc1C(=O)C 62a_100000751169_100000204255 [0,1,0,0,0,1|1,1,0]=4 3030 B16R1.3262 COC(=O)CCSc1ccccc1C(=O)N 62a_100000162227_100000204255 [0,1,0,0,0,1|0,1,0]=3 3031 B16R1.3262 COC(=O)CCSc1ccccc1C(=O)N 62a_100000204255_100000162227 [0,1,0,0,0,1|0,1,0]=3 3032 B16R1.3262 COC(=O)CCSc1ccccc1C(=O)O 62a_100000204255_100000734275 [0,1,0,0,0,1|1,1,0]=4 3033 B16R1.3262 COC(=O)CCSc1ccccc1C(=O)O 62a_202125556159_100000204255 [0,1,0,0,0,1|1,1,0]=4 3034 B16R1.3262 COC(=O)CCSc1cccnc1C(=O)N 62a_100000204255_200012359670 [0,1,0,0,0,1|1,1,0]=4 3035 B16R1.3262 COC(=O)CCSc1cccnc1C(=O)N 62a_200012359670_100000204255 [0,1,0,0,0,1|1,1,0]=4 3036 B16R1.3262 COC(=O)CCSc1ccncc1C(=O)N 62a_100000204255_100000697804 [0,1,0,0,0,1|1,1,0]=4 3037 B16R1.3262 COC(=O)CCSc1ccncc1C(=O)N 62a_100000697804_100000204255 [0,1,0,0,0,1|1,1,0]=4 3038 B16R1.3262 COC(=O)CCSc1cnccc1C(=O)N 62a_100000204255_100010205435 [0,1,0,0,0,1|1,1,0]=4 3039 B16R1.3262 COC(=O)CCSc1cnccc1C(=O)N 62a_100010205435_100000204255 [0,1,0,0,0,1|1,1,0]=4 3040 B16R1.3262 COC(=O)CCSc1ncccc1C(=O)N 62a_100000162199_100000204255 [0,1,0,0,0,1|1,1,0]=4 3041 B16R1.3262 COC(=O)CCSc1ncccc1C(=O)N 62a_100000204255_100000162199 [0,1,0,0,0,1|1,1,0]=4 3042 B16R1.3262 COC(=O)CNCc1ccccc1C(=O)O 269956a_100015183376_100000747449 [0,1,0,0,0,1|2,0,0]=4 3043 B16R1.3262 COC(=O)COCc1ccccc1[N+](=O)[O-] 7a_100011218404_100000747449 [0,1,0,0,0,1|2,0,0]=4 3044 B16R1.3262 COC(=O)OCSc1ccccc1C(=O)C 62a_100000751169_100000139417 [0,1,0,0,0,1|1,1,0]=4 3045 B16R1.3262 COC(=O)OCSc1ccccc1C(=O)N 62a_100000162227_100000139417 [0,1,0,0,0,1|0,1,0]=3 3046 B16R1.3262 COC(=O)OCSc1ccccc1C(=O)O 62a_202125556159_100000139417 [0,1,0,0,0,1|1,1,0]=4 3047 B16R1.3262 COC(=O)OCSc1cccnc1C(=O)N 62a_200012359670_100000139417 [0,1,0,0,0,1|1,1,0]=4 3048 B16R1.3262 COC(=O)OCSc1ccncc1C(=O)N 62a_100000697804_100000139417 [0,1,0,0,0,1|1,1,0]=4 3049 B16R1.3262 COC(=O)OCSc1cnccc1C(=O)N 62a_100010205435_100000139417 [0,1,0,0,0,1|1,1,0]=4 3050 B16R1.3262 COC(=O)OCSc1ncccc1C(=O)N 62a_100000162199_100000139417 [0,1,0,0,0,1|1,1,0]=4 3051 B16R1.3262 O=C(CO)CCOc1ccccc1[N+](=O)[O-] 1458a_100000210174_100000741959 [0,1,0,0,0,1|2,0,0]=4 3052 B16R1.4547 CC(=O)CCN(C)c1ccccc1C(=O)N 269982a_100000184419_100000053229 [0,1,0,0,0,1|2,0,0]=4 3053 B16R1.4547 CC(=O)OCN(C)c1ccccc1C(=O)N 269982a_100000184419_100000076356 [0,1,0,0,0,1|2,0,0]=4 3054 B16R1.4547 CN(CCC(=O)N)c1ccccc1C(=O)N 269982a_100000184419_100000744528 [0,1,0,0,0,1|2,0,0]=4 3055 B16R1.8797 C=C(C)CCOc1c(cccc1C(=O)N)Cl 34a_100009868166_100000730704 [0,1,0,0,0,1|2,0,0]=4 3056 B16R1.8797 C=C(C)CCOc1c(cccc1C(=O)N)Cl 7a_100009868166_100000730704 [0,1,0,0,0,1|2,0,0]=4 3057 B16R1.8797 C=C(C)CCOc1c(cccc1C(=O)N)F 34a_100009886295_100000730704 [0,1,0,0,0,1|2,0,0]=4 3058 B16R1.8797 C=C(C)CCOc1c(cccc1C(=O)N)F 7a_100009886295_100000730704 [0,1,0,0,0,1|2,0,0]=4 3059 B16R1.8797 CC(=CCOc1c(cccc1C(=O)N)Cl)C 34a_100009868166_100000761012 [0,1,0,0,0,1|2,0,0]=4 3060 B16R1.8797 CC(=CCOc1c(cccc1C(=O)N)Cl)C 7a_100009868166_100000761012 [0,1,0,0,0,1|2,0,0]=4 3061 B16R1.8797 CC(=CCOc1c(cccc1C(=O)N)F)C 34a_100009886295_100000761012 [0,1,0,0,0,1|2,0,0]=4 3062 B16R1.8797 CC(=CCOc1c(cccc1C(=O)N)F)C 7a_100009886295_100000761012 [0,1,0,0,0,1|2,0,0]=4 3063 B16R1.8797 CC(=O)CCOc1c(cccc1C(=O)C)C 7a_100009847209_100000053229 [0,1,0,0,0,1|2,0,0]=4 3064 B16R1.8797 CC(=O)CCOc1c(cccc1C(=O)C)Cl 7a_100000043392_100000053229 [0,1,0,0,0,1|2,0,0]=4 3065 B16R1.8797 CC(=O)CCOc1c(cccc1C(=O)C)F 7a_100011246037_100000053229 [0,1,0,0,0,1|2,0,0]=4 3066 B16R1.8797 CC(=O)CCOc1c(cccc1C(=O)N)Cl 7a_100009868166_100000053229 [0,1,0,0,0,1|1,0,0]=3 3067 B16R1.8797 CC(=O)CCOc1c(cccc1C(=O)N)F 7a_100009886295_100000053229 [0,1,0,0,0,1|1,0,0]=3 3068 B16R1.8797 CC(=O)CCSc1c(cccc1C(=O)N)C 62a_100000053229_200011409216 [0,1,0,0,0,1|1,1,0]=4 3069 B16R1.8797 CC(=O)CCSc1c(cccc1C(=O)N)C 62a_200011409216_100000053229 [0,1,0,0,0,1|1,1,0]=4 3070 B16R1.8797 CC(=O)CCSc1c(cccc1C(=O)N)F 62a_100000053229_200012351544 [0,1,0,0,0,1|1,1,0]=4 3071 B16R1.8797 CC(=O)CCSc1c(cccc1C(=O)N)F 62a_200012351544_100000053229 [0,1,0,0,0,1|1,1,0]=4 3072 B16R1.8797 CC(=O)OCNc1c(cccc1C(=O)N)C 34a_100000223273_100009813279 [0,1,0,0,0,1|2,0,0]=4 3073 B16R1.8797 CC(=O)OCNc1c(cccc1C(=O)N)Cl 34a_200011997947_100009813279 [0,1,0,0,0,1|2,0,0]=4 3074 B16R1.8797 CC(=O)OCNc1c(cccc1C(=O)N)F 34a_100011722151_100009813279 [0,1,0,0,0,1|2,0,0]=4 3075 B16R1.8797 CC(=O)OCOc1c(cccc1C(=O)C)C 34a_100009847209_100009813279 [0,1,0,0,0,1|2,0,0]=4 3076 B16R1.8797 CC(=O)OCOc1c(cccc1C(=O)C)Cl 34a_100000043392_100009813279 [0,1,0,0,0,1|2,0,0]=4 3077 B16R1.8797 CC(=O)OCOc1c(cccc1C(=O)C)F 34a_100011246037_100009813279 [0,1,0,0,0,1|2,0,0]=4 3078 B16R1.8797 CC(=O)OCOc1c(cccc1C(=O)N)Cl 34a_100009868166_100009813279 [0,1,0,0,0,1|1,0,0]=3 3079 B16R1.8797 CC(=O)OCOc1c(cccc1C(=O)N)F 34a_100009886295_100009813279 [0,1,0,0,0,1|1,0,0]=3 3080 B16R1.8797 CC(=O)OCSc1c(cccc1C(=O)N)C 62a_100000076356_200011409216 [0,1,0,0,0,1|1,1,0]=4 3081 B16R1.8797 CC(=O)OCSc1c(cccc1C(=O)N)C 62a_200011409216_100000076356 [0,1,0,0,0,1|1,1,0]=4 3082 B16R1.8797 CC(=O)OCSc1c(cccc1C(=O)N)F 62a_100000076356_200012351544 [0,1,0,0,0,1|1,1,0]=4 3083 B16R1.8797 CC(=O)OCSc1c(cccc1C(=O)N)F 62a_200012351544_100000076356 [0,1,0,0,0,1|1,1,0]=4 3084 B16R1.8797 CC(=O)c1cccc(c1OCCC(=O)N)C 34a_100009847209_100000731001 [0,1,0,0,0,1|2,0,0]=4 3085 B16R1.8797 CC(=O)c1cccc(c1OCCC(=O)N)C 7a_100009847209_100000744528 [0,1,0,0,0,1|2,0,0]=4 3086 B16R1.8797 CC(=O)c1cccc(c1OCCC(=O)N)Cl 34a_100000043392_100000731001 [0,1,0,0,0,1|2,0,0]=4 3087 B16R1.8797 CC(=O)c1cccc(c1OCCC(=O)N)Cl 7a_100000043392_100000744528 [0,1,0,0,0,1|2,0,0]=4 3088 B16R1.8797 CC(=O)c1cccc(c1OCCC(=O)N)F 34a_100011246037_100000731001 [0,1,0,0,0,1|2,0,0]=4 3089 B16R1.8797 CC(=O)c1cccc(c1OCCC(=O)N)F 7a_100011246037_100000744528 [0,1,0,0,0,1|2,0,0]=4 3090 B16R1.8797 CC(O)CCOc1c(cccc1C(=O)N)Cl 34a_100009868166_100012276601 [0,1,0,0,0,1|1,0,1]=4 3091 B16R1.8797 CC(O)CCOc1c(cccc1C(=O)N)Cl 7a_100009868166_100012276601 [0,1,0,0,0,1|1,0,1]=4 3092 B16R1.8797 CC(O)CCOc1c(cccc1C(=O)N)F 34a_100009886295_100012276601 [0,1,0,0,0,1|1,0,1]=4 3093 B16R1.8797 CC(O)CCOc1c(cccc1C(=O)N)F 7a_100009886295_100012276601 [0,1,0,0,0,1|1,0,1]=4 3094 B16R1.8797 Cc1cccc(c1NCCC(=O)N)C(=O)N 34a_100000223273_100000731001 [0,1,0,0,0,1|2,0,0]=4 3095 B16R1.8797 Cc1cccc(c1SCCC(=O)N)C(=O)N 62a_100000744528_200011409216 [0,1,0,0,0,1|1,1,0]=4 3096 B16R1.8797 Cc1cccc(c1SCCC(=O)N)C(=O)N 62a_200011409216_100000744528 [0,1,0,0,0,1|1,1,0]=4 3097 B16R1.8797 NC(=O)CCNc1c(cccc1C(=O)N)Cl 34a_200011997947_100000731001 [0,1,0,0,0,1|2,0,0]=4 3098 B16R1.8797 NC(=O)CCNc1c(cccc1C(=O)N)F 34a_100011722151_100000731001 [0,1,0,0,0,1|2,0,0]=4 3099 B16R1.8797 NC(=O)CCOc1c(cccc1C(=O)N)Cl 34a_100009868166_100000731001 [0,1,0,0,0,1|1,0,0]=3 3100 B16R1.8797 NC(=O)CCOc1c(cccc1C(=O)N)Cl 7a_100009868166_100000744528 [0,1,0,0,0,1|1,0,0]=3 3101 B16R1.8797 NC(=O)CCOc1c(cccc1C(=O)N)F 34a_100009886295_100000731001 [0,1,0,0,0,1|1,0,0]=3 3102 B16R1.8797 NC(=O)CCOc1c(cccc1C(=O)N)F 7a_100009886295_100000744528 [0,1,0,0,0,1|1,0,0]=3 3103 B16R1.8797 NC(=O)CCSc1c(cccc1C(=O)N)F 62a_100000744528_200012351544 [0,1,0,0,0,1|1,1,0]=4 3104 B16R1.8797 NC(=O)CCSc1c(cccc1C(=O)N)F 62a_200012351544_100000744528 [0,1,0,0,0,1|1,1,0]=4 3105 B16R1.11222 C=C(C)CCOc1cccc(c1C(=O)N)F 34a_100000701607_100000730704 [0,1,0,0,0,1|2,0,0]=4 3106 B16R1.11222 C=C(C)CCOc1cccc(c1C(=O)N)F 7a_100000701607_100000730704 [0,1,0,0,0,1|2,0,0]=4 3107 B16R1.11222 CC(=CCOc1cccc(c1C(=O)N)F)C 34a_100000701607_100000761012 [0,1,0,0,0,1|2,0,0]=4 3108 B16R1.11222 CC(=CCOc1cccc(c1C(=O)N)F)C 7a_100000701607_100000761012 [0,1,0,0,0,1|2,0,0]=4 3109 B16R1.11222 CC(=O)CCNc1cccc(c1C(=O)N)C 7a_100102558177_100000053229 [0,1,0,0,0,1|2,0,0]=4 3110 B16R1.11222 CC(=O)CCNc1cccc(c1C(=O)N)Cl 7a_100000764435_100000053229 [0,1,0,0,0,1|2,0,0]=4 3111 B16R1.11222 CC(=O)CCNc1cccc(c1C(=O)N)F 7a_100000036109_100000053229 [0,1,0,0,0,1|2,0,0]=4 3112 B16R1.11222 CC(=O)CCOc1cccc(c1C(=O)C)Br 7a_100010174959_100000053229 [0,1,0,0,0,1|2,0,0]=4 3113 B16R1.11222 CC(=O)CCOc1cccc(c1C(=O)C)C 7a_100009860897_100000053229 [0,1,0,0,0,1|2,0,0]=4 3114 B16R1.11222 CC(=O)CCOc1cccc(c1C(=O)C)Cl 7a_100000730630_100000053229 [0,1,0,0,0,1|2,0,0]=4 3115 B16R1.11222 CC(=O)CCOc1cccc(c1C(=O)C)F 7a_100011216272_100000053229 [0,1,0,0,0,1|2,0,0]=4 3116 B16R1.11222 CC(=O)CCOc1cccc(c1C(=O)N)F 7a_100000701607_100000053229 [0,1,0,0,0,1|1,0,0]=3 3117 B16R1.11222 CC(=O)CCSc1cccc(c1C(=O)N)Cl 62a_100010147686_100000053229 [0,1,0,0,0,1|1,1,0]=4 3118 B16R1.11222 CC(=O)CCSc1cccc(c1C(=O)N)F 62a_100011219063_100000053229 [0,1,0,0,0,1|1,1,0]=4 3119 B16R1.11222 CC(=O)OCNc1cccc(c1C(=O)N)C 34a_100102558177_100009813279 [0,1,0,0,0,1|2,0,0]=4 3120 B16R1.11222 CC(=O)OCNc1cccc(c1C(=O)N)Cl 34a_100000764435_100009813279 [0,1,0,0,0,1|2,0,0]=4 3121 B16R1.11222 CC(=O)OCNc1cccc(c1C(=O)N)F 34a_100000036109_100009813279 [0,1,0,0,0,1|2,0,0]=4 3122 B16R1.11222 CC(=O)OCOc1cccc(c1C(=O)C)Br 34a_100010174959_100009813279 [0,1,0,0,0,1|2,0,0]=4 3123 B16R1.11222 CC(=O)OCOc1cccc(c1C(=O)C)C 34a_100009860897_100009813279 [0,1,0,0,0,1|2,0,0]=4 3124 B16R1.11222 CC(=O)OCOc1cccc(c1C(=O)C)Cl 34a_100000730630_100009813279 [0,1,0,0,0,1|2,0,0]=4 3125 B16R1.11222 CC(=O)OCOc1cccc(c1C(=O)C)F 34a_100011216272_100009813279 [0,1,0,0,0,1|2,0,0]=4 3126 B16R1.11222 CC(=O)OCOc1cccc(c1C(=O)N)F 34a_100000701607_100009813279 [0,1,0,0,0,1|1,0,0]=3 3127 B16R1.11222 CC(=O)OCSc1cccc(c1C(=O)N)Cl 62a_100010147686_100000076356 [0,1,0,0,0,1|1,1,0]=4 3128 B16R1.11222 CC(=O)OCSc1cccc(c1C(=O)N)F 62a_100011219063_100000076356 [0,1,0,0,0,1|1,1,0]=4 3129 B16R1.11222 CC(=O)c1c(cccc1OCCC(=O)N)Br 34a_100010174959_100000731001 [0,1,0,0,0,1|2,0,0]=4 3130 B16R1.11222 CC(=O)c1c(cccc1OCCC(=O)N)Br 7a_100010174959_100000744528 [0,1,0,0,0,1|2,0,0]=4 3131 B16R1.11222 CC(=O)c1c(cccc1OCCC(=O)N)C 34a_100009860897_100000731001 [0,1,0,0,0,1|2,0,0]=4 3132 B16R1.11222 CC(=O)c1c(cccc1OCCC(=O)N)C 7a_100009860897_100000744528 [0,1,0,0,0,1|2,0,0]=4 3133 B16R1.11222 CC(=O)c1c(cccc1OCCC(=O)N)Cl 34a_100000730630_100000731001 [0,1,0,0,0,1|2,0,0]=4 3134 B16R1.11222 CC(=O)c1c(cccc1OCCC(=O)N)Cl 7a_100000730630_100000744528 [0,1,0,0,0,1|2,0,0]=4 3135 B16R1.11222 CC(=O)c1c(cccc1OCCC(=O)N)F 34a_100011216272_100000731001 [0,1,0,0,0,1|2,0,0]=4 3136 B16R1.11222 CC(=O)c1c(cccc1OCCC(=O)N)F 7a_100011216272_100000744528 [0,1,0,0,0,1|2,0,0]=4 3137 B16R1.11222 CC(O)CCOc1cccc(c1C(=O)N)F 34a_100000701607_100012276601 [0,1,0,0,0,1|1,0,1]=4 3138 B16R1.11222 CC(O)CCOc1cccc(c1C(=O)N)F 7a_100000701607_100012276601 [0,1,0,0,0,1|1,0,1]=4 3139 B16R1.11222 Cc1cccc(c1C(=O)N)NCCC(=O)N 34a_100102558177_100000731001 [0,1,0,0,0,1|2,0,0]=4 3140 B16R1.11222 Cc1cccc(c1C(=O)N)NCCC(=O)N 7a_100102558177_100000744528 [0,1,0,0,0,1|2,0,0]=4 3141 B16R1.11222 NC(=O)CCNc1cccc(c1C(=O)N)Cl 34a_100000764435_100000731001 [0,1,0,0,0,1|2,0,0]=4 3142 B16R1.11222 NC(=O)CCNc1cccc(c1C(=O)N)Cl 7a_100000764435_100000744528 [0,1,0,0,0,1|2,0,0]=4 3143 B16R1.11222 NC(=O)CCNc1cccc(c1C(=O)N)F 27a_100000740010_100011219063 [0,1,0,0,0,1|2,0,0]=4 3144 B16R1.11222 NC(=O)CCNc1cccc(c1C(=O)N)F 34a_100000036109_100000731001 [0,1,0,0,0,1|2,0,0]=4 3145 B16R1.11222 NC(=O)CCNc1cccc(c1C(=O)N)F 7a_100000036109_100000744528 [0,1,0,0,0,1|2,0,0]=4 3146 B16R1.11222 NC(=O)CCOc1cccc(c1C(=O)N)F 34a_100000701607_100000731001 [0,1,0,0,0,1|1,0,0]=3 3147 B16R1.11222 NC(=O)CCOc1cccc(c1C(=O)N)F 7a_100000701607_100000744528 [0,1,0,0,0,1|1,0,0]=3 3148 B16R1.11222 NC(=O)CCSc1cccc(c1C(=O)N)Cl 62a_100010147686_100000744528 [0,1,0,0,0,1|1,1,0]=4 3149 B16R1.11222 NC(=O)CCSc1cccc(c1C(=O)N)F 62a_100011219063_100000744528 [0,1,0,0,0,1|1,1,0]=4 3150 B16R1.11451 C=C(C)CCOc1cc(ccc1C(=O)N)Br 34a_100011550861_100000730704 [0,1,0,0,0,1|2,0,0]=4 3151 B16R1.11451 C=C(C)CCOc1cc(ccc1C(=O)N)Br 7a_100011550861_100000730704 [0,1,0,0,0,1|2,0,0]=4 3152 B16R1.11451 C=C(C)CCOc1cc(ccc1C(=O)N)C 34a_100000192831_100000730704 [0,1,0,0,0,1|2,0,0]=4 3153 B16R1.11451 C=C(C)CCOc1cc(ccc1C(=O)N)C 7a_100000192831_100000730704 [0,1,0,0,0,1|2,0,0]=4 3154 B16R1.11451 C=C(C)CCOc1cc(ccc1C(=O)N)Cl 34a_100000192836_100000730704 [0,1,0,0,0,1|2,0,0]=4 3155 B16R1.11451 C=C(C)CCOc1cc(ccc1C(=O)N)Cl 7a_100000192836_100000730704 [0,1,0,0,0,1|2,0,0]=4 3156 B16R1.11451 C=C(C)CCOc1cc(ccc1C(=O)N)N 34a_100000223280_100000730704 [0,1,0,0,0,1|2,0,0]=4 3157 B16R1.11451 C=C(C)CCOc1cc(ccc1C(=O)N)N 7a_100000223280_100000730704 [0,1,0,0,0,1|2,0,0]=4 3158 B16R1.11451 CC(=CCOc1cc(ccc1C(=O)N)Br)C 34a_100011550861_100000761012 [0,1,0,0,0,1|2,0,0]=4 3159 B16R1.11451 CC(=CCOc1cc(ccc1C(=O)N)Br)C 7a_100011550861_100000761012 [0,1,0,0,0,1|2,0,0]=4 3160 B16R1.11451 CC(=CCOc1cc(ccc1C(=O)N)C)C 34a_100000192831_100000761012 [0,1,0,0,0,1|2,0,0]=4 3161 B16R1.11451 CC(=CCOc1cc(ccc1C(=O)N)C)C 7a_100000192831_100000761012 [0,1,0,0,0,1|2,0,0]=4 3162 B16R1.11451 CC(=CCOc1cc(ccc1C(=O)N)Cl)C 34a_100000192836_100000761012 [0,1,0,0,0,1|2,0,0]=4 3163 B16R1.11451 CC(=CCOc1cc(ccc1C(=O)N)Cl)C 7a_100000192836_100000761012 [0,1,0,0,0,1|2,0,0]=4 3164 B16R1.11451 CC(=CCOc1cc(ccc1C(=O)N)N)C 34a_100000223280_100000761012 [0,1,0,0,0,1|2,0,0]=4 3165 B16R1.11451 CC(=CCOc1cc(ccc1C(=O)N)N)C 7a_100000223280_100000761012 [0,1,0,0,0,1|2,0,0]=4 3166 B16R1.11451 CC(=O)CCNc1cc(ccc1C(=O)N)Br 7a_100012349972_100000053229 [0,1,0,0,0,1|2,0,0]=4 3167 B16R1.11451 CC(=O)CCNc1cc(ccc1C(=O)N)C 7a_100011219537_100000053229 [0,1,0,0,0,1|2,0,0]=4 3168 B16R1.11451 CC(=O)CCNc1cc(ccc1C(=O)N)Cl 7a_100000738103_100000053229 [0,1,0,0,0,1|2,0,0]=4 3169 B16R1.11451 CC(=O)CCOc1cc(ccc1C(=O)C)Br 7a_100000188348_100000053229 [0,1,0,0,0,1|2,0,0]=4 3170 B16R1.11451 CC(=O)CCOc1cc(ccc1C(=O)C)C 7a_100000234885_100000053229 [0,1,0,0,0,1|2,0,0]=4 3171 B16R1.11451 CC(=O)CCOc1cc(ccc1C(=O)C)Cl 7a_100000061402_100000053229 [0,1,0,0,0,1|2,0,0]=4 3172 B16R1.11451 CC(=O)CCOc1cc(ccc1C(=O)C)F 7a_100011215782_100000053229 [0,1,0,0,0,1|2,0,0]=4 3173 B16R1.11451 CC(=O)CCOc1cc(ccc1C(=O)N)Br 7a_100011550861_100000053229 [0,1,0,0,0,1|1,0,0]=3 3174 B16R1.11451 CC(=O)CCOc1cc(ccc1C(=O)N)C 7a_100000192831_100000053229 [0,1,0,0,0,1|1,0,0]=3 3175 B16R1.11451 CC(=O)CCOc1cc(ccc1C(=O)N)Cl 7a_100000192836_100000053229 [0,1,0,0,0,1|1,0,0]=3 3176 B16R1.11451 CC(=O)CCOc1cc(ccc1C(=O)N)N 7a_100000223280_100000053229 [0,1,0,0,0,1|1,0,0]=3 3177 B16R1.11451 CC(=O)CCSc1cc(ccc1C(=O)N)Br 62a_100009815748_100000053229 [0,1,0,0,0,1|1,1,0]=4 3178 B16R1.11451 CC(=O)CCSc1cc(ccc1C(=O)N)F 62a_100000053229_100000206404 [0,1,0,0,0,1|1,1,0]=4 3179 B16R1.11451 CC(=O)CCSc1cc(ccc1C(=O)N)F 62a_100000206404_100000053229 [0,1,0,0,0,1|1,1,0]=4 3180 B16R1.11451 CC(=O)OCNc1cc(ccc1C(=O)N)C 34a_100011219537_100009813279 [0,1,0,0,0,1|2,0,0]=4 3181 B16R1.11451 CC(=O)OCNc1cc(ccc1C(=O)N)Cl 34a_100000738103_100009813279 [0,1,0,0,0,1|2,0,0]=4 3182 B16R1.11451 CC(=O)OCNc1cc(ccc1C(=O)N)F 34a_100011298637_100009813279 [0,1,0,0,0,1|2,0,0]=4 3183 B16R1.11451 CC(=O)OCOc1cc(ccc1C(=O)C)C 34a_100000234885_100009813279 [0,1,0,0,0,1|2,0,0]=4 3184 B16R1.11451 CC(=O)OCOc1cc(ccc1C(=O)C)Cl 34a_100000061402_100009813279 [0,1,0,0,0,1|2,0,0]=4 3185 B16R1.11451 CC(=O)OCOc1cc(ccc1C(=O)N)Br 34a_100011550861_100009813279 [0,1,0,0,0,1|1,0,0]=3 3186 B16R1.11451 CC(=O)OCOc1cc(ccc1C(=O)N)C 34a_100000192831_100009813279 [0,1,0,0,0,1|1,0,0]=3 3187 B16R1.11451 CC(=O)OCOc1cc(ccc1C(=O)N)Cl 34a_100000192836_100009813279 [0,1,0,0,0,1|1,0,0]=3 3188 B16R1.11451 CC(=O)OCOc1cc(ccc1C(=O)N)N 34a_100000223280_100009813279 [0,1,0,0,0,1|1,0,0]=3 3189 B16R1.11451 CC(=O)OCSc1cc(ccc1C(=O)N)Br 62a_100009815748_100000076356 [0,1,0,0,0,1|1,1,0]=4 3190 B16R1.11451 CC(=O)OCSc1cc(ccc1C(=O)N)F 62a_100000076356_100000206404 [0,1,0,0,0,1|1,1,0]=4 3191 B16R1.11451 CC(=O)OCSc1cc(ccc1C(=O)N)F 62a_100000206404_100000076356 [0,1,0,0,0,1|1,1,0]=4 3192 B16R1.11451 CC(=O)c1ccc(cc1OCCC(=O)N)Br 7a_100000188348_100000744528 [0,1,0,0,0,1|2,0,0]=4 3193 B16R1.11451 CC(=O)c1ccc(cc1OCCC(=O)N)C 34a_100000234885_100000731001 [0,1,0,0,0,1|2,0,0]=4 3194 B16R1.11451 CC(=O)c1ccc(cc1OCCC(=O)N)C 7a_100000234885_100000744528 [0,1,0,0,0,1|2,0,0]=4 3195 B16R1.11451 CC(=O)c1ccc(cc1OCCC(=O)N)Cl 34a_100000061402_100000731001 [0,1,0,0,0,1|2,0,0]=4 3196 B16R1.11451 CC(=O)c1ccc(cc1OCCC(=O)N)Cl 7a_100000061402_100000744528 [0,1,0,0,0,1|2,0,0]=4 3197 B16R1.11451 CC(=O)c1ccc(cc1OCCC(=O)N)F 7a_100011215782_100000744528 [0,1,0,0,0,1|2,0,0]=4 3198 B16R1.11451 CC(O)CCOc1cc(ccc1C(=O)N)Br 34a_100011550861_100012276601 [0,1,0,0,0,1|1,0,1]=4 3199 B16R1.11451 CC(O)CCOc1cc(ccc1C(=O)N)Br 7a_100011550861_100012276601 [0,1,0,0,0,1|1,0,1]=4 3200 B16R1.11451 CC(O)CCOc1cc(ccc1C(=O)N)Cl 34a_100000192836_100012276601 [0,1,0,0,0,1|1,0,1]=4 3201 B16R1.11451 CC(O)CCOc1cc(ccc1C(=O)N)Cl 7a_100000192836_100012276601 [0,1,0,0,0,1|1,0,1]=4 3202 B16R1.11451 CC(O)CCOc1cc(ccc1C(=O)N)N 34a_100000223280_100012276601 [0,1,0,0,0,1|1,0,1]=4 3203 B16R1.11451 CC(O)CCOc1cc(ccc1C(=O)N)N 7a_100000223280_100012276601 [0,1,0,0,0,1|1,0,1]=4 3204 B16R1.11451 Cc1ccc(c(c1)NCCC(=O)N)C(=O)N 34a_100011219537_100000731001 [0,1,0,0,0,1|2,0,0]=4 3205 B16R1.11451 Cc1ccc(c(c1)NCCC(=O)N)C(=O)N 7a_100011219537_100000744528 [0,1,0,0,0,1|2,0,0]=4 3206 B16R1.11451 Cc1ccc(c(c1)OCCC(=O)N)C(=O)N 34a_100000192831_100000731001 [0,1,0,0,0,1|1,0,0]=3 3207 B16R1.11451 Cc1ccc(c(c1)OCCC(=O)N)C(=O)N 7a_100000192831_100000744528 [0,1,0,0,0,1|1,0,0]=3 3208 B16R1.11451 Cc1ccc(c(c1)OCCC(C)O)C(=O)N 34a_100000192831_100012276601 [0,1,0,0,0,1|1,0,1]=4 3209 B16R1.11451 Cc1ccc(c(c1)OCCC(C)O)C(=O)N 7a_100000192831_100012276601 [0,1,0,0,0,1|1,0,1]=4 3210 B16R1.11451 NC(=O)CCNc1cc(ccc1C(=O)N)Br 27a_100000740010_100009815748 [0,1,0,0,0,1|2,0,0]=4 3211 B16R1.11451 NC(=O)CCNc1cc(ccc1C(=O)N)Br 7a_100012349972_100000744528 [0,1,0,0,0,1|2,0,0]=4 3212 B16R1.11451 NC(=O)CCNc1cc(ccc1C(=O)N)Cl 34a_100000738103_100000731001 [0,1,0,0,0,1|2,0,0]=4 3213 B16R1.11451 NC(=O)CCNc1cc(ccc1C(=O)N)Cl 7a_100000738103_100000744528 [0,1,0,0,0,1|2,0,0]=4 3214 B16R1.11451 NC(=O)CCNc1cc(ccc1C(=O)N)F 27a_100000740010_100000206404 [0,1,0,0,0,1|2,0,0]=4 3215 B16R1.11451 NC(=O)CCNc1cc(ccc1C(=O)N)F 34a_100011298637_100000731001 [0,1,0,0,0,1|2,0,0]=4 3216 B16R1.11451 NC(=O)CCOc1cc(ccc1C(=O)N)Br 34a_100011550861_100000731001 [0,1,0,0,0,1|1,0,0]=3 3217 B16R1.11451 NC(=O)CCOc1cc(ccc1C(=O)N)Br 7a_100011550861_100000744528 [0,1,0,0,0,1|1,0,0]=3 3218 B16R1.11451 NC(=O)CCOc1cc(ccc1C(=O)N)Cl 34a_100000192836_100000731001 [0,1,0,0,0,1|1,0,0]=3 3219 B16R1.11451 NC(=O)CCOc1cc(ccc1C(=O)N)Cl 7a_100000192836_100000744528 [0,1,0,0,0,1|1,0,0]=3 3220 B16R1.11451 NC(=O)CCOc1cc(ccc1C(=O)N)N 34a_100000223280_100000731001 [0,1,0,0,0,1|1,0,0]=3 3221 B16R1.11451 NC(=O)CCOc1cc(ccc1C(=O)N)N 7a_100000223280_100000744528 [0,1,0,0,0,1|1,0,0]=3 3222 B16R1.11451 NC(=O)CCSc1cc(ccc1C(=O)N)Br 62a_100009815748_100000744528 [0,1,0,0,0,1|1,1,0]=4 3223 B16R1.11451 NC(=O)CCSc1cc(ccc1C(=O)N)F 62a_100000206404_100000744528 [0,1,0,0,0,1|1,1,0]=4 3224 B16R1.11451 NC(=O)CCSc1cc(ccc1C(=O)N)F 62a_100000744528_100000206404 [0,1,0,0,0,1|1,1,0]=4 3225 B16R1.11454 C=C(C)CCOc1ccc(cc1C(=O)N)Br 34a_100000192807_100000730704 [0,1,0,0,0,1|2,0,0]=4 3226 B16R1.11454 C=C(C)CCOc1ccc(cc1C(=O)N)Br 7a_100000192807_100000730704 [0,1,0,0,0,1|2,0,0]=4 3227 B16R1.11454 C=C(C)CCOc1ccc(cc1C(=O)N)C 34a_200000192840_100000730704 [0,1,0,0,0,1|2,0,0]=4 3228 B16R1.11454 C=C(C)CCOc1ccc(cc1C(=O)N)C 7a_200000192840_100000730704 [0,1,0,0,0,1|2,0,0]=4 3229 B16R1.11454 C=C(C)CCOc1ccc(cc1C(=O)N)Cl 34a_100000185026_100000730704 [0,1,0,0,0,1|2,0,0]=4 3230 B16R1.11454 C=C(C)CCOc1ccc(cc1C(=O)N)Cl 7a_100000185026_100000730704 [0,1,0,0,0,1|2,0,0]=4 3231 B16R1.11454 C=C(C)CCOc1ccc(cc1C(=O)N)F 34a_100012186459_100000730704 [0,1,0,0,0,1|2,0,0]=4 3232 B16R1.11454 C=C(C)CCOc1ccc(cc1C(=O)N)F 7a_100012186459_100000730704 [0,1,0,0,0,1|2,0,0]=4 3233 B16R1.11454 C=C(C)CCOc1ccc(cc1C(=O)N)I 34a_100000192813_100000730704 [0,1,0,0,0,1|2,0,0]=4 3234 B16R1.11454 C=C(C)CCOc1ccc(cc1C(=O)N)I 7a_100000192813_100000730704 [0,1,0,0,0,1|2,0,0]=4 3235 B16R1.11454 CC(=CCOc1ccc(cc1C(=O)N)Br)C 34a_100000192807_100000761012 [0,1,0,0,0,1|2,0,0]=4 3236 B16R1.11454 CC(=CCOc1ccc(cc1C(=O)N)Br)C 7a_100000192807_100000761012 [0,1,0,0,0,1|2,0,0]=4 3237 B16R1.11454 CC(=CCOc1ccc(cc1C(=O)N)C)C 34a_200000192840_100000761012 [0,1,0,0,0,1|2,0,0]=4 3238 B16R1.11454 CC(=CCOc1ccc(cc1C(=O)N)C)C 7a_200000192840_100000761012 [0,1,0,0,0,1|2,0,0]=4 3239 B16R1.11454 CC(=CCOc1ccc(cc1C(=O)N)Cl)C 34a_100000185026_100000761012 [0,1,0,0,0,1|2,0,0]=4 3240 B16R1.11454 CC(=CCOc1ccc(cc1C(=O)N)Cl)C 7a_100000185026_100000761012 [0,1,0,0,0,1|2,0,0]=4 3241 B16R1.11454 CC(=CCOc1ccc(cc1C(=O)N)F)C 34a_100012186459_100000761012 [0,1,0,0,0,1|2,0,0]=4 3242 B16R1.11454 CC(=CCOc1ccc(cc1C(=O)N)F)C 7a_100012186459_100000761012 [0,1,0,0,0,1|2,0,0]=4 3243 B16R1.11454 CC(=CCOc1ccc(cc1C(=O)N)I)C 34a_100000192813_100000761012 [0,1,0,0,0,1|2,0,0]=4 3244 B16R1.11454 CC(=CCOc1ccc(cc1C(=O)N)I)C 7a_100000192813_100000761012 [0,1,0,0,0,1|2,0,0]=4 3245 B16R1.11454 CC(=O)CCNc1ccc(cc1C(=O)N)Br 7a_100000740421_100000053229 [0,1,0,0,0,1|2,0,0]=4 3246 B16R1.11454 CC(=O)CCNc1ccc(cc1C(=O)N)Cl 7a_100000743835_100000053229 [0,1,0,0,0,1|2,0,0]=4 3247 B16R1.11454 CC(=O)CCNc1ccc(cc1C(=O)N)F 7a_100000741173_100000053229 [0,1,0,0,0,1|2,0,0]=4 3248 B16R1.11454 CC(=O)CCOc1ccc(cc1C(=O)C)Br 7a_100000212127_100000053229 [0,1,0,0,0,1|2,0,0]=4 3249 B16R1.11454 CC(=O)CCOc1ccc(cc1C(=O)C)C 7a_100000195442_100000053229 [0,1,0,0,0,1|2,0,0]=4 3250 B16R1.11454 CC(=O)CCOc1ccc(cc1C(=O)C)Cl 7a_100000185566_100000053229 [0,1,0,0,0,1|2,0,0]=4 3251 B16R1.11454 CC(=O)CCOc1ccc(cc1C(=O)C)F 7a_100000182812_100000053229 [0,1,0,0,0,1|2,0,0]=4 3252 B16R1.11454 CC(=O)CCOc1ccc(cc1C(=O)C)I 7a_100010712555_100000053229 [0,1,0,0,0,1|2,0,0]=4 3253 B16R1.11454 CC(=O)CCOc1ccc(cc1C(=O)N)Br 7a_100000192807_100000053229 [0,1,0,0,0,1|1,0,0]=3 3254 B16R1.11454 CC(=O)CCOc1ccc(cc1C(=O)N)C 7a_200000192840_100000053229 [0,1,0,0,0,1|1,0,0]=3 3255 B16R1.11454 CC(=O)CCOc1ccc(cc1C(=O)N)Cl 7a_100000185026_100000053229 [0,1,0,0,0,1|1,0,0]=3 3256 B16R1.11454 CC(=O)CCOc1ccc(cc1C(=O)N)F 7a_100012186459_100000053229 [0,1,0,0,0,1|1,0,0]=3 3257 B16R1.11454 CC(=O)CCOc1ccc(cc1C(=O)N)I 7a_100000192813_100000053229 [0,1,0,0,0,1|1,0,0]=3 3258 B16R1.11454 CC(=O)CCSc1ccc(cc1C(=O)N)Br 62a_200000162314_100000053229 [0,1,0,0,0,1|1,1,0]=4 3259 B16R1.11454 CC(=O)CCSc1ccc(cc1C(=O)N)C 62a_100000053229_200012349609 [0,1,0,0,0,1|1,1,0]=4 3260 B16R1.11454 CC(=O)CCSc1ccc(cc1C(=O)N)C 62a_200012349609_100000053229 [0,1,0,0,0,1|1,1,0]=4 3261 B16R1.11454 CC(=O)CCSc1ccc(cc1C(=O)N)F 62a_100000053229_100000206434 [0,1,0,0,0,1|1,1,0]=4 3262 B16R1.11454 CC(=O)CCSc1ccc(cc1C(=O)N)F 62a_100000206434_100000053229 [0,1,0,0,0,1|1,1,0]=4 3263 B16R1.11454 CC(=O)CCSc1ccc(cc1C(=O)N)N 62a_100015186447_100000053229 [0,1,0,0,0,1|1,1,0]=4 3264 B16R1.11454 CC(=O)OCNc1ccc(cc1C(=O)N)Br 34a_100000740421_100009813279 [0,1,0,0,0,1|2,0,0]=4 3265 B16R1.11454 CC(=O)OCNc1ccc(cc1C(=O)N)C 34a_100011692829_100009813279 [0,1,0,0,0,1|2,0,0]=4 3266 B16R1.11454 CC(=O)OCNc1ccc(cc1C(=O)N)Cl 34a_100000743835_100009813279 [0,1,0,0,0,1|2,0,0]=4 3267 B16R1.11454 CC(=O)OCNc1ccc(cc1C(=O)N)F 34a_100000741173_100009813279 [0,1,0,0,0,1|2,0,0]=4 3268 B16R1.11454 CC(=O)OCOc1ccc(cc1C(=O)C)Br 34a_100000212127_100009813279 [0,1,0,0,0,1|2,0,0]=4 3269 B16R1.11454 CC(=O)OCOc1ccc(cc1C(=O)C)C 34a_100000195442_100009813279 [0,1,0,0,0,1|2,0,0]=4 3270 B16R1.11454 CC(=O)OCOc1ccc(cc1C(=O)C)Cl 34a_100000185566_100009813279 [0,1,0,0,0,1|2,0,0]=4 3271 B16R1.11454 CC(=O)OCOc1ccc(cc1C(=O)C)N 34a_100011218865_100009813279 [0,1,0,0,0,1|2,0,0]=4 3272 B16R1.11454 CC(=O)OCOc1ccc(cc1C(=O)N)Br 34a_100000192807_100009813279 [0,1,0,0,0,1|1,0,0]=3 3273 B16R1.11454 CC(=O)OCOc1ccc(cc1C(=O)N)C 34a_200000192840_100009813279 [0,1,0,0,0,1|1,0,0]=3 3274 B16R1.11454 CC(=O)OCOc1ccc(cc1C(=O)N)Cl 34a_100000185026_100009813279 [0,1,0,0,0,1|1,0,0]=3 3275 B16R1.11454 CC(=O)OCOc1ccc(cc1C(=O)N)F 34a_100012186459_100009813279 [0,1,0,0,0,1|1,0,0]=3 3276 B16R1.11454 CC(=O)OCOc1ccc(cc1C(=O)N)I 34a_100000192813_100009813279 [0,1,0,0,0,1|1,0,0]=3 3277 B16R1.11454 CC(=O)OCSc1ccc(cc1C(=O)N)Br 62a_200000162314_100000076356 [0,1,0,0,0,1|1,1,0]=4 3278 B16R1.11454 CC(=O)OCSc1ccc(cc1C(=O)N)C 62a_100000076356_200012349609 [0,1,0,0,0,1|1,1,0]=4 3279 B16R1.11454 CC(=O)OCSc1ccc(cc1C(=O)N)C 62a_200012349609_100000076356 [0,1,0,0,0,1|1,1,0]=4 3280 B16R1.11454 CC(=O)OCSc1ccc(cc1C(=O)N)F 62a_100000076356_100000206434 [0,1,0,0,0,1|1,1,0]=4 3281 B16R1.11454 CC(=O)OCSc1ccc(cc1C(=O)N)F 62a_100000206434_100000076356 [0,1,0,0,0,1|1,1,0]=4 3282 B16R1.11454 CC(=O)OCSc1ccc(cc1C(=O)N)N 62a_100015186447_100000076356 [0,1,0,0,0,1|1,1,0]=4 3283 B16R1.11454 CC(=O)c1cc(ccc1OCCC(=O)N)Br 34a_100000212127_100000731001 [0,1,0,0,0,1|2,0,0]=4 3284 B16R1.11454 CC(=O)c1cc(ccc1OCCC(=O)N)Br 7a_100000212127_100000744528 [0,1,0,0,0,1|2,0,0]=4 3285 B16R1.11454 CC(=O)c1cc(ccc1OCCC(=O)N)C 34a_100000195442_100000731001 [0,1,0,0,0,1|2,0,0]=4 3286 B16R1.11454 CC(=O)c1cc(ccc1OCCC(=O)N)C 7a_100000195442_100000744528 [0,1,0,0,0,1|2,0,0]=4 3287 B16R1.11454 CC(=O)c1cc(ccc1OCCC(=O)N)Cl 34a_100000185566_100000731001 [0,1,0,0,0,1|2,0,0]=4 3288 B16R1.11454 CC(=O)c1cc(ccc1OCCC(=O)N)Cl 7a_100000185566_100000744528 [0,1,0,0,0,1|2,0,0]=4 3289 B16R1.11454 CC(=O)c1cc(ccc1OCCC(=O)N)F 7a_100000182812_100000744528 [0,1,0,0,0,1|2,0,0]=4 3290 B16R1.11454 CC(=O)c1cc(ccc1OCCC(=O)N)I 7a_100010712555_100000744528 [0,1,0,0,0,1|2,0,0]=4 3291 B16R1.11454 CC(=O)c1cc(ccc1OCCC(=O)N)N 34a_100011218865_100000731001 [0,1,0,0,0,1|2,0,0]=4 3292 B16R1.11454 CC(O)CCOc1ccc(cc1C(=O)N)Br 34a_100000192807_100012276601 [0,1,0,0,0,1|1,0,1]=4 3293 B16R1.11454 CC(O)CCOc1ccc(cc1C(=O)N)Br 7a_100000192807_100012276601 [0,1,0,0,0,1|1,0,1]=4 3294 B16R1.11454 CC(O)CCOc1ccc(cc1C(=O)N)Cl 34a_100000185026_100012276601 [0,1,0,0,0,1|1,0,1]=4 3295 B16R1.11454 CC(O)CCOc1ccc(cc1C(=O)N)Cl 7a_100000185026_100012276601 [0,1,0,0,0,1|1,0,1]=4 3296 B16R1.11454 CC(O)CCOc1ccc(cc1C(=O)N)F 34a_100012186459_100012276601 [0,1,0,0,0,1|1,0,1]=4 3297 B16R1.11454 CC(O)CCOc1ccc(cc1C(=O)N)F 7a_100012186459_100012276601 [0,1,0,0,0,1|1,0,1]=4 3298 B16R1.11454 CC(O)CCOc1ccc(cc1C(=O)N)I 34a_100000192813_100012276601 [0,1,0,0,0,1|1,0,1]=4 3299 B16R1.11454 CC(O)CCOc1ccc(cc1C(=O)N)I 7a_100000192813_100012276601 [0,1,0,0,0,1|1,0,1]=4 3300 B16R1.11454 Cc1ccc(c(c1)C(=O)N)NCCC(=O)N 34a_100011692829_100000731001 [0,1,0,0,0,1|2,0,0]=4 3301 B16R1.11454 Cc1ccc(c(c1)C(=O)N)OCCC(=O)N 34a_200000192840_100000731001 [0,1,0,0,0,1|1,0,0]=3 3302 B16R1.11454 Cc1ccc(c(c1)C(=O)N)OCCC(=O)N 7a_200000192840_100000744528 [0,1,0,0,0,1|1,0,0]=3 3303 B16R1.11454 Cc1ccc(c(c1)C(=O)N)OCCC(C)O 34a_200000192840_100012276601 [0,1,0,0,0,1|1,0,1]=4 3304 B16R1.11454 Cc1ccc(c(c1)C(=O)N)OCCC(C)O 7a_200000192840_100012276601 [0,1,0,0,0,1|1,0,1]=4 3305 B16R1.11454 Cc1ccc(c(c1)C(=O)N)SCCC(=O)N 62a_100000744528_200012349609 [0,1,0,0,0,1|1,1,0]=4 3306 B16R1.11454 Cc1ccc(c(c1)C(=O)N)SCCC(=O)N 62a_200012349609_100000744528 [0,1,0,0,0,1|1,1,0]=4 3307 B16R1.11454 NC(=O)CCNc1ccc(cc1C(=O)N)Br 27a_100000740010_200000162314 [0,1,0,0,0,1|2,0,0]=4 3308 B16R1.11454 NC(=O)CCNc1ccc(cc1C(=O)N)Br 34a_100000740421_100000731001 [0,1,0,0,0,1|2,0,0]=4 3309 B16R1.11454 NC(=O)CCNc1ccc(cc1C(=O)N)Br 7a_100000740421_100000744528 [0,1,0,0,0,1|2,0,0]=4 3310 B16R1.11454 NC(=O)CCNc1ccc(cc1C(=O)N)Cl 34a_100000743835_100000731001 [0,1,0,0,0,1|2,0,0]=4 3311 B16R1.11454 NC(=O)CCNc1ccc(cc1C(=O)N)Cl 7a_100000743835_100000744528 [0,1,0,0,0,1|2,0,0]=4 3312 B16R1.11454 NC(=O)CCNc1ccc(cc1C(=O)N)F 34a_100000741173_100000731001 [0,1,0,0,0,1|2,0,0]=4 3313 B16R1.11454 NC(=O)CCNc1ccc(cc1C(=O)N)F 7a_100000741173_100000744528 [0,1,0,0,0,1|2,0,0]=4 3314 B16R1.11454 NC(=O)CCOc1ccc(cc1C(=O)N)Br 34a_100000192807_100000731001 [0,1,0,0,0,1|1,0,0]=3 3315 B16R1.11454 NC(=O)CCOc1ccc(cc1C(=O)N)Br 7a_100000192807_100000744528 [0,1,0,0,0,1|1,0,0]=3 3316 B16R1.11454 NC(=O)CCOc1ccc(cc1C(=O)N)Cl 34a_100000185026_100000731001 [0,1,0,0,0,1|1,0,0]=3 3317 B16R1.11454 NC(=O)CCOc1ccc(cc1C(=O)N)Cl 7a_100000185026_100000744528 [0,1,0,0,0,1|1,0,0]=3 3318 B16R1.11454 NC(=O)CCOc1ccc(cc1C(=O)N)F 34a_100012186459_100000731001 [0,1,0,0,0,1|1,0,0]=3 3319 B16R1.11454 NC(=O)CCOc1ccc(cc1C(=O)N)F 7a_100012186459_100000744528 [0,1,0,0,0,1|1,0,0]=3 3320 B16R1.11454 NC(=O)CCOc1ccc(cc1C(=O)N)I 34a_100000192813_100000731001 [0,1,0,0,0,1|1,0,0]=3 3321 B16R1.11454 NC(=O)CCOc1ccc(cc1C(=O)N)I 7a_100000192813_100000744528 [0,1,0,0,0,1|1,0,0]=3 3322 B16R1.11454 NC(=O)CCSc1ccc(cc1C(=O)N)Br 62a_200000162314_100000744528 [0,1,0,0,0,1|1,1,0]=4 3323 B16R1.11454 NC(=O)CCSc1ccc(cc1C(=O)N)F 62a_100000206434_100000744528 [0,1,0,0,0,1|1,1,0]=4 3324 B16R1.11454 NC(=O)CCSc1ccc(cc1C(=O)N)F 62a_100000744528_100000206434 [0,1,0,0,0,1|1,1,0]=4 3325 B16R1.11454 NC(=O)CCSc1ccc(cc1C(=O)N)N 62a_100015186447_100000744528 [0,1,0,0,0,1|1,1,0]=4 3326 B16R1.12214 CC(C)(O)CCOc1ccccc1C(=O)N 34a_100000192804_100000702414 [0,1,0,0,0,1|1,0,1]=4 3327 B16R1.12214 CC(C)(O)CCOc1ccccc1C(=O)N 7a_100000192804_100000702414 [0,1,0,0,0,1|1,0,1]=4 3328 B16R1.12214 CS(=O)(=O)CCOc1ccccc1C(=O)N 34a_100000192804_100000731031 [0,1,0,0,0,1|1,0,1]=4 3329 B16R1.12214 CS(=O)(=O)CCOc1ccccc1C(=O)N 7a_100000192804_100000230027 [0,1,0,0,0,1|1,0,1]=4 3330 B16R1.12214 NC(=O)c1ccccc1OCCS(=O)(=O)[O-] 34a_100000192804_100000762736 [0,1,0,0,0,1|1,0,1]=4 3331 B16R1.12222 CC(=O)CCOc1ccccc1S(=O)(=O)N 1458a_100000070787_100010006755 [0,1,0,0,0,1|2,0,0]=4 3332 B16R1.12222 CC(=O)COCc1ccccc1S(=O)(=O)N 34a_100000211253_200137420970 [0,1,0,0,0,1|2,0,0]=4 3333 B16R1.12222 NS(=O)(=O)c1ccccc1CNCC(=O)O 269956a_100016091260_200137420970 [0,1,0,0,0,1|2,0,0]=4 3334 B16R1.12463 CC(=O)CC(=O)Nc1ccccc1C(=O)N 1458a_100000070787_100000182880 [0,1,0,0,0,1|2,0,0]=4 3335 B16R1.12463 CC(=O)OC(C)Sc1ccccc1C(=O)N 62a_100000162227_100009818208 [0,1,0,0,0,1|1,1,0]=4 3336 B16R1.12463 CC(=O)OC(C)Sc1ccccc1C(=O)N 62a_100009818208_100000162227 [0,1,0,0,0,1|1,1,0]=4 3337 B16R1.12463 NC(=O)CC(=O)Nc1ccccc1C(=O)N 22a_100000185089_100134613110 [0,1,0,0,0,1|2,0,0]=4 3338 B16R1.1175 CC(C)(O)COc1ccccc1C(=O)NN 34a_100000186518_100000764493 [0,2,0,0,0,0|1,0,1]=4 3339 B16R1.1175 CC(C)(O)COc1ccccc1C(=O)NO 34a_100000188472_100000764493 [0,2,0,0,0,0|1,0,1]=4 3340 B16R1.1175 CNC(=O)c1ccccc1OCC(C)(C)O 34a_100000185920_100000764493 [0,2,0,0,0,0|1,0,1]=4 3341 B16R1.1175 CNC(=O)c1ccccc1OCC(C)(C)O 7a_100000185920_100000764493 [0,2,0,0,0,0|1,0,1]=4 3342 B16R1.1175 CNC(=O)c1ccccc1OCS(=O)(=O)[O-] 34a_100000185920_100009817235 [0,2,0,0,0,0|1,0,1]=4 3343 B16R1.1175 NNC(=O)c1ccccc1OCS(=O)(=O)[O-] 34a_100000186518_100009817235 [0,2,0,0,0,0|1,0,1]=4 3344 B16R1.1175 O=C(NO)c1ccccc1OCS(=O)(=O)[O-] 34a_100000188472_100009817235 [0,2,0,0,0,0|1,0,1]=4 3345 B16R1.8800 CC(C)(O)COc1c(cccc1C(=O)N)Cl 34a_100009868166_100000764493 [0,2,0,0,0,0|1,0,1]=4 3346 B16R1.8800 CC(C)(O)COc1c(cccc1C(=O)N)Cl 7a_100009868166_100000764493 [0,2,0,0,0,0|1,0,1]=4 3347 B16R1.8800 CC(C)(O)COc1c(cccc1C(=O)N)F 34a_100009886295_100000764493 [0,2,0,0,0,0|1,0,1]=4 3348 B16R1.8800 CC(C)(O)COc1c(cccc1C(=O)N)F 7a_100009886295_100000764493 [0,2,0,0,0,0|1,0,1]=4 3349 B16R1.8800 NC(=O)c1cccc(c1OCS(=O)(=O)[O-])Cl 34a_100009868166_100009817235 [0,2,0,0,0,0|1,0,1]=4 3350 B16R1.8800 NC(=O)c1cccc(c1OCS(=O)(=O)[O-])F 34a_100009886295_100009817235 [0,2,0,0,0,0|1,0,1]=4 3351 B16R1.10380 CC(C)(CO)COc1ccccc1C(=O)N 34a_100000192804_100009813988 [0,2,0,0,0,0|1,0,1]=4 3352 B16R1.10380 CC(C)(CO)COc1ccccc1C(=O)N 7a_100000192804_100009813988 [0,2,0,0,0,0|1,0,1]=4 3353 B16R1.10380 COC(C)(C)COc1ccccc1C(=O)N 34a_100000192804_100000701081 [0,2,0,0,0,0|1,0,1]=4 3354 B16R1.11427 CC(C)(O)COc1cc(ccc1C(=O)N)Br 34a_100011550861_100000764493 [0,2,0,0,0,0|1,0,1]=4 3355 B16R1.11427 CC(C)(O)COc1cc(ccc1C(=O)N)Br 7a_100011550861_100000764493 [0,2,0,0,0,0|1,0,1]=4 3356 B16R1.11427 CC(C)(O)COc1cc(ccc1C(=O)N)Cl 34a_100000192836_100000764493 [0,2,0,0,0,0|1,0,1]=4 3357 B16R1.11427 CC(C)(O)COc1cc(ccc1C(=O)N)Cl 7a_100000192836_100000764493 [0,2,0,0,0,0|1,0,1]=4 3358 B16R1.11427 CC(C)(O)COc1cc(ccc1C(=O)N)N 34a_100000223280_100000764493 [0,2,0,0,0,0|1,0,1]=4 3359 B16R1.11427 CC(C)(O)COc1cc(ccc1C(=O)N)N 7a_100000223280_100000764493 [0,2,0,0,0,0|1,0,1]=4 3360 B16R1.11427 Cc1ccc(c(c1)OCC(C)(C)O)C(=O)N 34a_100000192831_100000764493 [0,2,0,0,0,0|1,0,1]=4 3361 B16R1.11427 Cc1ccc(c(c1)OCC(C)(C)O)C(=O)N 7a_100000192831_100000764493 [0,2,0,0,0,0|1,0,1]=4 3362 B16R1.11427 Cc1ccc(c(c1)OCS(=O)(=O)[O-])C(=O)N 34a_100000192831_100009817235 [0,2,0,0,0,0|1,0,1]=4 3363 B16R1.11427 NC(=O)c1ccc(cc1OCS(=O)(=O)[O-])Br 34a_100011550861_100009817235 [0,2,0,0,0,0|1,0,1]=4 3364 B16R1.11427 NC(=O)c1ccc(cc1OCS(=O)(=O)[O-])Cl 34a_100000192836_100009817235 [0,2,0,0,0,0|1,0,1]=4 3365 B16R1.11427 NC(=O)c1ccc(cc1OCS(=O)(=O)[O-])N 34a_100000223280_100009817235 [0,2,0,0,0,0|1,0,1]=4 3366 B16R1.54262 CC(C)(O)COc1cccc(c1C(=O)N)F 34a_100000701607_100000764493 [0,2,0,0,0,0|1,0,1]=4 3367 B16R1.54262 CC(C)(O)COc1cccc(c1C(=O)N)F 7a_100000701607_100000764493 [0,2,0,0,0,0|1,0,1]=4 3368 B16R1.54262 NC(=O)c1c(cccc1OCS(=O)(=O)[O-])F 34a_100000701607_100009817235 [0,2,0,0,0,0|1,0,1]=4 3369 B16R1.54827 CC(C)(O)COc1ccc(cc1C(=O)N)Br 34a_100000192807_100000764493 [0,2,0,0,0,0|1,0,1]=4 3370 B16R1.54827 CC(C)(O)COc1ccc(cc1C(=O)N)Br 7a_100000192807_100000764493 [0,2,0,0,0,0|1,0,1]=4 3371 B16R1.54827 CC(C)(O)COc1ccc(cc1C(=O)N)Cl 34a_100000185026_100000764493 [0,2,0,0,0,0|1,0,1]=4 3372 B16R1.54827 CC(C)(O)COc1ccc(cc1C(=O)N)Cl 7a_100000185026_100000764493 [0,2,0,0,0,0|1,0,1]=4 3373 B16R1.54827 CC(C)(O)COc1ccc(cc1C(=O)N)F 34a_100012186459_100000764493 [0,2,0,0,0,0|1,0,1]=4 3374 B16R1.54827 CC(C)(O)COc1ccc(cc1C(=O)N)F 7a_100012186459_100000764493 [0,2,0,0,0,0|1,0,1]=4 3375 B16R1.54827 CC(C)(O)COc1ccc(cc1C(=O)N)I 34a_100000192813_100000764493 [0,2,0,0,0,0|1,0,1]=4 3376 B16R1.54827 CC(C)(O)COc1ccc(cc1C(=O)N)I 7a_100000192813_100000764493 [0,2,0,0,0,0|1,0,1]=4 3377 B16R1.54827 Cc1ccc(c(c1)C(=O)N)OCC(C)(C)O 34a_200000192840_100000764493 [0,2,0,0,0,0|1,0,1]=4 3378 B16R1.54827 Cc1ccc(c(c1)C(=O)N)OCC(C)(C)O 7a_200000192840_100000764493 [0,2,0,0,0,0|1,0,1]=4 3379 B16R1.54827 Cc1ccc(c(c1)C(=O)N)OCS(=O)(=O)[O-] 34a_200000192840_100009817235 [0,2,0,0,0,0|1,0,1]=4 3380 B16R1.54827 NC(=O)c1cc(ccc1OCS(=O)(=O)[O-])Br 34a_100000192807_100009817235 [0,2,0,0,0,0|1,0,1]=4 3381 B16R1.54827 NC(=O)c1cc(ccc1OCS(=O)(=O)[O-])Cl 34a_100000185026_100009817235 [0,2,0,0,0,0|1,0,1]=4 3382 B16R1.54827 NC(=O)c1cc(ccc1OCS(=O)(=O)[O-])F 34a_100012186459_100009817235 [0,2,0,0,0,0|1,0,1]=4 3383 B16R1.54827 NC(=O)c1cc(ccc1OCS(=O)(=O)[O-])I 34a_100000192813_100009817235 [0,2,0,0,0,0|1,0,1]=4 3384 B16R1.959 C=C(C)COc1ccccc1C(=O)NCC 11a_100015525214_100000217157 [0,2,0,0,0,0|2,0,0]=4 3385 B16R1.959 C=C(C)COc1ccccc1C(=O)NCC 240690a_100015525214_100000217157 [0,2,0,0,0,0|2,0,0]=4 3386 B16R1.959 C=C(C)COc1ccccc1C(=O)NCC 34a_100000192205_100000748629 [0,2,0,0,0,0|2,0,0]=4 3387 B16R1.959 C=C(C)COc1ccccc1C(=O)NCC 527a_100015525214_100000217157 [0,2,0,0,0,0|2,0,0]=4 3388 B16R1.959 C=C(C)COc1ccccc1C(=O)NCC 7a_100000192205_100000748629 [0,2,0,0,0,0|2,0,0]=4 3389 B16R1.959 C=C(C)COc1ccccc1C(=O)NNC 22a_100016993582_100000217157 [0,2,0,0,0,0|2,0,0]=4 3390 B16R1.959 C=C(F)COc1ccccc1C(=O)NCC 34a_100000192205_100009893438 [0,2,0,0,0,0|2,0,0]=4 3391 B16R1.959 C=C(F)COc1ccccc1C(=O)NCC 7a_100000192205_100000042424 [0,2,0,0,0,0|2,0,0]=4 3392 B16R1.959 CCCC(=O)c1ccccc1OCC(=O)N 34a_200000073644_100000187820 [0,2,0,0,0,0|2,0,0]=4 3393 B16R1.959 CCCC(=O)c1ccccc1OCC(=O)N 7a_200000073644_100000187820 [0,2,0,0,0,0|2,0,0]=4 3394 B16R1.959 CCCC(=O)c1ccccc1OCC(=O)[O-] 34a_200000073644_100020667443 [0,2,0,0,0,0|1,0,1]=4 3395 B16R1.959 CCNC(=O)c1ccccc1NCC(=O)N 34a_100000205978_100000187820 [0,2,0,0,0,0|2,0,0]=4 3396 B16R1.959 CCNC(=O)c1ccccc1NCC(=O)[O-] 34a_100000205978_100020667443 [0,2,0,0,0,0|1,0,1]=4 3397 B16R1.959 CCNC(=O)c1ccccc1OCC(=O)N 34a_100000192205_100000187820 [0,2,0,0,0,0|1,0,0]=3 3398 B16R1.959 CCNC(=O)c1ccccc1OCC(=O)N 7a_100000192205_100000187820 [0,2,0,0,0,0|1,0,0]=3 3399 B16R1.959 CCNC(=O)c1ccccc1OCC(=O)[O-] 34a_100000192205_100020667443 [0,2,0,0,0,0|0,0,1]=3 3400 B16R1.959 CCNC(=O)c1ccccc1OCC(C)O 34a_100000192205_100011218427 [0,2,0,0,0,0|1,0,1]=4 3401 B16R1.959 CCNC(=O)c1ccccc1OCC(C)O 7a_100000192205_100011218427 [0,2,0,0,0,0|1,0,1]=4 3402 B16R1.959 CCNC(=O)c1ccccc1OC[C@@H](C)O 34a_100000192205_100009817552 [0,2,0,0,0,0|1,0,1]=4 3403 B16R1.959 CCNC(=O)c1ccccc1OC[C@@H](C)O 7a_100000192205_100009817552 [0,2,0,0,0,0|1,0,1]=4 3404 B16R1.959 CCNC(=O)c1ccccc1OC[N+](=O)[O-] 34a_100000192205_100000761209 [0,2,0,0,0,0|1,0,1]=4 3405 B16R1.959 CCNC(=O)c1ccccc1SCC(=O)N 11a_100015525214_100000180052 [0,2,0,0,0,0|1,1,0]=4 3406 B16R1.959 CCNC(=O)c1ccccc1SCC(=O)N 240690a_100015525214_100000180052 [0,2,0,0,0,0|1,1,0]=4 3407 B16R1.959 CCNC(=O)c1ccccc1SCC(=O)N 527a_100015525214_100000180052 [0,2,0,0,0,0|1,1,0]=4 3408 B16R1.959 CCNC(=O)c1ccccc1SCC(=O)N 62a_100000747473_200000155173 [0,2,0,0,0,0|1,1,0]=4 3409 B16R1.959 CCNC(=O)c1ccccc1SCC(=O)N 62a_200000155173_100000747473 [0,2,0,0,0,0|1,1,0]=4 3410 B16R1.959 CCNC(=O)c1ccccc1SCC(=O)[O-] 62a_100020667443_200000155173 [0,2,0,0,0,0|0,1,1]=4 3411 B16R1.959 CCNC(=O)c1ccccc1SCC(=O)[O-] 62a_200000155173_100020667443 [0,2,0,0,0,0|0,1,1]=4 3412 B16R1.959 CCOC(=O)c1ccccc1OCC(=O)N 7a_100000169922_100000187820 [0,2,0,0,0,0|2,0,0]=4 3413 B16R1.959 CNNC(=O)c1ccccc1SCC(=O)N 22a_100016993582_100000180052 [0,2,0,0,0,0|1,1,0]=4 3414 B16R1.959 CONC(=O)c1ccccc1NCC(=O)N 34a_100011599994_100000187820 [0,2,0,0,0,0|2,0,0]=4 3415 B16R1.959 CONC(=O)c1ccccc1NCC(=O)[O-] 34a_100011599994_100020667443 [0,2,0,0,0,0|1,0,1]=4 3416 B16R1.959 N#CCC(=O)c1ccccc1OCC(=O)N 7a_200009873261_100000187820 [0,2,0,0,0,0|1,0,1]=4 3417 B16R1.959 NC(=O)COc1ccccc1C(=O)CCCl 7a_100009873196_100000187820 [0,2,0,0,0,0|2,0,0]=4 3418 B16R1.1332 C=C(C#N)COc1ccccc1C(=O)NC 34a_100000185920_100000694840 [0,2,0,0,0,0|2,0,0]=4 3419 B16R1.1332 C=C(C#N)COc1ccccc1C(=O)NN 34a_100000186518_100000694840 [0,2,0,0,0,0|2,0,0]=4 3420 B16R1.1332 C=C(C#N)COc1ccccc1C(=O)NO 34a_100000188472_100000694840 [0,2,0,0,0,0|2,0,0]=4 3421 B16R1.1332 C=CC(O)COc1ccccc1C(=O)NC 34a_100000185920_100000730141 [0,2,0,0,0,0|1,0,1]=4 3422 B16R1.1332 C=CC(O)COc1ccccc1C(=O)NC 7a_100000185920_100000730141 [0,2,0,0,0,0|1,0,1]=4 3423 B16R1.1332 C=CC(O)COc1ccccc1C(=O)NN 34a_100000186518_100000730141 [0,2,0,0,0,0|1,0,1]=4 3424 B16R1.1332 C=CC(O)COc1ccccc1C(=O)NO 34a_100000188472_100000730141 [0,2,0,0,0,0|1,0,1]=4 3425 B16R1.1332 CCC(=O)COc1ccccc1C(=O)CBr 7a_100000188908_100000747405 [0,2,0,0,0,0|2,0,0]=4 3426 B16R1.1332 CCC(=O)COc1ccccc1C(=O)CC 7a_100000184720_100000747405 [0,2,0,0,0,0|2,0,0]=4 3427 B16R1.1332 CCC(=O)COc1ccccc1C(=O)NC 7a_100000185920_100000747405 [0,2,0,0,0,0|1,0,0]=3 3428 B16R1.1332 CCC(=O)COc1ccccc1C(=O)OC 7a_100000150335_100000747405 [0,2,0,0,0,0|2,0,0]=4 3429 B16R1.1332 CCC(=O)COc1cccnc1C(=O)NC 7a_100011376092_100000747405 [0,2,0,0,0,0|2,0,0]=4 3430 B16R1.1332 CCC(=O)CSc1ccccc1C(=O)NC 62a_100000155073_100000747405 [0,2,0,0,0,0|1,1,0]=4 3431 B16R1.1332 CCC(=O)CSc1ccccc1C(=O)NC 62a_100000747405_100000155073 [0,2,0,0,0,0|1,1,0]=4 3432 B16R1.1332 CCC(=O)CSc1ccccc1C(=O)NN 62a_100000190081_100000747405 [0,2,0,0,0,0|1,1,0]=4 3433 B16R1.1332 CCC(=O)CSc1ccccc1C(=O)NN 62a_100000747405_100000190081 [0,2,0,0,0,0|1,1,0]=4 3434 B16R1.1332 CCC(=O)c1ccccc1OCC(=O)NC 7a_100000184720_100000183359 [0,2,0,0,0,0|2,0,0]=4 3435 B16R1.1332 CCC(=O)c1ccccc1OCC(=O)OC 7a_100000184720_100000747449 [0,2,0,0,0,0|1,0,0]=3 3436 B16R1.1332 CCC(O)COc1ccccc1C(=O)NC 34a_100000185920_100011218378 [0,2,0,0,0,0|1,0,1]=4 3437 B16R1.1332 CCC(O)COc1ccccc1C(=O)NC 7a_100000185920_100011218378 [0,2,0,0,0,0|1,0,1]=4 3438 B16R1.1332 CCC(O)COc1ccccc1C(=O)NN 34a_100000186518_100011218378 [0,2,0,0,0,0|1,0,1]=4 3439 B16R1.1332 CCC(O)COc1ccccc1C(=O)NO 34a_100000188472_100011218378 [0,2,0,0,0,0|1,0,1]=4 3440 B16R1.1332 CNC(=O)CNc1ccccc1C(=O)NC 27a_100000693194_100000155073 [0,2,0,0,0,0|2,0,0]=4 3441 B16R1.1332 CNC(=O)CNc1ccccc1C(=O)NC 34a_100000185696_100000183359 [0,2,0,0,0,0|2,0,0]=4 3442 B16R1.1332 CNC(=O)COc1ccccc1C(=O)CBr 7a_100000188908_100000183359 [0,2,0,0,0,0|2,0,0]=4 3443 B16R1.1332 CNC(=O)COc1ccccc1C(=O)NC 34a_100000185920_100000183359 [0,2,0,0,0,0|1,0,0]=3 3444 B16R1.1332 CNC(=O)COc1ccccc1C(=O)NC 7a_100000185920_100000183359 [0,2,0,0,0,0|1,0,0]=3 3445 B16R1.1332 CNC(=O)COc1ccccc1C(=O)NN 34a_100000186518_100000183359 [0,2,0,0,0,0|1,0,0]=3 3446 B16R1.1332 CNC(=O)COc1ccccc1C(=O)NO 34a_100000188472_100000183359 [0,2,0,0,0,0|1,0,0]=3 3447 B16R1.1332 CNC(=O)COc1ccccc1C(=O)OC 7a_100000150335_100000183359 [0,2,0,0,0,0|2,0,0]=4 3448 B16R1.1332 CNC(=O)COc1cccnc1C(=O)NC 34a_100011376092_100000183359 [0,2,0,0,0,0|2,0,0]=4 3449 B16R1.1332 CNC(=O)COc1cccnc1C(=O)NC 7a_100011376092_100000183359 [0,2,0,0,0,0|2,0,0]=4 3450 B16R1.1332 CNC(=O)CSc1ccccc1C(=O)NC 62a_100000155073_100000183359 [0,2,0,0,0,0|1,1,0]=4 3451 B16R1.1332 CNC(=O)CSc1ccccc1C(=O)NC 62a_100000183359_100000155073 [0,2,0,0,0,0|1,1,0]=4 3452 B16R1.1332 CNC(=O)CSc1ccccc1C(=O)NN 62a_100000183359_100000190081 [0,2,0,0,0,0|1,1,0]=4 3453 B16R1.1332 CNC(=O)CSc1ccccc1C(=O)NN 62a_100000190081_100000183359 [0,2,0,0,0,0|1,1,0]=4 3454 B16R1.1332 CNC(=O)c1ccccc1NCC(=O)OC 34a_100000185696_100000747449 [0,2,0,0,0,0|1,0,0]=3 3455 B16R1.1332 CNC(=O)c1ccccc1OCC(=O)OC 34a_100000185920_100000747449 [0,2,0,0,0,0|0,0,0]=2 3456 B16R1.1332 CNC(=O)c1ccccc1OCC(=O)OC 7a_100000185920_100000747449 [0,2,0,0,0,0|0,0,0]=2 3457 B16R1.1332 CNC(=O)c1ccccc1OCC(O)CO 34a_100000185920_100011219619 [0,2,0,0,0,0|0,0,2]=4 3458 B16R1.1332 CNC(=O)c1ccccc1OCC(O)CO 7a_100000185920_100011219619 [0,2,0,0,0,0|0,0,2]=4 3459 B16R1.1332 CNC(=O)c1ccccc1OC[C@@H](C)CO 34a_100000185920_100000059175 [0,2,0,0,0,0|1,0,1]=4 3460 B16R1.1332 CNC(=O)c1ccccc1OC[C@@H](C)CO 7a_100000185920_100000059175 [0,2,0,0,0,0|1,0,1]=4 3461 B16R1.1332 CNC(=O)c1ccccc1OC[C@@H](O)CF 34a_100000185920_100015614560 [0,2,0,0,0,0|1,0,1]=4 3462 B16R1.1332 CNC(=O)c1ccccc1OC[C@@H](O)CF 7a_100000185920_100015614560 [0,2,0,0,0,0|1,0,1]=4 3463 B16R1.1332 CNC(=O)c1ccccc1OC[C@@H](O)CO 34a_100000185920_100009815848 [0,2,0,0,0,0|0,0,2]=4 3464 B16R1.1332 CNC(=O)c1ccccc1OC[C@@H](O)CO 7a_100000185920_100009815848 [0,2,0,0,0,0|0,0,2]=4 3465 B16R1.1332 CNC(=O)c1ccccc1SCC(=O)OC 62a_100000155073_100000747449 [0,2,0,0,0,0|0,1,0]=3 3466 B16R1.1332 CNC(=O)c1ccccc1SCC(=O)OC 62a_100000747449_100000155073 [0,2,0,0,0,0|0,1,0]=3 3467 B16R1.1332 CNC(=O)c1cccnc1SCC(=O)OC 62a_100000159833_100000747449 [0,2,0,0,0,0|1,1,0]=4 3468 B16R1.1332 CNC(=O)c1cccnc1SCC(=O)OC 62a_100000747449_100000159833 [0,2,0,0,0,0|1,1,0]=4 3469 B16R1.1332 CNC(=O)c1ncccc1OCC(=O)OC 34a_100011376092_100000747449 [0,2,0,0,0,0|1,0,0]=3 3470 B16R1.1332 CNC(=O)c1ncccc1OCC(=O)OC 7a_100011376092_100000747449 [0,2,0,0,0,0|1,0,0]=3 3471 B16R1.1332 COC(=O)COc1ccccc1C(=NO)C 34a_100000164216_100000747449 [0,2,0,0,0,0|1,0,1]=4 3472 B16R1.1332 COC(=O)COc1ccccc1C(=O)CBr 7a_100000188908_100000747449 [0,2,0,0,0,0|1,0,0]=3 3473 B16R1.1332 COC(=O)COc1ccccc1C(=O)NN 34a_100000186518_100000747449 [0,2,0,0,0,0|0,0,0]=2 3474 B16R1.1332 COC(=O)COc1ccccc1C(=O)NO 34a_100000188472_100000747449 [0,2,0,0,0,0|0,0,0]=2 3475 B16R1.1332 COC(=O)COc1ccccc1C(=O)OC 7a_100000150335_100000747449 [0,2,0,0,0,0|1,0,0]=3 3476 B16R1.1332 COC(=O)COc1cccnc1C(=O)OC 34a_100000744052_100000747449 [0,2,0,0,0,0|2,0,0]=4 3477 B16R1.1332 COC(=O)COc1cccnc1C(=O)OC 7a_100000744052_100000747449 [0,2,0,0,0,0|2,0,0]=4 3478 B16R1.1332 COC(=O)CSc1ccccc1C(=O)NN 62a_100000190081_100000747449 [0,2,0,0,0,0|0,1,0]=3 3479 B16R1.1332 COC(=O)CSc1ccccc1C(=O)NN 62a_100000747449_100000190081 [0,2,0,0,0,0|0,1,0]=3 3480 B16R1.1332 COC(=O)CSc1ccccc1C(=O)OC 62a_100000148710_100000747449 [0,2,0,0,0,0|1,1,0]=4 3481 B16R1.1332 COC(=O)CSc1ccccc1C(=O)OC 62a_100000747449_100000148710 [0,2,0,0,0,0|1,1,0]=4 3482 B16R1.1332 COC(=O)CSc1ccccc1C(=O)O[Na] 62a_100000747449_114855342371 [0,2,0,0,0,0|1,1,0]=4 3483 B16R1.1332 COC(=O)c1ccccc1CCC(=O)CO 1458a_100000210174_200010284099 [0,2,0,0,0,0|2,0,0]=4 3484 B16R1.1332 C[C@@H](CO)COc1ccccc1C(=O)NN 34a_100000186518_100000059175 [0,2,0,0,0,0|1,0,1]=4 3485 B16R1.1332 C[C@@H](CO)COc1ccccc1C(=O)NO 34a_100000188472_100000059175 [0,2,0,0,0,0|1,0,1]=4 3486 B16R1.1332 NNC(=O)c1ccccc1OCC(O)CO 34a_100000186518_100011219619 [0,2,0,0,0,0|0,0,2]=4 3487 B16R1.1332 NNC(=O)c1ccccc1OC[C@@H](O)CF 34a_100000186518_100015614560 [0,2,0,0,0,0|1,0,1]=4 3488 B16R1.1332 NNC(=O)c1ccccc1OC[C@@H](O)CO 34a_100000186518_100009815848 [0,2,0,0,0,0|0,0,2]=4 3489 B16R1.1332 O=C(NO)c1ccccc1OCC(O)CO 34a_100000188472_100011219619 [0,2,0,0,0,0|0,0,2]=4 3490 B16R1.1332 O=C(NO)c1ccccc1OC[C@@H](O)CF 34a_100000188472_100015614560 [0,2,0,0,0,0|1,0,1]=4 3491 B16R1.1332 O=C(NO)c1ccccc1OC[C@@H](O)CO 34a_100000188472_100009815848 [0,2,0,0,0,0|0,0,2]=4 3492 B16R1.16697 CNC(=O)c1ccccc1N(C)CC(=O)N 27a_100000739694_100000155073 [0,2,0,0,0,0|2,0,0]=4 3493 B16R1.16698 CC(=O)C(C)Oc1ccccc1C(=O)CBr 7a_100000188908_100000179758 [0,2,0,0,0,0|2,0,0]=4 3494 B16R1.16698 CC(=O)C(C)Sc1ccccc1C(=O)NN 62a_100000190081_100009814033 [0,2,0,0,0,0|1,1,0]=4 3495 B16R1.16698 CC(=O)C(C)Sc1ccccc1C(=O)NN 62a_100009814033_100000190081 [0,2,0,0,0,0|1,1,0]=4 3496 B16R1.16698 CC(Oc1ccccc1C(=O)CBr)C(=O)N 7a_100000188908_100000702099 [0,2,0,0,0,0|2,0,0]=4 3497 B16R1.16698 CC(Oc1ccccc1C(=O)NN)C(=O)N 34a_100000186518_100000702099 [0,2,0,0,0,0|1,0,0]=3 3498 B16R1.16698 CC(Oc1ccccc1C(=O)NO)C(=O)N 34a_100000188472_100000702099 [0,2,0,0,0,0|1,0,0]=3 3499 B16R1.16698 CC(Sc1ccccc1C(=O)NN)C(=O)N 62a_100000190081_100000702099 [0,2,0,0,0,0|1,1,0]=4 3500 B16R1.16698 CC(Sc1ccccc1C(=O)NN)C(=O)N 62a_100000702099_100000190081 [0,2,0,0,0,0|1,1,0]=4 3501 B16R1.16698 CCC(=O)c1ccccc1OC(C)C(=O)C 7a_100000184720_100000179758 [0,2,0,0,0,0|2,0,0]=4 3502 B16R1.16698 CCC(=O)c1ccccc1OC(C)C(=O)N 7a_100000184720_100000702099 [0,2,0,0,0,0|2,0,0]=4 3503 B16R1.16698 CCC(=O)c1ccccc1OC(F)C(=O)N 7a_100000184720_100009813875 [0,2,0,0,0,0|2,0,0]=4 3504 B16R1.16698 CNC(=O)c1ccccc1NC(C)C(=O)N 34a_100000185696_100000702099 [0,2,0,0,0,0|2,0,0]=4 3505 B16R1.16698 CNC(=O)c1ccccc1NC(F)C(=O)N 34a_100000185696_100009813875 [0,2,0,0,0,0|2,0,0]=4 3506 B16R1.16698 CNC(=O)c1ccccc1NC(F)C(=O)[O-] 34a_100000185696_100020610796 [0,2,0,0,0,0|1,0,1]=4 3507 B16R1.16698 CNC(=O)c1ccccc1N[C@H](C)C(=O)N 27a_100000119354_100000155073 [0,2,0,0,0,0|2,0,0]=4 3508 B16R1.16698 CNC(=O)c1ccccc1OC(C)C(=O)C 7a_100000185920_100000179758 [0,2,0,0,0,0|1,0,0]=3 3509 B16R1.16698 CNC(=O)c1ccccc1OC(C)C(=O)N 34a_100000185920_100000702099 [0,2,0,0,0,0|1,0,0]=3 3510 B16R1.16698 CNC(=O)c1ccccc1OC(C)C(=O)N 7a_100000185920_100000702099 [0,2,0,0,0,0|1,0,0]=3 3511 B16R1.16698 CNC(=O)c1ccccc1OC(F)C(=O)N 34a_100000185920_100009813875 [0,2,0,0,0,0|1,0,0]=3 3512 B16R1.16698 CNC(=O)c1ccccc1OC(F)C(=O)N 7a_100000185920_100009813875 [0,2,0,0,0,0|1,0,0]=3 3513 B16R1.16698 CNC(=O)c1ccccc1OC(F)C(=O)[O-] 34a_100000185920_100020610796 [0,2,0,0,0,0|0,0,1]=3 3514 B16R1.16698 CNC(=O)c1ccccc1SC(C)C(=O)C 62a_100000155073_100009814033 [0,2,0,0,0,0|1,1,0]=4 3515 B16R1.16698 CNC(=O)c1ccccc1SC(C)C(=O)C 62a_100009814033_100000155073 [0,2,0,0,0,0|1,1,0]=4 3516 B16R1.16698 CNC(=O)c1ccccc1SC(C)C(=O)N 62a_100000155073_100000702099 [0,2,0,0,0,0|1,1,0]=4 3517 B16R1.16698 CNC(=O)c1ccccc1SC(C)C(=O)N 62a_100000702099_100000155073 [0,2,0,0,0,0|1,1,0]=4 3518 B16R1.16698 CNC(=O)c1ccccc1SC(F)C(=O)N 62a_100000155073_100009813875 [0,2,0,0,0,0|1,1,0]=4 3519 B16R1.16698 CNC(=O)c1ccccc1SC(F)C(=O)N 62a_100009813875_100000155073 [0,2,0,0,0,0|1,1,0]=4 3520 B16R1.16698 CNC(=O)c1ccccc1SC(F)C(=O)[O-] 62a_100000155073_100020610796 [0,2,0,0,0,0|0,1,1]=4 3521 B16R1.16698 CNC(=O)c1ccccc1SC(F)C(=O)[O-] 62a_100020610796_100000155073 [0,2,0,0,0,0|0,1,1]=4 3522 B16R1.16698 CNC(=O)c1ncccc1OC(C)C(=O)C 7a_100011376092_100000179758 [0,2,0,0,0,0|2,0,0]=4 3523 B16R1.16698 CNC(=O)c1ncccc1OC(C)C(=O)N 34a_100011376092_100000702099 [0,2,0,0,0,0|2,0,0]=4 3524 B16R1.16698 CNC(=O)c1ncccc1OC(C)C(=O)N 7a_100011376092_100000702099 [0,2,0,0,0,0|2,0,0]=4 3525 B16R1.16698 CNC(=O)c1ncccc1OC(F)C(=O)N 34a_100011376092_100009813875 [0,2,0,0,0,0|2,0,0]=4 3526 B16R1.16698 CNC(=O)c1ncccc1OC(F)C(=O)N 7a_100011376092_100009813875 [0,2,0,0,0,0|2,0,0]=4 3527 B16R1.16698 CNC(=O)c1ncccc1OC(F)C(=O)[O-] 34a_100011376092_100020610796 [0,2,0,0,0,0|1,0,1]=4 3528 B16R1.16698 COC(=O)c1ccccc1OC(C)C(=O)C 7a_100000150335_100000179758 [0,2,0,0,0,0|2,0,0]=4 3529 B16R1.16698 COC(=O)c1ccccc1OC(C)C(=O)N 7a_100000150335_100000702099 [0,2,0,0,0,0|2,0,0]=4 3530 B16R1.16698 COC(=O)c1ccccc1OC(F)C(=O)N 7a_100000150335_100009813875 [0,2,0,0,0,0|2,0,0]=4 3531 B16R1.16698 NC(=O)C(F)Oc1ccccc1C(=O)CBr 7a_100000188908_100009813875 [0,2,0,0,0,0|2,0,0]=4 3532 B16R1.16698 NC(=O)C(F)Oc1ccccc1C(=O)NO 34a_100000188472_100009813875 [0,2,0,0,0,0|1,0,0]=3 3533 B16R1.16698 NNC(=O)c1ccccc1OC(F)C(=O)N 34a_100000186518_100009813875 [0,2,0,0,0,0|1,0,0]=3 3534 B16R1.16698 NNC(=O)c1ccccc1OC(F)C(=O)[O-] 34a_100000186518_100020610796 [0,2,0,0,0,0|0,0,1]=3 3535 B16R1.16698 NNC(=O)c1ccccc1SC(F)C(=O)N 62a_100000190081_100009813875 [0,2,0,0,0,0|1,1,0]=4 3536 B16R1.16698 NNC(=O)c1ccccc1SC(F)C(=O)N 62a_100009813875_100000190081 [0,2,0,0,0,0|1,1,0]=4 3537 B16R1.16698 NNC(=O)c1ccccc1SC(F)C(=O)[O-] 62a_100000190081_100020610796 [0,2,0,0,0,0|0,1,1]=4 3538 B16R1.16698 NNC(=O)c1ccccc1SC(F)C(=O)[O-] 62a_100020610796_100000190081 [0,2,0,0,0,0|0,1,1]=4 3539 B16R1.16698 O=C(NO)c1ccccc1OC(F)C(=O)[O-] 34a_100000188472_100020610796 [0,2,0,0,0,0|0,0,1]=3 3540 B16R1.16763 C=C(C)COc1ccc(cc1C(=O)NN)Br 34a_100000193350_100000748629 [0,2,0,0,0,0|2,0,0]=4 3541 B16R1.16763 C=C(C)COc1ccc(cc1C(=O)NN)C 34a_200000193374_100000748629 [0,2,0,0,0,0|2,0,0]=4 3542 B16R1.16763 C=C(C)COc1ccc(cc1C(=O)NO)Cl 34a_100000199126_100000748629 [0,2,0,0,0,0|2,0,0]=4 3543 B16R1.16763 C=C(F)COc1ccc(cc1C(=O)NN)Br 34a_100000193350_100009893438 [0,2,0,0,0,0|2,0,0]=4 3544 B16R1.16763 C=C(F)COc1ccc(cc1C(=O)NN)C 34a_200000193374_100009893438 [0,2,0,0,0,0|2,0,0]=4 3545 B16R1.16763 C=C(F)COc1ccc(cc1C(=O)NO)Cl 34a_100000199126_100009893438 [0,2,0,0,0,0|2,0,0]=4 3546 B16R1.16763 CC(O)COc1ccc(cc1C(=O)NN)Br 34a_100000193350_100011218427 [0,2,0,0,0,0|1,0,1]=4 3547 B16R1.16763 CC(O)COc1ccc(cc1C(=O)NO)Cl 34a_100000199126_100011218427 [0,2,0,0,0,0|1,0,1]=4 3548 B16R1.16763 CCC(=O)c1cc(ccc1OCC(=O)N)Br 7a_100000183607_100000187820 [0,2,0,0,0,0|2,0,0]=4 3549 B16R1.16763 CCC(=O)c1cc(ccc1OCC(=O)N)C 7a_100000183590_100000187820 [0,2,0,0,0,0|2,0,0]=4 3550 B16R1.16763 CCC(=O)c1cc(ccc1OCC(=O)N)Cl 7a_100000181482_100000187820 [0,2,0,0,0,0|2,0,0]=4 3551 B16R1.16763 CCC(=O)c1cc(ccc1OCC(=O)N)F 34a_100000183209_100000187820 [0,2,0,0,0,0|2,0,0]=4 3552 B16R1.16763 CCC(=O)c1cc(ccc1OCC(=O)N)F 7a_100000183209_100000187820 [0,2,0,0,0,0|2,0,0]=4 3553 B16R1.16763 CCC(=O)c1cc(ccc1OCC(=O)[O-])F 34a_100000183209_100020667443 [0,2,0,0,0,0|1,0,1]=4 3554 B16R1.16763 CNC(=O)c1cc(ccc1NCC(=O)N)Br 34a_100000690504_100000187820 [0,2,0,0,0,0|2,0,0]=4 3555 B16R1.16763 CNC(=O)c1cc(ccc1NCC(=O)N)Cl 34a_100000739363_100000187820 [0,2,0,0,0,0|2,0,0]=4 3556 B16R1.16763 CNC(=O)c1cc(ccc1NCC(=O)[O-])Br 34a_100000690504_100020667443 [0,2,0,0,0,0|1,0,1]=4 3557 B16R1.16763 CNC(=O)c1cc(ccc1NCC(=O)[O-])Cl 34a_100000739363_100020667443 [0,2,0,0,0,0|1,0,1]=4 3558 B16R1.16763 CNC(=O)c1cc(ccc1SCC(=O)N)Cl 62a_100000747473_200011279454 [0,2,0,0,0,0|1,1,0]=4 3559 B16R1.16763 CNC(=O)c1cc(ccc1SCC(=O)N)Cl 62a_200011279454_100000747473 [0,2,0,0,0,0|1,1,0]=4 3560 B16R1.16763 CNC(=O)c1cc(ccc1SCC(=O)N)F 62a_100000747473_200000206232 [0,2,0,0,0,0|1,1,0]=4 3561 B16R1.16763 CNC(=O)c1cc(ccc1SCC(=O)N)F 62a_200000206232_100000747473 [0,2,0,0,0,0|1,1,0]=4 3562 B16R1.16763 CNC(=O)c1cc(ccc1SCC(=O)[O-])Cl 62a_100020667443_200011279454 [0,2,0,0,0,0|0,1,1]=4 3563 B16R1.16763 CNC(=O)c1cc(ccc1SCC(=O)[O-])Cl 62a_200011279454_100020667443 [0,2,0,0,0,0|0,1,1]=4 3564 B16R1.16763 CNC(=O)c1cc(ccc1SCC(=O)[O-])F 62a_100020667443_200000206232 [0,2,0,0,0,0|0,1,1]=4 3565 B16R1.16763 CNC(=O)c1cc(ccc1SCC(=O)[O-])F 62a_200000206232_100020667443 [0,2,0,0,0,0|0,1,1]=4 3566 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)Br 34a_100000149267_100000187820 [0,2,0,0,0,0|2,0,0]=4 3567 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)Br 7a_100000149267_100000187820 [0,2,0,0,0,0|2,0,0]=4 3568 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)C 34a_100000216618_100000187820 [0,2,0,0,0,0|2,0,0]=4 3569 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)C 7a_100000216618_100000187820 [0,2,0,0,0,0|2,0,0]=4 3570 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)Cl 34a_100000149278_100000187820 [0,2,0,0,0,0|2,0,0]=4 3571 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)Cl 7a_100000149278_100000187820 [0,2,0,0,0,0|2,0,0]=4 3572 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)F 34a_100011219540_100000187820 [0,2,0,0,0,0|2,0,0]=4 3573 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)F 7a_100011219540_100000187820 [0,2,0,0,0,0|2,0,0]=4 3574 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)I 34a_100000149868_100000187820 [0,2,0,0,0,0|2,0,0]=4 3575 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)I 7a_100000149868_100000187820 [0,2,0,0,0,0|2,0,0]=4 3576 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)N 34a_100011246163_100000187820 [0,2,0,0,0,0|2,0,0]=4 3577 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)N)N 7a_100011246163_100000187820 [0,2,0,0,0,0|2,0,0]=4 3578 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)[O-])Br 34a_100000149267_100020667443 [0,2,0,0,0,0|1,0,1]=4 3579 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)[O-])C 34a_100000216618_100020667443 [0,2,0,0,0,0|1,0,1]=4 3580 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)[O-])Cl 34a_100000149278_100020667443 [0,2,0,0,0,0|1,0,1]=4 3581 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)[O-])F 34a_100011219540_100020667443 [0,2,0,0,0,0|1,0,1]=4 3582 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)[O-])I 34a_100000149868_100020667443 [0,2,0,0,0,0|1,0,1]=4 3583 B16R1.16763 COC(=O)c1cc(ccc1OCC(=O)[O-])N 34a_100011246163_100020667443 [0,2,0,0,0,0|1,0,1]=4 3584 B16R1.16763 C[C@@H](O)COc1ccc(cc1C(=O)NN)Br 34a_100000193350_100009817552 [0,2,0,0,0,0|1,0,1]=4 3585 B16R1.16763 C[C@@H](O)COc1ccc(cc1C(=O)NO)Cl 34a_100000199126_100009817552 [0,2,0,0,0,0|1,0,1]=4 3586 B16R1.16763 Cc1ccc(c(c1)C(=O)NN)OCC(=O)N 34a_200000193374_100000187820 [0,2,0,0,0,0|1,0,0]=3 3587 B16R1.16763 Cc1ccc(c(c1)C(=O)NN)OCC(=O)[O-] 34a_200000193374_100020667443 [0,2,0,0,0,0|0,0,1]=3 3588 B16R1.16763 Cc1ccc(c(c1)C(=O)NN)OCC(C)O 34a_200000193374_100011218427 [0,2,0,0,0,0|1,0,1]=4 3589 B16R1.16763 Cc1ccc(c(c1)C(=O)NN)OC[C@@H](C)O 34a_200000193374_100009817552 [0,2,0,0,0,0|1,0,1]=4 3590 B16R1.16763 Cc1ccc(c(c1)C(=O)NN)OC[N+](=O)[O-] 34a_200000193374_100000761209 [0,2,0,0,0,0|1,0,1]=4 3591 B16R1.16763 NC(=O)COc1ccc(cc1C(=O)CBr)Br 7a_200009828000_100000187820 [0,2,0,0,0,0|2,0,0]=4 3592 B16R1.16763 NC(=O)COc1ccc(cc1C(=O)CBr)Cl 7a_200009816716_100000187820 [0,2,0,0,0,0|2,0,0]=4 3593 B16R1.16763 NC(=O)COc1ccc(cc1C(=O)CBr)F 7a_100009814381_100000187820 [0,2,0,0,0,0|2,0,0]=4 3594 B16R1.16763 NC(=O)COc1ccc(cc1C(=O)CCl)F 7a_100000047744_100000187820 [0,2,0,0,0,0|2,0,0]=4 3595 B16R1.16763 NC(=O)COc1ccc(cc1C(=O)NO)Cl 34a_100000199126_100000187820 [0,2,0,0,0,0|1,0,0]=3 3596 B16R1.16763 NNC(=O)c1cc(ccc1OCC(=O)N)Br 34a_100000193350_100000187820 [0,2,0,0,0,0|1,0,0]=3 3597 B16R1.16763 NNC(=O)c1cc(ccc1OCC(=O)[O-])Br 34a_100000193350_100020667443 [0,2,0,0,0,0|0,0,1]=3 3598 B16R1.16763 NNC(=O)c1cc(ccc1OC[N+](=O)[O-])Br 34a_100000193350_100000761209 [0,2,0,0,0,0|1,0,1]=4 3599 B16R1.16763 NNC(=O)c1cc(ccc1SCC(=O)N)F 62a_100000205862_100000747473 [0,2,0,0,0,0|1,1,0]=4 3600 B16R1.16763 NNC(=O)c1cc(ccc1SCC(=O)N)F 62a_100000747473_100000205862 [0,2,0,0,0,0|1,1,0]=4 3601 B16R1.16763 NNC(=O)c1cc(ccc1SCC(=O)[O-])F 62a_100000205862_100020667443 [0,2,0,0,0,0|0,1,1]=4 3602 B16R1.16763 NNC(=O)c1cc(ccc1SCC(=O)[O-])F 62a_100020667443_100000205862 [0,2,0,0,0,0|0,1,1]=4 3603 B16R1.16763 O=C(NO)c1cc(ccc1OC[N+](=O)[O-])Cl 34a_100000199126_100000761209 [0,2,0,0,0,0|1,0,1]=4 3604 B16R1.16763 O=C([O-])COc1ccc(cc1C(=O)NO)Cl 34a_100000199126_100020667443 [0,2,0,0,0,0|0,0,1]=3 3605 B16R1.17274 CNC(=O)c1c(cccc1SCC(=O)N)F 62a_100000747473_100012642803 [0,2,0,0,0,0|1,1,0]=4 3606 B16R1.17274 CNC(=O)c1c(cccc1SCC(=O)N)F 62a_100012642803_100000747473 [0,2,0,0,0,0|1,1,0]=4 3607 B16R1.17274 CNC(=O)c1c(cccc1SCC(=O)[O-])F 62a_100012642803_100020667443 [0,2,0,0,0,0|0,1,1]=4 3608 B16R1.17274 CNC(=O)c1c(cccc1SCC(=O)[O-])F 62a_100020667443_100012642803 [0,2,0,0,0,0|0,1,1]=4 3609 B16R1.17274 COC(=O)c1c(cccc1OCC(=O)N)C 34a_100000084604_100000187820 [0,2,0,0,0,0|2,0,0]=4 3610 B16R1.17274 COC(=O)c1c(cccc1OCC(=O)N)C 7a_100000084604_100000187820 [0,2,0,0,0,0|2,0,0]=4 3611 B16R1.17274 COC(=O)c1c(cccc1OCC(=O)N)Cl 34a_200000055445_100000187820 [0,2,0,0,0,0|2,0,0]=4 3612 B16R1.17274 COC(=O)c1c(cccc1OCC(=O)N)Cl 7a_200000055445_100000187820 [0,2,0,0,0,0|2,0,0]=4 3613 B16R1.17274 COC(=O)c1c(cccc1OCC(=O)N)F 34a_100011216559_100000187820 [0,2,0,0,0,0|2,0,0]=4 3614 B16R1.17274 COC(=O)c1c(cccc1OCC(=O)N)F 7a_100011216559_100000187820 [0,2,0,0,0,0|2,0,0]=4 3615 B16R1.17274 COC(=O)c1c(cccc1OCC(=O)[O-])C 34a_100000084604_100020667443 [0,2,0,0,0,0|1,0,1]=4 3616 B16R1.17274 COC(=O)c1c(cccc1OCC(=O)[O-])Cl 34a_200000055445_100020667443 [0,2,0,0,0,0|1,0,1]=4 3617 B16R1.17274 COC(=O)c1c(cccc1OCC(=O)[O-])F 34a_100011216559_100020667443 [0,2,0,0,0,0|1,0,1]=4 3618 B16R1.74189 C=C(C)COc1c(cccc1C(=O)NN)C 34a_100000193353_100000748629 [0,2,0,0,0,0|2,0,0]=4 3619 B16R1.74189 C=C(F)COc1c(cccc1C(=O)NN)C 34a_100000193353_100009893438 [0,2,0,0,0,0|2,0,0]=4 3620 B16R1.74189 CNC(=O)c1cccc(c1NCC(=O)N)C 34a_100000223168_100000187820 [0,2,0,0,0,0|2,0,0]=4 3621 B16R1.74189 CNC(=O)c1cccc(c1NCC(=O)N)Cl 34a_200012181065_100000187820 [0,2,0,0,0,0|2,0,0]=4 3622 B16R1.74189 CNC(=O)c1cccc(c1NCC(=O)[O-])C 34a_100000223168_100020667443 [0,2,0,0,0,0|1,0,1]=4 3623 B16R1.74189 CNC(=O)c1cccc(c1NCC(=O)[O-])Cl 34a_200012181065_100020667443 [0,2,0,0,0,0|1,0,1]=4 3624 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)N)Br 34a_100009816214_100000187820 [0,2,0,0,0,0|2,0,0]=4 3625 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)N)C 34a_100000149854_100000187820 [0,2,0,0,0,0|2,0,0]=4 3626 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)N)C 7a_100000149854_100000187820 [0,2,0,0,0,0|2,0,0]=4 3627 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)N)Cl 34a_100000074923_100000187820 [0,2,0,0,0,0|2,0,0]=4 3628 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)N)Cl 7a_100000074923_100000187820 [0,2,0,0,0,0|2,0,0]=4 3629 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)N)F 34a_100000082593_100000187820 [0,2,0,0,0,0|2,0,0]=4 3630 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)N)F 7a_100000082593_100000187820 [0,2,0,0,0,0|2,0,0]=4 3631 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)N)N 34a_100000750886_100000187820 [0,2,0,0,0,0|2,0,0]=4 3632 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)[O-])Br 34a_100009816214_100020667443 [0,2,0,0,0,0|1,0,1]=4 3633 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)[O-])C 34a_100000149854_100020667443 [0,2,0,0,0,0|1,0,1]=4 3634 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)[O-])Cl 34a_100000074923_100020667443 [0,2,0,0,0,0|1,0,1]=4 3635 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)[O-])F 34a_100000082593_100020667443 [0,2,0,0,0,0|1,0,1]=4 3636 B16R1.74189 COC(=O)c1cccc(c1OCC(=O)[O-])N 34a_100000750886_100020667443 [0,2,0,0,0,0|1,0,1]=4 3637 B16R1.74189 Cc1cccc(c1OCC(=O)N)C(=O)NN 34a_100000193353_100000187820 [0,2,0,0,0,0|1,0,0]=3 3638 B16R1.74189 Cc1cccc(c1OCC(=O)[O-])C(=O)NN 34a_100000193353_100020667443 [0,2,0,0,0,0|0,0,1]=3 3639 B16R1.74189 Cc1cccc(c1OCC(C)O)C(=O)NN 34a_100000193353_100011218427 [0,2,0,0,0,0|1,0,1]=4 3640 B16R1.74189 Cc1cccc(c1OC[C@@H](C)O)C(=O)NN 34a_100000193353_100009817552 [0,2,0,0,0,0|1,0,1]=4 3641 B16R1.74189 Cc1cccc(c1OC[N+](=O)[O-])C(=O)NN 34a_100000193353_100000761209 [0,2,0,0,0,0|1,0,1]=4 3642 B16R1.74189 Cc1cccc(c1SCC(=O)N)C(=O)NN 62a_100000747473_200012340524 [0,2,0,0,0,0|1,1,0]=4 3643 B16R1.74189 Cc1cccc(c1SCC(=O)N)C(=O)NN 62a_200012340524_100000747473 [0,2,0,0,0,0|1,1,0]=4 3644 B16R1.74189 Cc1cccc(c1SCC(=O)[O-])C(=O)NN 62a_100020667443_200012340524 [0,2,0,0,0,0|0,1,1]=4 3645 B16R1.74189 Cc1cccc(c1SCC(=O)[O-])C(=O)NN 62a_200012340524_100020667443 [0,2,0,0,0,0|0,1,1]=4 3646 B16R1.75817 C=C(C)COc1cc(ccc1C(=O)NC)N 34a_100000223174_100000748629 [0,2,0,0,0,0|2,0,0]=4 3647 B16R1.75817 C=C(C)COc1cc(ccc1C(=O)NC)N 7a_100000223174_100000748629 [0,2,0,0,0,0|2,0,0]=4 3648 B16R1.75817 C=C(C)COc1cc(ccc1C(=O)NN)C 34a_100000193368_100000748629 [0,2,0,0,0,0|2,0,0]=4 3649 B16R1.75817 C=C(C)COc1cc(ccc1C(=O)NN)Cl 34a_100000193371_100000748629 [0,2,0,0,0,0|2,0,0]=4 3650 B16R1.75817 C=C(C)COc1cc(ccc1C(=O)NN)N 34a_200000020778_100000748629 [0,2,0,0,0,0|2,0,0]=4 3651 B16R1.75817 C=C(C)COc1cc(ccc1C(=O)NO)C 34a_200000199133_100000748629 [0,2,0,0,0,0|2,0,0]=4 3652 B16R1.75817 C=C(C)COc1cc(ccc1C(=O)NO)Cl 34a_100000199135_100000748629 [0,2,0,0,0,0|2,0,0]=4 3653 B16R1.75817 C=C(F)COc1cc(ccc1C(=O)NC)N 34a_100000223174_100009893438 [0,2,0,0,0,0|2,0,0]=4 3654 B16R1.75817 C=C(F)COc1cc(ccc1C(=O)NC)N 7a_100000223174_100000042424 [0,2,0,0,0,0|2,0,0]=4 3655 B16R1.75817 C=C(F)COc1cc(ccc1C(=O)NN)C 34a_100000193368_100009893438 [0,2,0,0,0,0|2,0,0]=4 3656 B16R1.75817 C=C(F)COc1cc(ccc1C(=O)NN)Cl 34a_100000193371_100009893438 [0,2,0,0,0,0|2,0,0]=4 3657 B16R1.75817 C=C(F)COc1cc(ccc1C(=O)NN)N 34a_200000020778_100009893438 [0,2,0,0,0,0|2,0,0]=4 3658 B16R1.75817 C=C(F)COc1cc(ccc1C(=O)NO)C 34a_200000199133_100009893438 [0,2,0,0,0,0|2,0,0]=4 3659 B16R1.75817 C=C(F)COc1cc(ccc1C(=O)NO)Cl 34a_100000199135_100009893438 [0,2,0,0,0,0|2,0,0]=4 3660 B16R1.75817 CC(O)COc1cc(ccc1C(=O)NN)Cl 34a_100000193371_100011218427 [0,2,0,0,0,0|1,0,1]=4 3661 B16R1.75817 CC(O)COc1cc(ccc1C(=O)NN)N 34a_200000020778_100011218427 [0,2,0,0,0,0|1,0,1]=4 3662 B16R1.75817 CC(O)COc1cc(ccc1C(=O)NO)Cl 34a_100000199135_100011218427 [0,2,0,0,0,0|1,0,1]=4 3663 B16R1.75817 CNC(=O)c1ccc(cc1NCC(=O)N)Cl 34a_100000742614_100000187820 [0,2,0,0,0,0|2,0,0]=4 3664 B16R1.75817 CNC(=O)c1ccc(cc1NCC(=O)[O-])Cl 34a_100000742614_100020667443 [0,2,0,0,0,0|1,0,1]=4 3665 B16R1.75817 CNC(=O)c1ccc(cc1OCC(=O)N)N 34a_100000223174_100000187820 [0,2,0,0,0,0|1,0,0]=3 3666 B16R1.75817 CNC(=O)c1ccc(cc1OCC(=O)N)N 7a_100000223174_100000187820 [0,2,0,0,0,0|1,0,0]=3 3667 B16R1.75817 CNC(=O)c1ccc(cc1OCC(=O)[O-])N 34a_100000223174_100020667443 [0,2,0,0,0,0|0,0,1]=3 3668 B16R1.75817 CNC(=O)c1ccc(cc1OCC(C)O)N 34a_100000223174_100011218427 [0,2,0,0,0,0|1,0,1]=4 3669 B16R1.75817 CNC(=O)c1ccc(cc1OCC(C)O)N 7a_100000223174_100011218427 [0,2,0,0,0,0|1,0,1]=4 3670 B16R1.75817 CNC(=O)c1ccc(cc1OC[C@@H](C)O)N 34a_100000223174_100009817552 [0,2,0,0,0,0|1,0,1]=4 3671 B16R1.75817 CNC(=O)c1ccc(cc1OC[C@@H](C)O)N 7a_100000223174_100009817552 [0,2,0,0,0,0|1,0,1]=4 3672 B16R1.75817 CNC(=O)c1ccc(cc1OC[N+](=O)[O-])N 34a_100000223174_100000761209 [0,2,0,0,0,0|1,0,1]=4 3673 B16R1.75817 CNC(=O)c1ccc(cc1SCC(=O)N)F 62a_100000747473_200000206206 [0,2,0,0,0,0|1,1,0]=4 3674 B16R1.75817 CNC(=O)c1ccc(cc1SCC(=O)N)F 62a_200000206206_100000747473 [0,2,0,0,0,0|1,1,0]=4 3675 B16R1.75817 CNC(=O)c1ccc(cc1SCC(=O)[O-])F 62a_100020667443_200000206206 [0,2,0,0,0,0|0,1,1]=4 3676 B16R1.75817 CNC(=O)c1ccc(cc1SCC(=O)[O-])F 62a_200000206206_100020667443 [0,2,0,0,0,0|0,1,1]=4 3677 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)Br 34a_100000699699_100000187820 [0,2,0,0,0,0|2,0,0]=4 3678 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)Br 7a_100000699699_100000187820 [0,2,0,0,0,0|2,0,0]=4 3679 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)C 34a_100000148187_100000187820 [0,2,0,0,0,0|2,0,0]=4 3680 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)C 7a_100000148187_100000187820 [0,2,0,0,0,0|2,0,0]=4 3681 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)Cl 34a_100000151441_100000187820 [0,2,0,0,0,0|2,0,0]=4 3682 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)Cl 7a_100000151441_100000187820 [0,2,0,0,0,0|2,0,0]=4 3683 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)F 34a_100011216117_100000187820 [0,2,0,0,0,0|2,0,0]=4 3684 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)F 7a_100011216117_100000187820 [0,2,0,0,0,0|2,0,0]=4 3685 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)I 7a_100000062286_100000187820 [0,2,0,0,0,0|2,0,0]=4 3686 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)N 34a_100000718744_100000187820 [0,2,0,0,0,0|2,0,0]=4 3687 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)N)N 7a_100000718744_100000187820 [0,2,0,0,0,0|2,0,0]=4 3688 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)[O-])Br 34a_100000699699_100020667443 [0,2,0,0,0,0|1,0,1]=4 3689 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)[O-])C 34a_100000148187_100020667443 [0,2,0,0,0,0|1,0,1]=4 3690 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)[O-])Cl 34a_100000151441_100020667443 [0,2,0,0,0,0|1,0,1]=4 3691 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)[O-])F 34a_100011216117_100020667443 [0,2,0,0,0,0|1,0,1]=4 3692 B16R1.75817 COC(=O)c1ccc(cc1OCC(=O)[O-])N 34a_100000718744_100020667443 [0,2,0,0,0,0|1,0,1]=4 3693 B16R1.75817 C[C@@H](O)COc1cc(ccc1C(=O)NN)Cl 34a_100000193371_100009817552 [0,2,0,0,0,0|1,0,1]=4 3694 B16R1.75817 C[C@@H](O)COc1cc(ccc1C(=O)NN)N 34a_200000020778_100009817552 [0,2,0,0,0,0|1,0,1]=4 3695 B16R1.75817 C[C@@H](O)COc1cc(ccc1C(=O)NO)Cl 34a_100000199135_100009817552 [0,2,0,0,0,0|1,0,1]=4 3696 B16R1.75817 Cc1ccc(c(c1)OCC(=O)N)C(=O)NN 34a_100000193368_100000187820 [0,2,0,0,0,0|1,0,0]=3 3697 B16R1.75817 Cc1ccc(c(c1)OCC(=O)N)C(=O)NO 34a_200000199133_100000187820 [0,2,0,0,0,0|1,0,0]=3 3698 B16R1.75817 Cc1ccc(c(c1)OCC(=O)[O-])C(=O)NN 34a_100000193368_100020667443 [0,2,0,0,0,0|0,0,1]=3 3699 B16R1.75817 Cc1ccc(c(c1)OCC(=O)[O-])C(=O)NO 34a_200000199133_100020667443 [0,2,0,0,0,0|0,0,1]=3 3700 B16R1.75817 Cc1ccc(c(c1)OCC(C)O)C(=O)NN 34a_100000193368_100011218427 [0,2,0,0,0,0|1,0,1]=4 3701 B16R1.75817 Cc1ccc(c(c1)OCC(C)O)C(=O)NO 34a_200000199133_100011218427 [0,2,0,0,0,0|1,0,1]=4 3702 B16R1.75817 Cc1ccc(c(c1)OC[C@@H](C)O)C(=O)NN 34a_100000193368_100009817552 [0,2,0,0,0,0|1,0,1]=4 3703 B16R1.75817 Cc1ccc(c(c1)OC[C@@H](C)O)C(=O)NO 34a_200000199133_100009817552 [0,2,0,0,0,0|1,0,1]=4 3704 B16R1.75817 Cc1ccc(c(c1)OC[N+](=O)[O-])C(=O)NN 34a_100000193368_100000761209 [0,2,0,0,0,0|1,0,1]=4 3705 B16R1.75817 Cc1ccc(c(c1)OC[N+](=O)[O-])C(=O)NO 34a_200000199133_100000761209 [0,2,0,0,0,0|1,0,1]=4 3706 B16R1.75817 Cc1ccc(c(c1)SCC(=O)N)C(=O)NN 62a_100000747473_200012340525 [0,2,0,0,0,0|1,1,0]=4 3707 B16R1.75817 Cc1ccc(c(c1)SCC(=O)N)C(=O)NN 62a_200012340525_100000747473 [0,2,0,0,0,0|1,1,0]=4 3708 B16R1.75817 Cc1ccc(c(c1)SCC(=O)[O-])C(=O)NN 62a_100020667443_200012340525 [0,2,0,0,0,0|0,1,1]=4 3709 B16R1.75817 Cc1ccc(c(c1)SCC(=O)[O-])C(=O)NN 62a_200012340525_100020667443 [0,2,0,0,0,0|0,1,1]=4 3710 B16R1.75817 NC(=O)COc1cc(ccc1C(=O)CBr)F 7a_100009817053_100000187820 [0,2,0,0,0,0|2,0,0]=4 3711 B16R1.75817 NC(=O)COc1cc(ccc1C(=O)NO)Cl 34a_100000199135_100000187820 [0,2,0,0,0,0|1,0,0]=3 3712 B16R1.75817 NNC(=O)c1ccc(cc1OCC(=O)N)Cl 34a_100000193371_100000187820 [0,2,0,0,0,0|1,0,0]=3 3713 B16R1.75817 NNC(=O)c1ccc(cc1OCC(=O)N)N 34a_200000020778_100000187820 [0,2,0,0,0,0|1,0,0]=3 3714 B16R1.75817 NNC(=O)c1ccc(cc1OCC(=O)[O-])Cl 34a_100000193371_100020667443 [0,2,0,0,0,0|0,0,1]=3 3715 B16R1.75817 NNC(=O)c1ccc(cc1OCC(=O)[O-])N 34a_200000020778_100020667443 [0,2,0,0,0,0|0,0,1]=3 3716 B16R1.75817 NNC(=O)c1ccc(cc1OC[N+](=O)[O-])Cl 34a_100000193371_100000761209 [0,2,0,0,0,0|1,0,1]=4 3717 B16R1.75817 NNC(=O)c1ccc(cc1OC[N+](=O)[O-])N 34a_200000020778_100000761209 [0,2,0,0,0,0|1,0,1]=4 3718 B16R1.75817 NNC(=O)c1ccc(cc1SCC(=O)N)F 62a_100000203923_100000747473 [0,2,0,0,0,0|1,1,0]=4 3719 B16R1.75817 NNC(=O)c1ccc(cc1SCC(=O)N)F 62a_100000747473_100000203923 [0,2,0,0,0,0|1,1,0]=4 3720 B16R1.75817 NNC(=O)c1ccc(cc1SCC(=O)[O-])F 62a_100000203923_100020667443 [0,2,0,0,0,0|0,1,1]=4 3721 B16R1.75817 NNC(=O)c1ccc(cc1SCC(=O)[O-])F 62a_100020667443_100000203923 [0,2,0,0,0,0|0,1,1]=4 3722 B16R1.75817 O=C(NO)c1ccc(cc1OC[N+](=O)[O-])Cl 34a_100000199135_100000761209 [0,2,0,0,0,0|1,0,1]=4 3723 B16R1.75817 O=C([O-])COc1cc(ccc1C(=O)NO)Cl 34a_100000199135_100020667443 [0,2,0,0,0,0|0,0,1]=3 3724 B16R1.874 CCC(=O)CN(C)c1ccccc1C(=O)N 269982a_100000184419_100000747405 [0,2,0,0,0,0|2,0,0]=4 3725 B16R1.874 CNC(=O)CN(C)c1ccccc1C(=O)N 269982a_100000184419_100000183359 [0,2,0,0,0,0|2,0,0]=4 3726 B16R1.874 COC(=O)CN(C)c1ccccc1C(=O)N 269982a_100000184419_100000747449 [0,2,0,0,0,0|1,0,0]=3 3727 B16R1.874 COC(=O)CN(C)c1cccnc1C(=O)N 27a_100000198492_200012359670 [0,2,0,0,0,0|2,0,0]=4 3728 B16R1.874 COC(=O)CN(C)c1ccncc1C(=O)N 27a_100000198492_100000697804 [0,2,0,0,0,0|2,0,0]=4 3729 B16R1.874 COC(=O)CN(C)c1ncccc1C(=O)N 27a_100000198492_100000162199 [0,2,0,0,0,0|2,0,0]=4 3730 B16R1.1138 C=C(C#N)COc1ccc(cc1C(=O)N)Br 34a_100000192807_100000694840 [0,2,0,0,0,0|2,0,0]=4 3731 B16R1.1138 C=C(C#N)COc1ccc(cc1C(=O)N)C 34a_200000192840_100000694840 [0,2,0,0,0,0|2,0,0]=4 3732 B16R1.1138 C=C(C#N)COc1ccc(cc1C(=O)N)Cl 34a_100000185026_100000694840 [0,2,0,0,0,0|2,0,0]=4 3733 B16R1.1138 C=C(C#N)COc1ccc(cc1C(=O)N)F 34a_100012186459_100000694840 [0,2,0,0,0,0|2,0,0]=4 3734 B16R1.1138 C=C(C#N)COc1ccc(cc1C(=O)N)I 34a_100000192813_100000694840 [0,2,0,0,0,0|2,0,0]=4 3735 B16R1.1138 C=C(C)c1cc(ccc1OCC(=O)OC)F 271570a_100000694244_200000151491 [0,2,0,0,0,0|2,0,0]=4 3736 B16R1.1138 C=CC(O)COc1ccc(cc1C(=O)N)Br 34a_100000192807_100000730141 [0,2,0,0,0,0|1,0,1]=4 3737 B16R1.1138 C=CC(O)COc1ccc(cc1C(=O)N)Br 7a_100000192807_100000730141 [0,2,0,0,0,0|1,0,1]=4 3738 B16R1.1138 C=CC(O)COc1ccc(cc1C(=O)N)C 34a_200000192840_100000730141 [0,2,0,0,0,0|1,0,1]=4 3739 B16R1.1138 C=CC(O)COc1ccc(cc1C(=O)N)C 7a_200000192840_100000730141 [0,2,0,0,0,0|1,0,1]=4 3740 B16R1.1138 C=CC(O)COc1ccc(cc1C(=O)N)Cl 34a_100000185026_100000730141 [0,2,0,0,0,0|1,0,1]=4 3741 B16R1.1138 C=CC(O)COc1ccc(cc1C(=O)N)Cl 7a_100000185026_100000730141 [0,2,0,0,0,0|1,0,1]=4 3742 B16R1.1138 C=CC(O)COc1ccc(cc1C(=O)N)F 34a_100012186459_100000730141 [0,2,0,0,0,0|1,0,1]=4 3743 B16R1.1138 C=CC(O)COc1ccc(cc1C(=O)N)F 7a_100012186459_100000730141 [0,2,0,0,0,0|1,0,1]=4 3744 B16R1.1138 C=CC(O)COc1ccc(cc1C(=O)N)I 34a_100000192813_100000730141 [0,2,0,0,0,0|1,0,1]=4 3745 B16R1.1138 C=CC(O)COc1ccc(cc1C(=O)N)I 7a_100000192813_100000730141 [0,2,0,0,0,0|1,0,1]=4 3746 B16R1.1138 CCC(=O)CNc1ccc(cc1C(=O)N)Br 7a_100000740421_100000747405 [0,2,0,0,0,0|2,0,0]=4 3747 B16R1.1138 CCC(=O)CNc1ccc(cc1C(=O)N)Cl 7a_100000743835_100000747405 [0,2,0,0,0,0|2,0,0]=4 3748 B16R1.1138 CCC(=O)CNc1ccc(cc1C(=O)N)F 7a_100000741173_100000747405 [0,2,0,0,0,0|2,0,0]=4 3749 B16R1.1138 CCC(=O)COc1ccc(cc1C(=O)C)Br 7a_100000212127_100000747405 [0,2,0,0,0,0|2,0,0]=4 3750 B16R1.1138 CCC(=O)COc1ccc(cc1C(=O)C)C 7a_100000195442_100000747405 [0,2,0,0,0,0|2,0,0]=4 3751 B16R1.1138 CCC(=O)COc1ccc(cc1C(=O)C)Cl 7a_100000185566_100000747405 [0,2,0,0,0,0|2,0,0]=4 3752 B16R1.1138 CCC(=O)COc1ccc(cc1C(=O)C)F 7a_100000182812_100000747405 [0,2,0,0,0,0|2,0,0]=4 3753 B16R1.1138 CCC(=O)COc1ccc(cc1C(=O)C)I 7a_100010712555_100000747405 [0,2,0,0,0,0|2,0,0]=4 3754 B16R1.1138 CCC(=O)COc1ccc(cc1C(=O)N)Br 7a_100000192807_100000747405 [0,2,0,0,0,0|1,0,0]=3 3755 B16R1.1138 CCC(=O)COc1ccc(cc1C(=O)N)C 7a_200000192840_100000747405 [0,2,0,0,0,0|1,0,0]=3 3756 B16R1.1138 CCC(=O)COc1ccc(cc1C(=O)N)Cl 7a_100000185026_100000747405 [0,2,0,0,0,0|1,0,0]=3 3757 B16R1.1138 CCC(=O)COc1ccc(cc1C(=O)N)F 7a_100012186459_100000747405 [0,2,0,0,0,0|1,0,0]=3 3758 B16R1.1138 CCC(=O)COc1ccc(cc1C(=O)N)I 7a_100000192813_100000747405 [0,2,0,0,0,0|1,0,0]=3 3759 B16R1.1138 CCC(=O)CSc1ccc(cc1C(=O)N)Br 62a_200000162314_100000747405 [0,2,0,0,0,0|1,1,0]=4 3760 B16R1.1138 CCC(=O)CSc1ccc(cc1C(=O)N)C 62a_100000747405_200012349609 [0,2,0,0,0,0|1,1,0]=4 3761 B16R1.1138 CCC(=O)CSc1ccc(cc1C(=O)N)C 62a_200012349609_100000747405 [0,2,0,0,0,0|1,1,0]=4 3762 B16R1.1138 CCC(=O)CSc1ccc(cc1C(=O)N)F 62a_100000206434_100000747405 [0,2,0,0,0,0|1,1,0]=4 3763 B16R1.1138 CCC(=O)CSc1ccc(cc1C(=O)N)F 62a_100000747405_100000206434 [0,2,0,0,0,0|1,1,0]=4 3764 B16R1.1138 CCC(=O)CSc1ccc(cc1C(=O)N)N 62a_100015186447_100000747405 [0,2,0,0,0,0|1,1,0]=4 3765 B16R1.1138 CCC(O)COc1ccc(cc1C(=O)N)Br 34a_100000192807_100011218378 [0,2,0,0,0,0|1,0,1]=4 3766 B16R1.1138 CCC(O)COc1ccc(cc1C(=O)N)Br 7a_100000192807_100011218378 [0,2,0,0,0,0|1,0,1]=4 3767 B16R1.1138 CCC(O)COc1ccc(cc1C(=O)N)C 34a_200000192840_100011218378 [0,2,0,0,0,0|1,0,1]=4 3768 B16R1.1138 CCC(O)COc1ccc(cc1C(=O)N)C 7a_200000192840_100011218378 [0,2,0,0,0,0|1,0,1]=4 3769 B16R1.1138 CCC(O)COc1ccc(cc1C(=O)N)Cl 34a_100000185026_100011218378 [0,2,0,0,0,0|1,0,1]=4 3770 B16R1.1138 CCC(O)COc1ccc(cc1C(=O)N)Cl 7a_100000185026_100011218378 [0,2,0,0,0,0|1,0,1]=4 3771 B16R1.1138 CCC(O)COc1ccc(cc1C(=O)N)F 34a_100012186459_100011218378 [0,2,0,0,0,0|1,0,1]=4 3772 B16R1.1138 CCC(O)COc1ccc(cc1C(=O)N)F 7a_100012186459_100011218378 [0,2,0,0,0,0|1,0,1]=4 3773 B16R1.1138 CCC(O)COc1ccc(cc1C(=O)N)I 34a_100000192813_100011218378 [0,2,0,0,0,0|1,0,1]=4 3774 B16R1.1138 CCC(O)COc1ccc(cc1C(=O)N)I 7a_100000192813_100011218378 [0,2,0,0,0,0|1,0,1]=4 3775 B16R1.1138 CNC(=O)CNc1ccc(cc1C(=O)N)Br 27a_100000693194_200000162314 [0,2,0,0,0,0|2,0,0]=4 3776 B16R1.1138 CNC(=O)CNc1ccc(cc1C(=O)N)Br 34a_100000740421_100000183359 [0,2,0,0,0,0|2,0,0]=4 3777 B16R1.1138 CNC(=O)CNc1ccc(cc1C(=O)N)Br 7a_100000740421_100000183359 [0,2,0,0,0,0|2,0,0]=4 3778 B16R1.1138 CNC(=O)CNc1ccc(cc1C(=O)N)C 34a_100011692829_100000183359 [0,2,0,0,0,0|2,0,0]=4 3779 B16R1.1138 CNC(=O)CNc1ccc(cc1C(=O)N)Cl 34a_100000743835_100000183359 [0,2,0,0,0,0|2,0,0]=4 3780 B16R1.1138 CNC(=O)CNc1ccc(cc1C(=O)N)Cl 7a_100000743835_100000183359 [0,2,0,0,0,0|2,0,0]=4 3781 B16R1.1138 CNC(=O)CNc1ccc(cc1C(=O)N)F 34a_100000741173_100000183359 [0,2,0,0,0,0|2,0,0]=4 3782 B16R1.1138 CNC(=O)CNc1ccc(cc1C(=O)N)F 7a_100000741173_100000183359 [0,2,0,0,0,0|2,0,0]=4 3783 B16R1.1138 CNC(=O)COc1ccc(cc1C(=O)C)Br 34a_100000212127_100000183359 [0,2,0,0,0,0|2,0,0]=4 3784 B16R1.1138 CNC(=O)COc1ccc(cc1C(=O)C)Br 7a_100000212127_100000183359 [0,2,0,0,0,0|2,0,0]=4 3785 B16R1.1138 CNC(=O)COc1ccc(cc1C(=O)C)C 34a_100000195442_100000183359 [0,2,0,0,0,0|2,0,0]=4 3786 B16R1.1138 CNC(=O)COc1ccc(cc1C(=O)C)C 7a_100000195442_100000183359 [0,2,0,0,0,0|2,0,0]=4 3787 B16R1.1138 CNC(=O)COc1ccc(cc1C(=O)C)Cl 34a_100000185566_100000183359 [0,2,0,0,0,0|2,0,0]=4 3788 B16R1.1138 CNC(=O)COc1ccc(cc1C(=O)C)Cl 7a_100000185566_100000183359 [0,2,0,0,0,0|2,0,0]=4 3789 B16R1.1138 CNC(=O)COc1ccc(cc1C(=O)C)F 7a_100000182812_100000183359 [0,2,0,0,0,0|2,0,0]=4 3790 B16R1.1138 CNC(=O)COc1ccc(cc1C(=O)C)I 7a_100010712555_100000183359 [0,2,0,0,0,0|2,0,0]=4 3791 B16R1.1138 CNC(=O)COc1ccc(cc1C(=O)C)N 34a_100011218865_100000183359 [0,2,0,0,0,0|2,0,0]=4 3792 B16R1.1138 CNC(=O)COc1ccc(cc1C(=O)N)Br 34a_100000192807_100000183359 [0,2,0,0,0,0|1,0,0]=3 3793 B16R1.1138 CNC(=O)COc1ccc(cc1C(=O)N)Br 7a_100000192807_100000183359 [0,2,0,0,0,0|1,0,0]=3 3794 B16R1.1138 CNC(=O)COc1ccc(cc1C(=O)N)C 34a_200000192840_100000183359 [0,2,0,0,0,0|1,0,0]=3 3795 B16R1.1138 CNC(=O)COc1ccc(cc1C(=O)N)C 7a_200000192840_100000183359 [0,2,0,0,0,0|1,0,0]=3 3796 B16R1.1138 CNC(=O)COc1ccc(cc1C(=O)N)Cl 34a_100000185026_100000183359 [0,2,0,0,0,0|1,0,0]=3 3797 B16R1.1138 CNC(=O)COc1ccc(cc1C(=O)N)Cl 7a_100000185026_100000183359 [0,2,0,0,0,0|1,0,0]=3 3798 B16R1.1138 CNC(=O)COc1ccc(cc1C(=O)N)F 34a_100012186459_100000183359 [0,2,0,0,0,0|1,0,0]=3 3799 B16R1.1138 CNC(=O)COc1ccc(cc1C(=O)N)F 7a_100012186459_100000183359 [0,2,0,0,0,0|1,0,0]=3 3800 B16R1.1138 CNC(=O)COc1ccc(cc1C(=O)N)I 34a_100000192813_100000183359 [0,2,0,0,0,0|1,0,0]=3 3801 B16R1.1138 CNC(=O)COc1ccc(cc1C(=O)N)I 7a_100000192813_100000183359 [0,2,0,0,0,0|1,0,0]=3 3802 B16R1.1138 CNC(=O)CSc1ccc(cc1C(=O)N)Br 62a_200000162314_100000183359 [0,2,0,0,0,0|1,1,0]=4 3803 B16R1.1138 CNC(=O)CSc1ccc(cc1C(=O)N)C 62a_100000183359_200012349609 [0,2,0,0,0,0|1,1,0]=4 3804 B16R1.1138 CNC(=O)CSc1ccc(cc1C(=O)N)C 62a_200012349609_100000183359 [0,2,0,0,0,0|1,1,0]=4 3805 B16R1.1138 CNC(=O)CSc1ccc(cc1C(=O)N)F 62a_100000183359_100000206434 [0,2,0,0,0,0|1,1,0]=4 3806 B16R1.1138 CNC(=O)CSc1ccc(cc1C(=O)N)F 62a_100000206434_100000183359 [0,2,0,0,0,0|1,1,0]=4 3807 B16R1.1138 CNC(=O)CSc1ccc(cc1C(=O)N)N 62a_100015186447_100000183359 [0,2,0,0,0,0|1,1,0]=4 3808 B16R1.1138 COC(=O)CNc1ccc(cc1C(=O)N)Br 34a_100000740421_100000747449 [0,2,0,0,0,0|1,0,0]=3 3809 B16R1.1138 COC(=O)CNc1ccc(cc1C(=O)N)Br 7a_100000740421_100000747449 [0,2,0,0,0,0|1,0,0]=3 3810 B16R1.1138 COC(=O)CNc1ccc(cc1C(=O)N)C 34a_100011692829_100000747449 [0,2,0,0,0,0|1,0,0]=3 3811 B16R1.1138 COC(=O)CNc1ccc(cc1C(=O)N)Cl 34a_100000743835_100000747449 [0,2,0,0,0,0|1,0,0]=3 3812 B16R1.1138 COC(=O)CNc1ccc(cc1C(=O)N)Cl 7a_100000743835_100000747449 [0,2,0,0,0,0|1,0,0]=3 3813 B16R1.1138 COC(=O)CNc1ccc(cc1C(=O)N)F 34a_100000741173_100000747449 [0,2,0,0,0,0|1,0,0]=3 3814 B16R1.1138 COC(=O)CNc1ccc(cc1C(=O)N)F 7a_100000741173_100000747449 [0,2,0,0,0,0|1,0,0]=3 3815 B16R1.1138 COC(=O)COc1ccc(cc1C(=O)C)Br 34a_100000212127_100000747449 [0,2,0,0,0,0|1,0,0]=3 3816 B16R1.1138 COC(=O)COc1ccc(cc1C(=O)C)Br 7a_100000212127_100000747449 [0,2,0,0,0,0|1,0,0]=3 3817 B16R1.1138 COC(=O)COc1ccc(cc1C(=O)C)C 34a_100000195442_100000747449 [0,2,0,0,0,0|1,0,0]=3 3818 B16R1.1138 COC(=O)COc1ccc(cc1C(=O)C)C 7a_100000195442_100000747449 [0,2,0,0,0,0|1,0,0]=3 3819 B16R1.1138 COC(=O)COc1ccc(cc1C(=O)C)Cl 34a_100000185566_100000747449 [0,2,0,0,0,0|1,0,0]=3 3820 B16R1.1138 COC(=O)COc1ccc(cc1C(=O)C)Cl 7a_100000185566_100000747449 [0,2,0,0,0,0|1,0,0]=3 3821 B16R1.1138 COC(=O)COc1ccc(cc1C(=O)C)F 7a_100000182812_100000747449 [0,2,0,0,0,0|1,0,0]=3 3822 B16R1.1138 COC(=O)COc1ccc(cc1C(=O)C)I 7a_100010712555_100000747449 [0,2,0,0,0,0|1,0,0]=3 3823 B16R1.1138 COC(=O)COc1ccc(cc1C(=O)C)N 34a_100011218865_100000747449 [0,2,0,0,0,0|1,0,0]=3 3824 B16R1.1138 COC(=O)COc1ccc(cc1C(=O)N)Br 34a_100000192807_100000747449 [0,2,0,0,0,0|0,0,0]=2 3825 B16R1.1138 COC(=O)COc1ccc(cc1C(=O)N)Br 7a_100000192807_100000747449 [0,2,0,0,0,0|0,0,0]=2 3826 B16R1.1138 COC(=O)COc1ccc(cc1C(=O)N)C 34a_200000192840_100000747449 [0,2,0,0,0,0|0,0,0]=2 3827 B16R1.1138 COC(=O)COc1ccc(cc1C(=O)N)C 7a_200000192840_100000747449 [0,2,0,0,0,0|0,0,0]=2 3828 B16R1.1138 COC(=O)COc1ccc(cc1C(=O)N)Cl 34a_100000185026_100000747449 [0,2,0,0,0,0|0,0,0]=2 3829 B16R1.1138 COC(=O)COc1ccc(cc1C(=O)N)Cl 7a_100000185026_100000747449 [0,2,0,0,0,0|0,0,0]=2 3830 B16R1.1138 COC(=O)COc1ccc(cc1C(=O)N)F 34a_100012186459_100000747449 [0,2,0,0,0,0|0,0,0]=2 3831 B16R1.1138 COC(=O)COc1ccc(cc1C(=O)N)F 7a_100012186459_100000747449 [0,2,0,0,0,0|0,0,0]=2 3832 B16R1.1138 COC(=O)COc1ccc(cc1C(=O)N)I 34a_100000192813_100000747449 [0,2,0,0,0,0|0,0,0]=2 3833 B16R1.1138 COC(=O)COc1ccc(cc1C(=O)N)I 7a_100000192813_100000747449 [0,2,0,0,0,0|0,0,0]=2 3834 B16R1.1138 COC(=O)COc1ccc(cc1[C@@H](C)N)Cl 34a_100011853016_100000747449 [0,2,0,0,0,0|1,0,1]=4 3835 B16R1.1138 COC(=O)COc1ccc(cc1[C@@H](C)N)Cl 7a_100011853016_100000747449 [0,2,0,0,0,0|1,0,1]=4 3836 B16R1.1138 COC(=O)COc1ccc(cc1[C@H](C)N)F 34a_100160469477_100000747449 [0,2,0,0,0,0|1,0,1]=4 3837 B16R1.1138 COC(=O)COc1ccc(cc1[C@H](C)N)F 7a_100160469477_100000747449 [0,2,0,0,0,0|1,0,1]=4 3838 B16R1.1138 COC(=O)COc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_100000747449 [0,2,0,0,0,0|2,0,0]=4 3839 B16R1.1138 COC(=O)COc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_100000747449 [0,2,0,0,0,0|2,0,0]=4 3840 B16R1.1138 COC(=O)COc1ccc(cc1[N+](=O)[O-])C 34a_100000195567_100000747449 [0,2,0,0,0,0|2,0,0]=4 3841 B16R1.1138 COC(=O)COc1ccc(cc1[N+](=O)[O-])C 7a_100000195567_100000747449 [0,2,0,0,0,0|2,0,0]=4 3842 B16R1.1138 COC(=O)COc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_100000747449 [0,2,0,0,0,0|2,0,0]=4 3843 B16R1.1138 COC(=O)COc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_100000747449 [0,2,0,0,0,0|2,0,0]=4 3844 B16R1.1138 COC(=O)COc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_100000747449 [0,2,0,0,0,0|2,0,0]=4 3845 B16R1.1138 COC(=O)COc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_100000747449 [0,2,0,0,0,0|2,0,0]=4 3846 B16R1.1138 COC(=O)COc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_100000747449 [0,2,0,0,0,0|2,0,0]=4 3847 B16R1.1138 COC(=O)COc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_100000747449 [0,2,0,0,0,0|2,0,0]=4 3848 B16R1.1138 COC(=O)COc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_100000747449 [0,2,0,0,0,0|2,0,0]=4 3849 B16R1.1138 COC(=O)CSc1ccc(cc1C(=O)C)Br 62a_100012349576_100000747449 [0,2,0,0,0,0|1,1,0]=4 3850 B16R1.1138 COC(=O)CSc1ccc(cc1C(=O)C)C 62a_100000747449_100012361225 [0,2,0,0,0,0|1,1,0]=4 3851 B16R1.1138 COC(=O)CSc1ccc(cc1C(=O)C)C 62a_100012361225_100000747449 [0,2,0,0,0,0|1,1,0]=4 3852 B16R1.1138 COC(=O)CSc1ccc(cc1C(=O)C)F 62a_100000747449_100010200798 [0,2,0,0,0,0|1,1,0]=4 3853 B16R1.1138 COC(=O)CSc1ccc(cc1C(=O)C)F 62a_100012353695_100000747449 [0,2,0,0,0,0|1,1,0]=4 3854 B16R1.1138 COC(=O)CSc1ccc(cc1C(=O)C)N 62a_100012349454_100000747449 [0,2,0,0,0,0|1,1,0]=4 3855 B16R1.1138 COC(=O)CSc1ccc(cc1C(=O)N)Br 62a_200000162314_100000747449 [0,2,0,0,0,0|0,1,0]=3 3856 B16R1.1138 COC(=O)CSc1ccc(cc1C(=O)N)C 62a_100000747449_200012349609 [0,2,0,0,0,0|0,1,0]=3 3857 B16R1.1138 COC(=O)CSc1ccc(cc1C(=O)N)C 62a_200012349609_100000747449 [0,2,0,0,0,0|0,1,0]=3 3858 B16R1.1138 COC(=O)CSc1ccc(cc1C(=O)N)F 62a_100000206434_100000747449 [0,2,0,0,0,0|0,1,0]=3 3859 B16R1.1138 COC(=O)CSc1ccc(cc1C(=O)N)F 62a_100000747449_100000206434 [0,2,0,0,0,0|0,1,0]=3 3860 B16R1.1138 COC(=O)CSc1ccc(cc1C(=O)N)N 62a_100015186447_100000747449 [0,2,0,0,0,0|0,1,0]=3 3861 B16R1.1138 COC(=O)CSc1ccc(cc1C(=O)O)Br 62a_100011072988_100000747449 [0,2,0,0,0,0|1,1,0]=4 3862 B16R1.1138 COC(=O)CSc1ncc(cc1C(=O)N)F 62a_100000747449_100012183597 [0,2,0,0,0,0|1,1,0]=4 3863 B16R1.1138 COC(=O)CSc1ncc(cc1C(=O)N)F 62a_100012183597_100000747449 [0,2,0,0,0,0|1,1,0]=4 3864 B16R1.1138 C[C@@H](CO)COc1ccc(cc1C(=O)N)Br 34a_100000192807_100000059175 [0,2,0,0,0,0|1,0,1]=4 3865 B16R1.1138 C[C@@H](CO)COc1ccc(cc1C(=O)N)Br 7a_100000192807_100000059175 [0,2,0,0,0,0|1,0,1]=4 3866 B16R1.1138 C[C@@H](CO)COc1ccc(cc1C(=O)N)Cl 34a_100000185026_100000059175 [0,2,0,0,0,0|1,0,1]=4 3867 B16R1.1138 C[C@@H](CO)COc1ccc(cc1C(=O)N)Cl 7a_100000185026_100000059175 [0,2,0,0,0,0|1,0,1]=4 3868 B16R1.1138 C[C@@H](CO)COc1ccc(cc1C(=O)N)F 34a_100012186459_100000059175 [0,2,0,0,0,0|1,0,1]=4 3869 B16R1.1138 C[C@@H](CO)COc1ccc(cc1C(=O)N)F 7a_100012186459_100000059175 [0,2,0,0,0,0|1,0,1]=4 3870 B16R1.1138 C[C@@H](CO)COc1ccc(cc1C(=O)N)I 34a_100000192813_100000059175 [0,2,0,0,0,0|1,0,1]=4 3871 B16R1.1138 C[C@@H](CO)COc1ccc(cc1C(=O)N)I 7a_100000192813_100000059175 [0,2,0,0,0,0|1,0,1]=4 3872 B16R1.1138 Cc1ccc(c(c1)C(=O)N)OCC(O)CO 34a_200000192840_100011219619 [0,2,0,0,0,0|0,0,2]=4 3873 B16R1.1138 Cc1ccc(c(c1)C(=O)N)OCC(O)CO 7a_200000192840_100011219619 [0,2,0,0,0,0|0,0,2]=4 3874 B16R1.1138 Cc1ccc(c(c1)C(=O)N)OC[C@@H](C)CO 34a_200000192840_100000059175 [0,2,0,0,0,0|1,0,1]=4 3875 B16R1.1138 Cc1ccc(c(c1)C(=O)N)OC[C@@H](C)CO 7a_200000192840_100000059175 [0,2,0,0,0,0|1,0,1]=4 3876 B16R1.1138 Cc1ccc(c(c1)C(=O)N)OC[C@@H](O)CF 34a_200000192840_100015614560 [0,2,0,0,0,0|1,0,1]=4 3877 B16R1.1138 Cc1ccc(c(c1)C(=O)N)OC[C@@H](O)CF 7a_200000192840_100015614560 [0,2,0,0,0,0|1,0,1]=4 3878 B16R1.1138 Cc1ccc(c(c1)C(=O)N)OC[C@@H](O)CO 34a_200000192840_100009815848 [0,2,0,0,0,0|0,0,2]=4 3879 B16R1.1138 Cc1ccc(c(c1)C(=O)N)OC[C@@H](O)CO 7a_200000192840_100009815848 [0,2,0,0,0,0|0,0,2]=4 3880 B16R1.1138 NC(=O)c1cc(ccc1OCC(O)CO)Br 34a_100000192807_100011219619 [0,2,0,0,0,0|0,0,2]=4 3881 B16R1.1138 NC(=O)c1cc(ccc1OCC(O)CO)Br 7a_100000192807_100011219619 [0,2,0,0,0,0|0,0,2]=4 3882 B16R1.1138 NC(=O)c1cc(ccc1OCC(O)CO)Cl 34a_100000185026_100011219619 [0,2,0,0,0,0|0,0,2]=4 3883 B16R1.1138 NC(=O)c1cc(ccc1OCC(O)CO)Cl 7a_100000185026_100011219619 [0,2,0,0,0,0|0,0,2]=4 3884 B16R1.1138 NC(=O)c1cc(ccc1OCC(O)CO)F 34a_100012186459_100011219619 [0,2,0,0,0,0|0,0,2]=4 3885 B16R1.1138 NC(=O)c1cc(ccc1OCC(O)CO)F 7a_100012186459_100011219619 [0,2,0,0,0,0|0,0,2]=4 3886 B16R1.1138 NC(=O)c1cc(ccc1OCC(O)CO)I 34a_100000192813_100011219619 [0,2,0,0,0,0|0,0,2]=4 3887 B16R1.1138 NC(=O)c1cc(ccc1OCC(O)CO)I 7a_100000192813_100011219619 [0,2,0,0,0,0|0,0,2]=4 3888 B16R1.1138 NC(=O)c1cc(ccc1OC[C@@H](O)CF)Br 34a_100000192807_100015614560 [0,2,0,0,0,0|1,0,1]=4 3889 B16R1.1138 NC(=O)c1cc(ccc1OC[C@@H](O)CF)Br 7a_100000192807_100015614560 [0,2,0,0,0,0|1,0,1]=4 3890 B16R1.1138 NC(=O)c1cc(ccc1OC[C@@H](O)CF)Cl 34a_100000185026_100015614560 [0,2,0,0,0,0|1,0,1]=4 3891 B16R1.1138 NC(=O)c1cc(ccc1OC[C@@H](O)CF)Cl 7a_100000185026_100015614560 [0,2,0,0,0,0|1,0,1]=4 3892 B16R1.1138 NC(=O)c1cc(ccc1OC[C@@H](O)CF)F 34a_100012186459_100015614560 [0,2,0,0,0,0|1,0,1]=4 3893 B16R1.1138 NC(=O)c1cc(ccc1OC[C@@H](O)CF)F 7a_100012186459_100015614560 [0,2,0,0,0,0|1,0,1]=4 3894 B16R1.1138 NC(=O)c1cc(ccc1OC[C@@H](O)CF)I 34a_100000192813_100015614560 [0,2,0,0,0,0|1,0,1]=4 3895 B16R1.1138 NC(=O)c1cc(ccc1OC[C@@H](O)CF)I 7a_100000192813_100015614560 [0,2,0,0,0,0|1,0,1]=4 3896 B16R1.1138 NC(=O)c1cc(ccc1OC[C@@H](O)CO)Br 34a_100000192807_100009815848 [0,2,0,0,0,0|0,0,2]=4 3897 B16R1.1138 NC(=O)c1cc(ccc1OC[C@@H](O)CO)Br 7a_100000192807_100009815848 [0,2,0,0,0,0|0,0,2]=4 3898 B16R1.1138 NC(=O)c1cc(ccc1OC[C@@H](O)CO)Cl 34a_100000185026_100009815848 [0,2,0,0,0,0|0,0,2]=4 3899 B16R1.1138 NC(=O)c1cc(ccc1OC[C@@H](O)CO)Cl 7a_100000185026_100009815848 [0,2,0,0,0,0|0,0,2]=4 3900 B16R1.1138 NC(=O)c1cc(ccc1OC[C@@H](O)CO)F 34a_100012186459_100009815848 [0,2,0,0,0,0|0,0,2]=4 3901 B16R1.1138 NC(=O)c1cc(ccc1OC[C@@H](O)CO)F 7a_100012186459_100009815848 [0,2,0,0,0,0|0,0,2]=4 3902 B16R1.1138 NC(=O)c1cc(ccc1OC[C@@H](O)CO)I 34a_100000192813_100009815848 [0,2,0,0,0,0|0,0,2]=4 3903 B16R1.1138 NC(=O)c1cc(ccc1OC[C@@H](O)CO)I 7a_100000192813_100009815848 [0,2,0,0,0,0|0,0,2]=4 3904 B16R1.1302 C=C(C#N)COc1cc(ccc1C(=O)N)Br 34a_100011550861_100000694840 [0,2,0,0,0,0|2,0,0]=4 3905 B16R1.1302 C=C(C#N)COc1cc(ccc1C(=O)N)C 34a_100000192831_100000694840 [0,2,0,0,0,0|2,0,0]=4 3906 B16R1.1302 C=C(C#N)COc1cc(ccc1C(=O)N)Cl 34a_100000192836_100000694840 [0,2,0,0,0,0|2,0,0]=4 3907 B16R1.1302 C=C(C#N)COc1cc(ccc1C(=O)N)N 34a_100000223280_100000694840 [0,2,0,0,0,0|2,0,0]=4 3908 B16R1.1302 C=C(C)c1ccc(cc1OCC(=O)OC)F 271570a_100000694244_200012936119 [0,2,0,0,0,0|2,0,0]=4 3909 B16R1.1302 C=CC(O)COc1cc(ccc1C(=O)N)Br 34a_100011550861_100000730141 [0,2,0,0,0,0|1,0,1]=4 3910 B16R1.1302 C=CC(O)COc1cc(ccc1C(=O)N)Br 7a_100011550861_100000730141 [0,2,0,0,0,0|1,0,1]=4 3911 B16R1.1302 C=CC(O)COc1cc(ccc1C(=O)N)C 34a_100000192831_100000730141 [0,2,0,0,0,0|1,0,1]=4 3912 B16R1.1302 C=CC(O)COc1cc(ccc1C(=O)N)C 7a_100000192831_100000730141 [0,2,0,0,0,0|1,0,1]=4 3913 B16R1.1302 C=CC(O)COc1cc(ccc1C(=O)N)Cl 34a_100000192836_100000730141 [0,2,0,0,0,0|1,0,1]=4 3914 B16R1.1302 C=CC(O)COc1cc(ccc1C(=O)N)Cl 7a_100000192836_100000730141 [0,2,0,0,0,0|1,0,1]=4 3915 B16R1.1302 C=CC(O)COc1cc(ccc1C(=O)N)N 34a_100000223280_100000730141 [0,2,0,0,0,0|1,0,1]=4 3916 B16R1.1302 C=CC(O)COc1cc(ccc1C(=O)N)N 7a_100000223280_100000730141 [0,2,0,0,0,0|1,0,1]=4 3917 B16R1.1302 CCC(=O)CNc1cc(ccc1C(=O)N)Br 7a_100012349972_100000747405 [0,2,0,0,0,0|2,0,0]=4 3918 B16R1.1302 CCC(=O)CNc1cc(ccc1C(=O)N)C 7a_100011219537_100000747405 [0,2,0,0,0,0|2,0,0]=4 3919 B16R1.1302 CCC(=O)CNc1cc(ccc1C(=O)N)Cl 7a_100000738103_100000747405 [0,2,0,0,0,0|2,0,0]=4 3920 B16R1.1302 CCC(=O)COc1cc(ccc1C(=O)C)Br 7a_100000188348_100000747405 [0,2,0,0,0,0|2,0,0]=4 3921 B16R1.1302 CCC(=O)COc1cc(ccc1C(=O)C)C 7a_100000234885_100000747405 [0,2,0,0,0,0|2,0,0]=4 3922 B16R1.1302 CCC(=O)COc1cc(ccc1C(=O)C)Cl 7a_100000061402_100000747405 [0,2,0,0,0,0|2,0,0]=4 3923 B16R1.1302 CCC(=O)COc1cc(ccc1C(=O)C)F 7a_100011215782_100000747405 [0,2,0,0,0,0|2,0,0]=4 3924 B16R1.1302 CCC(=O)COc1cc(ccc1C(=O)N)Br 7a_100011550861_100000747405 [0,2,0,0,0,0|1,0,0]=3 3925 B16R1.1302 CCC(=O)COc1cc(ccc1C(=O)N)C 7a_100000192831_100000747405 [0,2,0,0,0,0|1,0,0]=3 3926 B16R1.1302 CCC(=O)COc1cc(ccc1C(=O)N)Cl 7a_100000192836_100000747405 [0,2,0,0,0,0|1,0,0]=3 3927 B16R1.1302 CCC(=O)COc1cc(ccc1C(=O)N)N 7a_100000223280_100000747405 [0,2,0,0,0,0|1,0,0]=3 3928 B16R1.1302 CCC(=O)CSc1cc(ccc1C(=O)N)Br 62a_100009815748_100000747405 [0,2,0,0,0,0|1,1,0]=4 3929 B16R1.1302 CCC(=O)CSc1cc(ccc1C(=O)N)F 62a_100000206404_100000747405 [0,2,0,0,0,0|1,1,0]=4 3930 B16R1.1302 CCC(=O)CSc1cc(ccc1C(=O)N)F 62a_100000747405_100000206404 [0,2,0,0,0,0|1,1,0]=4 3931 B16R1.1302 CCC(O)COc1cc(ccc1C(=O)N)Br 34a_100011550861_100011218378 [0,2,0,0,0,0|1,0,1]=4 3932 B16R1.1302 CCC(O)COc1cc(ccc1C(=O)N)Br 7a_100011550861_100011218378 [0,2,0,0,0,0|1,0,1]=4 3933 B16R1.1302 CCC(O)COc1cc(ccc1C(=O)N)C 34a_100000192831_100011218378 [0,2,0,0,0,0|1,0,1]=4 3934 B16R1.1302 CCC(O)COc1cc(ccc1C(=O)N)C 7a_100000192831_100011218378 [0,2,0,0,0,0|1,0,1]=4 3935 B16R1.1302 CCC(O)COc1cc(ccc1C(=O)N)Cl 34a_100000192836_100011218378 [0,2,0,0,0,0|1,0,1]=4 3936 B16R1.1302 CCC(O)COc1cc(ccc1C(=O)N)Cl 7a_100000192836_100011218378 [0,2,0,0,0,0|1,0,1]=4 3937 B16R1.1302 CCC(O)COc1cc(ccc1C(=O)N)N 34a_100000223280_100011218378 [0,2,0,0,0,0|1,0,1]=4 3938 B16R1.1302 CCC(O)COc1cc(ccc1C(=O)N)N 7a_100000223280_100011218378 [0,2,0,0,0,0|1,0,1]=4 3939 B16R1.1302 CNC(=O)CNc1cc(ccc1C(=O)N)Br 27a_100000693194_100009815748 [0,2,0,0,0,0|2,0,0]=4 3940 B16R1.1302 CNC(=O)CNc1cc(ccc1C(=O)N)Br 7a_100012349972_100000183359 [0,2,0,0,0,0|2,0,0]=4 3941 B16R1.1302 CNC(=O)CNc1cc(ccc1C(=O)N)C 34a_100011219537_100000183359 [0,2,0,0,0,0|2,0,0]=4 3942 B16R1.1302 CNC(=O)CNc1cc(ccc1C(=O)N)C 7a_100011219537_100000183359 [0,2,0,0,0,0|2,0,0]=4 3943 B16R1.1302 CNC(=O)CNc1cc(ccc1C(=O)N)Cl 34a_100000738103_100000183359 [0,2,0,0,0,0|2,0,0]=4 3944 B16R1.1302 CNC(=O)CNc1cc(ccc1C(=O)N)Cl 7a_100000738103_100000183359 [0,2,0,0,0,0|2,0,0]=4 3945 B16R1.1302 CNC(=O)CNc1cc(ccc1C(=O)N)F 27a_100000693194_100000206404 [0,2,0,0,0,0|2,0,0]=4 3946 B16R1.1302 CNC(=O)CNc1cc(ccc1C(=O)N)F 34a_100011298637_100000183359 [0,2,0,0,0,0|2,0,0]=4 3947 B16R1.1302 CNC(=O)COc1cc(ccc1C(=O)C)Br 7a_100000188348_100000183359 [0,2,0,0,0,0|2,0,0]=4 3948 B16R1.1302 CNC(=O)COc1cc(ccc1C(=O)C)C 34a_100000234885_100000183359 [0,2,0,0,0,0|2,0,0]=4 3949 B16R1.1302 CNC(=O)COc1cc(ccc1C(=O)C)C 7a_100000234885_100000183359 [0,2,0,0,0,0|2,0,0]=4 3950 B16R1.1302 CNC(=O)COc1cc(ccc1C(=O)C)Cl 34a_100000061402_100000183359 [0,2,0,0,0,0|2,0,0]=4 3951 B16R1.1302 CNC(=O)COc1cc(ccc1C(=O)C)Cl 7a_100000061402_100000183359 [0,2,0,0,0,0|2,0,0]=4 3952 B16R1.1302 CNC(=O)COc1cc(ccc1C(=O)C)F 7a_100011215782_100000183359 [0,2,0,0,0,0|2,0,0]=4 3953 B16R1.1302 CNC(=O)COc1cc(ccc1C(=O)N)Br 34a_100011550861_100000183359 [0,2,0,0,0,0|1,0,0]=3 3954 B16R1.1302 CNC(=O)COc1cc(ccc1C(=O)N)Br 7a_100011550861_100000183359 [0,2,0,0,0,0|1,0,0]=3 3955 B16R1.1302 CNC(=O)COc1cc(ccc1C(=O)N)C 34a_100000192831_100000183359 [0,2,0,0,0,0|1,0,0]=3 3956 B16R1.1302 CNC(=O)COc1cc(ccc1C(=O)N)C 7a_100000192831_100000183359 [0,2,0,0,0,0|1,0,0]=3 3957 B16R1.1302 CNC(=O)COc1cc(ccc1C(=O)N)Cl 34a_100000192836_100000183359 [0,2,0,0,0,0|1,0,0]=3 3958 B16R1.1302 CNC(=O)COc1cc(ccc1C(=O)N)Cl 7a_100000192836_100000183359 [0,2,0,0,0,0|1,0,0]=3 3959 B16R1.1302 CNC(=O)COc1cc(ccc1C(=O)N)N 34a_100000223280_100000183359 [0,2,0,0,0,0|1,0,0]=3 3960 B16R1.1302 CNC(=O)COc1cc(ccc1C(=O)N)N 7a_100000223280_100000183359 [0,2,0,0,0,0|1,0,0]=3 3961 B16R1.1302 CNC(=O)CSc1cc(ccc1C(=O)N)Br 62a_100009815748_100000183359 [0,2,0,0,0,0|1,1,0]=4 3962 B16R1.1302 CNC(=O)CSc1cc(ccc1C(=O)N)F 62a_100000183359_100000206404 [0,2,0,0,0,0|1,1,0]=4 3963 B16R1.1302 CNC(=O)CSc1cc(ccc1C(=O)N)F 62a_100000206404_100000183359 [0,2,0,0,0,0|1,1,0]=4 3964 B16R1.1302 COC(=O)CNc1cc(ccc1C(=O)N)Br 7a_100012349972_100000747449 [0,2,0,0,0,0|1,0,0]=3 3965 B16R1.1302 COC(=O)CNc1cc(ccc1C(=O)N)C 34a_100011219537_100000747449 [0,2,0,0,0,0|1,0,0]=3 3966 B16R1.1302 COC(=O)CNc1cc(ccc1C(=O)N)C 7a_100011219537_100000747449 [0,2,0,0,0,0|1,0,0]=3 3967 B16R1.1302 COC(=O)CNc1cc(ccc1C(=O)N)Cl 34a_100000738103_100000747449 [0,2,0,0,0,0|1,0,0]=3 3968 B16R1.1302 COC(=O)CNc1cc(ccc1C(=O)N)Cl 7a_100000738103_100000747449 [0,2,0,0,0,0|1,0,0]=3 3969 B16R1.1302 COC(=O)CNc1cc(ccc1C(=O)N)F 34a_100011298637_100000747449 [0,2,0,0,0,0|1,0,0]=3 3970 B16R1.1302 COC(=O)COc1cc(ccc1C(=O)C)Br 7a_100000188348_100000747449 [0,2,0,0,0,0|1,0,0]=3 3971 B16R1.1302 COC(=O)COc1cc(ccc1C(=O)C)C 34a_100000234885_100000747449 [0,2,0,0,0,0|1,0,0]=3 3972 B16R1.1302 COC(=O)COc1cc(ccc1C(=O)C)C 7a_100000234885_100000747449 [0,2,0,0,0,0|1,0,0]=3 3973 B16R1.1302 COC(=O)COc1cc(ccc1C(=O)C)Cl 34a_100000061402_100000747449 [0,2,0,0,0,0|1,0,0]=3 3974 B16R1.1302 COC(=O)COc1cc(ccc1C(=O)C)Cl 7a_100000061402_100000747449 [0,2,0,0,0,0|1,0,0]=3 3975 B16R1.1302 COC(=O)COc1cc(ccc1C(=O)C)F 7a_100011215782_100000747449 [0,2,0,0,0,0|1,0,0]=3 3976 B16R1.1302 COC(=O)COc1cc(ccc1C(=O)N)Br 34a_100011550861_100000747449 [0,2,0,0,0,0|0,0,0]=2 3977 B16R1.1302 COC(=O)COc1cc(ccc1C(=O)N)Br 7a_100011550861_100000747449 [0,2,0,0,0,0|0,0,0]=2 3978 B16R1.1302 COC(=O)COc1cc(ccc1C(=O)N)C 34a_100000192831_100000747449 [0,2,0,0,0,0|0,0,0]=2 3979 B16R1.1302 COC(=O)COc1cc(ccc1C(=O)N)C 7a_100000192831_100000747449 [0,2,0,0,0,0|0,0,0]=2 3980 B16R1.1302 COC(=O)COc1cc(ccc1C(=O)N)Cl 34a_100000192836_100000747449 [0,2,0,0,0,0|0,0,0]=2 3981 B16R1.1302 COC(=O)COc1cc(ccc1C(=O)N)Cl 7a_100000192836_100000747449 [0,2,0,0,0,0|0,0,0]=2 3982 B16R1.1302 COC(=O)COc1cc(ccc1C(=O)N)N 34a_100000223280_100000747449 [0,2,0,0,0,0|0,0,0]=2 3983 B16R1.1302 COC(=O)COc1cc(ccc1C(=O)N)N 7a_100000223280_100000747449 [0,2,0,0,0,0|0,0,0]=2 3984 B16R1.1302 COC(=O)COc1cc(ccc1[N+](=O)[O-])Br 7a_100011934350_100000747449 [0,2,0,0,0,0|2,0,0]=4 3985 B16R1.1302 COC(=O)COc1cc(ccc1[N+](=O)[O-])C 34a_100000195450_100000747449 [0,2,0,0,0,0|2,0,0]=4 3986 B16R1.1302 COC(=O)COc1cc(ccc1[N+](=O)[O-])C 7a_100000195450_100000747449 [0,2,0,0,0,0|2,0,0]=4 3987 B16R1.1302 COC(=O)COc1cc(ccc1[N+](=O)[O-])Cl 34a_100000746067_100000747449 [0,2,0,0,0,0|2,0,0]=4 3988 B16R1.1302 COC(=O)COc1cc(ccc1[N+](=O)[O-])Cl 7a_100000746067_100000747449 [0,2,0,0,0,0|2,0,0]=4 3989 B16R1.1302 COC(=O)COc1cc(ccc1[N+](=O)[O-])F 34a_100000210785_100000747449 [0,2,0,0,0,0|2,0,0]=4 3990 B16R1.1302 COC(=O)COc1cc(ccc1[N+](=O)[O-])F 7a_100000210785_100000747449 [0,2,0,0,0,0|2,0,0]=4 3991 B16R1.1302 COC(=O)COc1cc(ccc1[N+](=O)[O-])I 7a_100000072657_100000747449 [0,2,0,0,0,0|2,0,0]=4 3992 B16R1.1302 COC(=O)CSc1cc(ccc1C(=O)C)C 62a_100000747449_100012353930 [0,2,0,0,0,0|1,1,0]=4 3993 B16R1.1302 COC(=O)CSc1cc(ccc1C(=O)C)C 62a_100012353930_100000747449 [0,2,0,0,0,0|1,1,0]=4 3994 B16R1.1302 COC(=O)CSc1cc(ccc1C(=O)C)F 62a_100000686192_100000747449 [0,2,0,0,0,0|1,1,0]=4 3995 B16R1.1302 COC(=O)CSc1cc(ccc1C(=O)C)O 62a_100012340537_100000747449 [0,2,0,0,0,0|1,1,0]=4 3996 B16R1.1302 COC(=O)CSc1cc(ccc1C(=O)N)Br 62a_100009815748_100000747449 [0,2,0,0,0,0|0,1,0]=3 3997 B16R1.1302 COC(=O)CSc1cc(ccc1C(=O)N)F 62a_100000206404_100000747449 [0,2,0,0,0,0|0,1,0]=3 3998 B16R1.1302 COC(=O)CSc1cc(ccc1C(=O)N)F 62a_100000747449_100000206404 [0,2,0,0,0,0|0,1,0]=3 3999 B16R1.1302 COC(=O)CSc1nc(ccc1C(=O)N)C 62a_100000041523_100000747449 [0,2,0,0,0,0|1,1,0]=4 4000 B16R1.1302 COC(=O)CSc1nc(ccc1C(=O)N)C 62a_100000747449_100000041523 [0,2,0,0,0,0|1,1,0]=4 4001 B16R1.1302 C[C@@H](CO)COc1cc(ccc1C(=O)N)Br 34a_100011550861_100000059175 [0,2,0,0,0,0|1,0,1]=4 4002 B16R1.1302 C[C@@H](CO)COc1cc(ccc1C(=O)N)Br 7a_100011550861_100000059175 [0,2,0,0,0,0|1,0,1]=4 4003 B16R1.1302 C[C@@H](CO)COc1cc(ccc1C(=O)N)Cl 34a_100000192836_100000059175 [0,2,0,0,0,0|1,0,1]=4 4004 B16R1.1302 C[C@@H](CO)COc1cc(ccc1C(=O)N)Cl 7a_100000192836_100000059175 [0,2,0,0,0,0|1,0,1]=4 4005 B16R1.1302 C[C@@H](CO)COc1cc(ccc1C(=O)N)N 34a_100000223280_100000059175 [0,2,0,0,0,0|1,0,1]=4 4006 B16R1.1302 C[C@@H](CO)COc1cc(ccc1C(=O)N)N 7a_100000223280_100000059175 [0,2,0,0,0,0|1,0,1]=4 4007 B16R1.1302 Cc1ccc(c(c1)OCC(O)CO)C(=O)N 34a_100000192831_100011219619 [0,2,0,0,0,0|0,0,2]=4 4008 B16R1.1302 Cc1ccc(c(c1)OCC(O)CO)C(=O)N 7a_100000192831_100011219619 [0,2,0,0,0,0|0,0,2]=4 4009 B16R1.1302 Cc1ccc(c(c1)OC[C@@H](C)CO)C(=O)N 34a_100000192831_100000059175 [0,2,0,0,0,0|1,0,1]=4 4010 B16R1.1302 Cc1ccc(c(c1)OC[C@@H](C)CO)C(=O)N 7a_100000192831_100000059175 [0,2,0,0,0,0|1,0,1]=4 4011 B16R1.1302 Cc1ccc(c(c1)OC[C@@H](O)CF)C(=O)N 34a_100000192831_100015614560 [0,2,0,0,0,0|1,0,1]=4 4012 B16R1.1302 Cc1ccc(c(c1)OC[C@@H](O)CF)C(=O)N 7a_100000192831_100015614560 [0,2,0,0,0,0|1,0,1]=4 4013 B16R1.1302 Cc1ccc(c(c1)OC[C@@H](O)CO)C(=O)N 34a_100000192831_100009815848 [0,2,0,0,0,0|0,0,2]=4 4014 B16R1.1302 Cc1ccc(c(c1)OC[C@@H](O)CO)C(=O)N 7a_100000192831_100009815848 [0,2,0,0,0,0|0,0,2]=4 4015 B16R1.1302 NC(=O)c1ccc(cc1OCC(O)CO)Br 34a_100011550861_100011219619 [0,2,0,0,0,0|0,0,2]=4 4016 B16R1.1302 NC(=O)c1ccc(cc1OCC(O)CO)Br 7a_100011550861_100011219619 [0,2,0,0,0,0|0,0,2]=4 4017 B16R1.1302 NC(=O)c1ccc(cc1OCC(O)CO)Cl 34a_100000192836_100011219619 [0,2,0,0,0,0|0,0,2]=4 4018 B16R1.1302 NC(=O)c1ccc(cc1OCC(O)CO)Cl 7a_100000192836_100011219619 [0,2,0,0,0,0|0,0,2]=4 4019 B16R1.1302 NC(=O)c1ccc(cc1OCC(O)CO)N 34a_100000223280_100011219619 [0,2,0,0,0,0|0,0,2]=4 4020 B16R1.1302 NC(=O)c1ccc(cc1OCC(O)CO)N 7a_100000223280_100011219619 [0,2,0,0,0,0|0,0,2]=4 4021 B16R1.1302 NC(=O)c1ccc(cc1OC[C@@H](O)CF)Br 34a_100011550861_100015614560 [0,2,0,0,0,0|1,0,1]=4 4022 B16R1.1302 NC(=O)c1ccc(cc1OC[C@@H](O)CF)Br 7a_100011550861_100015614560 [0,2,0,0,0,0|1,0,1]=4 4023 B16R1.1302 NC(=O)c1ccc(cc1OC[C@@H](O)CF)Cl 34a_100000192836_100015614560 [0,2,0,0,0,0|1,0,1]=4 4024 B16R1.1302 NC(=O)c1ccc(cc1OC[C@@H](O)CF)Cl 7a_100000192836_100015614560 [0,2,0,0,0,0|1,0,1]=4 4025 B16R1.1302 NC(=O)c1ccc(cc1OC[C@@H](O)CF)N 34a_100000223280_100015614560 [0,2,0,0,0,0|1,0,1]=4 4026 B16R1.1302 NC(=O)c1ccc(cc1OC[C@@H](O)CF)N 7a_100000223280_100015614560 [0,2,0,0,0,0|1,0,1]=4 4027 B16R1.1302 NC(=O)c1ccc(cc1OC[C@@H](O)CO)Br 34a_100011550861_100009815848 [0,2,0,0,0,0|0,0,2]=4 4028 B16R1.1302 NC(=O)c1ccc(cc1OC[C@@H](O)CO)Br 7a_100011550861_100009815848 [0,2,0,0,0,0|0,0,2]=4 4029 B16R1.1302 NC(=O)c1ccc(cc1OC[C@@H](O)CO)Cl 34a_100000192836_100009815848 [0,2,0,0,0,0|0,0,2]=4 4030 B16R1.1302 NC(=O)c1ccc(cc1OC[C@@H](O)CO)Cl 7a_100000192836_100009815848 [0,2,0,0,0,0|0,0,2]=4 4031 B16R1.1302 NC(=O)c1ccc(cc1OC[C@@H](O)CO)N 34a_100000223280_100009815848 [0,2,0,0,0,0|0,0,2]=4 4032 B16R1.1302 NC(=O)c1ccc(cc1OC[C@@H](O)CO)N 7a_100000223280_100009815848 [0,2,0,0,0,0|0,0,2]=4 4033 B16R1.1331 COC(=O)CNc1ccccc1S(=O)(=O)N 34a_100011204920_100000747449 [0,2,0,0,0,0|2,0,0]=4 4034 B16R1.1331 COC(=O)COc1ccccc1S(=O)(=O)C 34a_100000054562_100000747449 [0,2,0,0,0,0|2,0,0]=4 4035 B16R1.1331 COC(=O)COc1ccccc1S(=O)(=O)C 7a_100000054562_100000747449 [0,2,0,0,0,0|2,0,0]=4 4036 B16R1.1331 COC(=O)CSc1ccccc1S(=O)(=O)N 62a_100000164562_100000747449 [0,2,0,0,0,0|1,1,0]=4 4037 B16R1.4440 C#CCC(=O)COc1ccccc1C(=O)N 1458a_100000182327_100000184674 [0,2,0,0,0,0|1,0,0]=3 4038 B16R1.4440 C=C(C)c1ccccc1OCC(=O)OCC 271570a_100000694244_100000174061 [0,2,0,0,0,0|2,0,0]=4 4039 B16R1.4440 C=CCC(=O)COc1ccccc1C(=O)N 1458a_100000182327_100000210623 [0,2,0,0,0,0|1,0,0]=3 4040 B16R1.4440 C=COC(=O)CNc1ccccc1C(=O)N 34a_100000185089_100000036128 [0,2,0,0,0,0|1,0,0]=3 4041 B16R1.4440 C=COC(=O)COc1ccccc1C(=O)N 34a_100000192804_100000036128 [0,2,0,0,0,0|0,0,0]=2 4042 B16R1.4440 C=COC(=O)COc1ccccc1[C@@H](C)N 34a_100025703389_100000036128 [0,2,0,0,0,0|1,0,1]=4 4043 B16R1.4440 C=COC(=O)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100000036128 [0,2,0,0,0,0|2,0,0]=4 4044 B16R1.4440 C=COC(=O)COc1cccnc1C(=O)C 34a_100000087166_100000036128 [0,2,0,0,0,0|2,0,0]=4 4045 B16R1.4440 C=COC(=O)COc1cccnc1C(=O)N 34a_200011215183_100000036128 [0,2,0,0,0,0|1,0,0]=3 4046 B16R1.4440 C=COC(=O)COc1ccncc1C(=O)N 34a_200011998761_100000036128 [0,2,0,0,0,0|1,0,0]=3 4047 B16R1.4440 C=COC(=O)COc1nccnc1C(=O)N 34a_100011830332_100000036128 [0,2,0,0,0,0|2,0,0]=4 4048 B16R1.4440 C=COC(=O)CSc1ccccc1C(=O)C 62a_100000751169_100000036128 [0,2,0,0,0,0|1,1,0]=4 4049 B16R1.4440 C=COC(=O)CSc1ccccc1C(=O)N 62a_100000036128_100000162227 [0,2,0,0,0,0|0,1,0]=3 4050 B16R1.4440 C=COC(=O)CSc1ccccc1C(=O)N 62a_100000162227_100000036128 [0,2,0,0,0,0|0,1,0]=3 4051 B16R1.4440 C=COC(=O)CSc1ccccc1C(=O)O 62a_100000036128_100000734275 [0,2,0,0,0,0|1,1,0]=4 4052 B16R1.4440 C=COC(=O)CSc1ccccc1C(=O)O 62a_202125556159_100000036128 [0,2,0,0,0,0|1,1,0]=4 4053 B16R1.4440 C=COC(=O)CSc1cccnc1C(=O)N 62a_100000036128_200012359670 [0,2,0,0,0,0|1,1,0]=4 4054 B16R1.4440 C=COC(=O)CSc1cccnc1C(=O)N 62a_200012359670_100000036128 [0,2,0,0,0,0|1,1,0]=4 4055 B16R1.4440 C=COC(=O)CSc1ccncc1C(=O)N 62a_100000036128_100000697804 [0,2,0,0,0,0|1,1,0]=4 4056 B16R1.4440 C=COC(=O)CSc1ccncc1C(=O)N 62a_100000697804_100000036128 [0,2,0,0,0,0|1,1,0]=4 4057 B16R1.4440 C=COC(=O)CSc1cnccc1C(=O)N 62a_100000036128_100010205435 [0,2,0,0,0,0|1,1,0]=4 4058 B16R1.4440 C=COC(=O)CSc1cnccc1C(=O)N 62a_100010205435_100000036128 [0,2,0,0,0,0|1,1,0]=4 4059 B16R1.4440 C=COC(=O)CSc1ncccc1C(=O)N 62a_100000036128_100000162199 [0,2,0,0,0,0|1,1,0]=4 4060 B16R1.4440 C=COC(=O)CSc1ncccc1C(=O)N 62a_100000162199_100000036128 [0,2,0,0,0,0|1,1,0]=4 4061 B16R1.4440 CC(=O)c1ccccc1SCC(=O)NCO 62a_100000751169_100000185155 [0,2,0,0,0,0|1,1,0]=4 4062 B16R1.4440 CC(=O)c1ccncc1OCC(=O)NCO 7a_100009872882_100000185155 [0,2,0,0,0,0|2,0,0]=4 4063 B16R1.4440 CC(=O)c1ncccc1OCC(=O)NCO 34a_100000087166_100000185155 [0,2,0,0,0,0|2,0,0]=4 4064 B16R1.4440 CC(=O)c1ncccc1OCC(=O)NCO 7a_100000087166_100000185155 [0,2,0,0,0,0|2,0,0]=4 4065 B16R1.4440 CCCC(=O)COc1ccccc1C(=O)N 1458a_100000182327_100000210303 [0,2,0,0,0,0|1,0,0]=3 4066 B16R1.4440 CCCC(=O)COc1ccccc1C(=O)N 7a_100000192804_100000747444 [0,2,0,0,0,0|1,0,0]=3 4067 B16R1.4440 CCCC(=O)COc1ccccc1C(=O)[O-] 7a_100015234032_100000747444 [0,2,0,0,0,0|2,0,0]=4 4068 B16R1.4440 CCCC(=O)COc1ccccc1C(=S)N 7a_100000745089_100000747444 [0,2,0,0,0,0|1,1,0]=4 4069 B16R1.4440 CCCC(=O)COc1cccnc1C(=O)N 7a_200011215183_100000747444 [0,2,0,0,0,0|2,0,0]=4 4070 B16R1.4440 CCCC(=O)COc1cnccc1C(=O)N 7a_100012022987_100000747444 [0,2,0,0,0,0|2,0,0]=4 4071 B16R1.4440 CCCC(=O)CSc1ccccc1C(=O)N 62a_100000162227_100000747444 [0,2,0,0,0,0|1,1,0]=4 4072 B16R1.4440 CCCC(=O)CSc1ccccc1C(=O)N 62a_100000747444_100000162227 [0,2,0,0,0,0|1,1,0]=4 4073 B16R1.4440 CCNC(=O)CNc1ccccc1C(=O)N 34a_100000185089_100000183381 [0,2,0,0,0,0|2,0,0]=4 4074 B16R1.4440 CCNC(=O)COc1ccccc1C(=O)N 240690a_100015525214_100000182327 [0,2,0,0,0,0|1,0,0]=3 4075 B16R1.4440 CCNC(=O)COc1ccccc1C(=O)N 34a_100000192804_100000183381 [0,2,0,0,0,0|1,0,0]=3 4076 B16R1.4440 CCNC(=O)COc1ccccc1C(=O)N 7a_100000192804_100000183381 [0,2,0,0,0,0|1,0,0]=3 4077 B16R1.4440 CCNC(=O)COc1ccccc1C(=O)[O-] 7a_100015234032_100000183381 [0,2,0,0,0,0|2,0,0]=4 4078 B16R1.4440 CCNC(=O)COc1ccccc1C(=S)N 7a_100000745089_100000183381 [0,2,0,0,0,0|1,1,0]=4 4079 B16R1.4440 CCNC(=O)COc1cccnc1C(=O)N 34a_200011215183_100000183381 [0,2,0,0,0,0|2,0,0]=4 4080 B16R1.4440 CCNC(=O)COc1cccnc1C(=O)N 7a_200011215183_100000183381 [0,2,0,0,0,0|2,0,0]=4 4081 B16R1.4440 CCNC(=O)COc1ccncc1C(=O)N 34a_200011998761_100000183381 [0,2,0,0,0,0|2,0,0]=4 4082 B16R1.4440 CCNC(=O)COc1cnccc1C(=O)N 7a_100012022987_100000183381 [0,2,0,0,0,0|2,0,0]=4 4083 B16R1.4440 CCNC(=O)CSc1ccccc1C(=O)N 62a_100000162227_100000183381 [0,2,0,0,0,0|1,1,0]=4 4084 B16R1.4440 CCNC(=O)CSc1ccccc1C(=O)N 62a_100000183381_100000162227 [0,2,0,0,0,0|1,1,0]=4 4085 B16R1.4440 CCOC(=O)C=Cc1ccccc1C(=O)N 271570a_100010199719_100000162227 [0,2,0,0,0,0|1,0,1]=4 4086 B16R1.4440 CCOC(=O)CNc1ccccc1C(=O)N 34a_100000185089_100000188475 [0,2,0,0,0,0|1,0,0]=3 4087 B16R1.4440 CCOC(=O)COc1ccccc1C(=O)N 34a_100000192804_100000188475 [0,2,0,0,0,0|0,0,0]=2 4088 B16R1.4440 CCOC(=O)COc1ccccc1C(=O)N 7a_100000192804_100000188475 [0,2,0,0,0,0|0,0,0]=2 4089 B16R1.4440 CCOC(=O)COc1ccccc1C(=O)[O-] 7a_100015234032_100000188475 [0,2,0,0,0,0|1,0,0]=3 4090 B16R1.4440 CCOC(=O)COc1ccccc1C(=S)N 7a_100000745089_100000188475 [0,2,0,0,0,0|0,1,0]=3 4091 B16R1.4440 CCOC(=O)COc1ccccc1[C@@H](C)N 34a_100025703389_100000188475 [0,2,0,0,0,0|1,0,1]=4 4092 B16R1.4440 CCOC(=O)COc1ccccc1[N+](=O)[O-] 34a_100000186319_100000188475 [0,2,0,0,0,0|2,0,0]=4 4093 B16R1.4440 CCOC(=O)COc1ccccc1[N+](=O)[O-] 7a_100000186319_100000188475 [0,2,0,0,0,0|2,0,0]=4 4094 B16R1.4440 CCOC(=O)COc1cccnc1C(=O)C 34a_100000087166_100000188475 [0,2,0,0,0,0|2,0,0]=4 4095 B16R1.4440 CCOC(=O)COc1cccnc1C(=O)C 7a_100000087166_100000188475 [0,2,0,0,0,0|2,0,0]=4 4096 B16R1.4440 CCOC(=O)COc1cccnc1C(=O)N 34a_200011215183_100000188475 [0,2,0,0,0,0|1,0,0]=3 4097 B16R1.4440 CCOC(=O)COc1cccnc1C(=O)N 7a_200011215183_100000188475 [0,2,0,0,0,0|1,0,0]=3 4098 B16R1.4440 CCOC(=O)COc1ccncc1C(=O)N 34a_200011998761_100000188475 [0,2,0,0,0,0|1,0,0]=3 4099 B16R1.4440 CCOC(=O)COc1cnccc1C(=O)C 7a_100009872882_100000188475 [0,2,0,0,0,0|2,0,0]=4 4100 B16R1.4440 CCOC(=O)COc1cnccc1C(=O)N 7a_100012022987_100000188475 [0,2,0,0,0,0|1,0,0]=3 4101 B16R1.4440 CCOC(=O)COc1nccnc1C(=O)N 34a_100011830332_100000188475 [0,2,0,0,0,0|2,0,0]=4 4102 B16R1.4440 CCOC(=O)CSc1ccccc1C(=O)C 62a_100000751169_100000188475 [0,2,0,0,0,0|1,1,0]=4 4103 B16R1.4440 CCOC(=O)CSc1ccccc1C(=O)N 62a_100000162227_100000188475 [0,2,0,0,0,0|0,1,0]=3 4104 B16R1.4440 CCOC(=O)CSc1ccccc1C(=O)N 62a_100000188475_100000162227 [0,2,0,0,0,0|0,1,0]=3 4105 B16R1.4440 CCOC(=O)CSc1ccccc1C(=O)O 62a_100000188475_100000734275 [0,2,0,0,0,0|1,1,0]=4 4106 B16R1.4440 CCOC(=O)CSc1ccccc1C(=O)O 62a_202125556159_100000188475 [0,2,0,0,0,0|1,1,0]=4 4107 B16R1.4440 CCOC(=O)CSc1cccnc1C(=O)N 62a_100000188475_200012359670 [0,2,0,0,0,0|1,1,0]=4 4108 B16R1.4440 CCOC(=O)CSc1cccnc1C(=O)N 62a_200012359670_100000188475 [0,2,0,0,0,0|1,1,0]=4 4109 B16R1.4440 CCOC(=O)CSc1ccncc1C(=O)N 62a_100000188475_100000697804 [0,2,0,0,0,0|1,1,0]=4 4110 B16R1.4440 CCOC(=O)CSc1ccncc1C(=O)N 62a_100000697804_100000188475 [0,2,0,0,0,0|1,1,0]=4 4111 B16R1.4440 CCOC(=O)CSc1cnccc1C(=O)N 62a_100000188475_100010205435 [0,2,0,0,0,0|1,1,0]=4 4112 B16R1.4440 CCOC(=O)CSc1cnccc1C(=O)N 62a_100010205435_100000188475 [0,2,0,0,0,0|1,1,0]=4 4113 B16R1.4440 CCOC(=O)CSc1ncccc1C(=O)N 62a_100000162199_100000188475 [0,2,0,0,0,0|1,1,0]=4 4114 B16R1.4440 CCOC(=O)CSc1ncccc1C(=O)N 62a_100000188475_100000162199 [0,2,0,0,0,0|1,1,0]=4 4115 B16R1.4440 COCC(O)COc1ccccc1C(=O)N 34a_100000192804_100011215053 [0,2,0,0,0,0|0,0,2]=4 4116 B16R1.4440 COCC(O)COc1ccccc1C(=O)N 7a_100000192804_100011215053 [0,2,0,0,0,0|0,0,2]=4 4117 B16R1.4440 C[C@@H](N)c1ccccc1OCC(=O)NCO 34a_100025703389_100000185155 [0,2,0,0,0,0|1,0,1]=4 4118 B16R1.4440 N#CCC(=O)COc1ccccc1C(=O)N 1458a_100000182327_100011214920 [0,2,0,0,0,0|1,0,0]=3 4119 B16R1.4440 N#CC[C@H](O)COc1ccccc1C(=O)N 7a_100000192804_100000001066 [0,2,0,0,0,0|1,0,1]=4 4120 B16R1.4440 NC(=O)c1ccccc1NCC(=O)NCO 34a_100000185089_100000185155 [0,2,0,0,0,0|1,0,0]=3 4121 B16R1.4440 NC(=O)c1ccccc1OCC(=O)CCF 1458a_100000182327_100011217306 [0,2,0,0,0,0|1,0,0]=3 4122 B16R1.4440 NC(=O)c1ccccc1OCC(=O)CCO 1458a_100000182327_100000211926 [0,2,0,0,0,0|0,0,0]=2 4123 B16R1.4440 NC(=O)c1ccccc1OCC(=O)NCO 34a_100000192804_100000185155 [0,2,0,0,0,0|0,0,0]=2 4124 B16R1.4440 NC(=O)c1ccccc1OCC(=O)NCO 7a_100000192804_100000185155 [0,2,0,0,0,0|0,0,0]=2 4125 B16R1.4440 NC(=O)c1ccccc1SCC(=O)NCO 62a_100000162227_100000185155 [0,2,0,0,0,0|0,1,0]=3 4126 B16R1.4440 NC(=O)c1ccccc1SCC(=O)NCO 62a_100000185155_100000162227 [0,2,0,0,0,0|0,1,0]=3 4127 B16R1.4440 NC(=O)c1cccnc1SCC(=O)NCO 62a_100000162199_100000185155 [0,2,0,0,0,0|1,1,0]=4 4128 B16R1.4440 NC(=O)c1cccnc1SCC(=O)NCO 62a_100000185155_100000162199 [0,2,0,0,0,0|1,1,0]=4 4129 B16R1.4440 NC(=O)c1ccncc1OCC(=O)NCO 7a_100012022987_100000185155 [0,2,0,0,0,0|1,0,0]=3 4130 B16R1.4440 NC(=O)c1ccncc1SCC(=O)NCO 62a_100000185155_100010205435 [0,2,0,0,0,0|1,1,0]=4 4131 B16R1.4440 NC(=O)c1ccncc1SCC(=O)NCO 62a_100010205435_100000185155 [0,2,0,0,0,0|1,1,0]=4 4132 B16R1.4440 NC(=O)c1cnccc1OCC(=O)NCO 34a_200011998761_100000185155 [0,2,0,0,0,0|1,0,0]=3 4133 B16R1.4440 NC(=O)c1cnccc1SCC(=O)NCO 62a_100000185155_100000697804 [0,2,0,0,0,0|1,1,0]=4 4134 B16R1.4440 NC(=O)c1cnccc1SCC(=O)NCO 62a_100000697804_100000185155 [0,2,0,0,0,0|1,1,0]=4 4135 B16R1.4440 NC(=O)c1ncccc1OCC(=O)NCO 34a_200011215183_100000185155 [0,2,0,0,0,0|1,0,0]=3 4136 B16R1.4440 NC(=O)c1ncccc1OCC(=O)NCO 7a_200011215183_100000185155 [0,2,0,0,0,0|1,0,0]=3 4137 B16R1.4440 NC(=O)c1ncccc1SCC(=O)NCO 62a_100000185155_200012359670 [0,2,0,0,0,0|1,1,0]=4 4138 B16R1.4440 NC(=O)c1ncccc1SCC(=O)NCO 62a_200012359670_100000185155 [0,2,0,0,0,0|1,1,0]=4 4139 B16R1.4440 NC(=O)c1nccnc1OCC(=O)NCO 34a_100011830332_100000185155 [0,2,0,0,0,0|2,0,0]=4 4140 B16R1.4440 NC(=S)c1ccccc1OCC(=O)NCO 7a_100000745089_100000185155 [0,2,0,0,0,0|0,1,0]=3 4141 B16R1.4440 O=C(CCO)COc1ccccc1[N+](=O)[O-] 1458a_100000182526_100000211926 [0,2,0,0,0,0|2,0,0]=4 4142 B16R1.4440 O=C(COc1ccccc1C(=O)[O-])NCO 7a_100015234032_100000185155 [0,2,0,0,0,0|1,0,0]=3 4143 B16R1.4440 O=C(COc1ccccc1[N+](=O)[O-])NCO 34a_100000186319_100000185155 [0,2,0,0,0,0|2,0,0]=4 4144 B16R1.4440 O=C(COc1ccccc1[N+](=O)[O-])NCO 7a_100000186319_100000185155 [0,2,0,0,0,0|2,0,0]=4 4145 B16R1.4440 O=C(CSc1ccccc1C(=O)O)NCO 62a_100000185155_100000734275 [0,2,0,0,0,0|1,1,0]=4 4146 B16R1.4440 O=C(CSc1ccccc1C(=O)O)NCO 62a_202125556159_100000185155 [0,2,0,0,0,0|1,1,0]=4 4147 B16R1.6958 CCC(=O)C(C)Oc1ccccc1C(=O)N 7a_100000192804_100000742827 [0,2,0,0,0,0|1,0,0]=3 4148 B16R1.6958 CCC(=O)C(C)Oc1ccccc1C(=O)[O-] 7a_100015234032_100000742827 [0,2,0,0,0,0|2,0,0]=4 4149 B16R1.6958 CCC(=O)C(C)Oc1ccccc1C(=S)N 7a_100000745089_100000742827 [0,2,0,0,0,0|1,1,0]=4 4150 B16R1.6958 CCC(=O)C(C)Oc1cccnc1C(=O)N 7a_200011215183_100000742827 [0,2,0,0,0,0|2,0,0]=4 4151 B16R1.6958 CCC(=O)C(C)Oc1cnccc1C(=O)N 7a_100012022987_100000742827 [0,2,0,0,0,0|2,0,0]=4 4152 B16R1.6958 CCC(=O)C(C)Sc1ccccc1C(=O)N 62a_100000162227_100000742827 [0,2,0,0,0,0|1,1,0]=4 4153 B16R1.6958 CCC(=O)C(C)Sc1ccccc1C(=O)N 62a_100000742827_100000162227 [0,2,0,0,0,0|1,1,0]=4 4154 B16R1.6958 CNC(=O)C(C)Nc1ccccc1C(=O)N 34a_100000185089_100000731044 [0,2,0,0,0,0|2,0,0]=4 4155 B16R1.6958 CNC(=O)C(C)Oc1ccccc1C(=O)N 34a_100000192804_100000731044 [0,2,0,0,0,0|1,0,0]=3 4156 B16R1.6958 CNC(=O)C(C)Oc1ccccc1C(=O)N 7a_100000192804_100000209862 [0,2,0,0,0,0|1,0,0]=3 4157 B16R1.6958 CNC(=O)C(C)Oc1ccccc1C(=O)[O-] 7a_100015234032_100000209862 [0,2,0,0,0,0|2,0,0]=4 4158 B16R1.6958 CNC(=O)C(C)Oc1ccccc1C(=S)N 7a_100000745089_100000209862 [0,2,0,0,0,0|1,1,0]=4 4159 B16R1.6958 CNC(=O)C(C)Oc1cccnc1C(=O)N 34a_200011215183_100000731044 [0,2,0,0,0,0|2,0,0]=4 4160 B16R1.6958 CNC(=O)C(C)Oc1cccnc1C(=O)N 7a_200011215183_100000209862 [0,2,0,0,0,0|2,0,0]=4 4161 B16R1.6958 CNC(=O)C(C)Oc1ccncc1C(=O)N 34a_200011998761_100000731044 [0,2,0,0,0,0|2,0,0]=4 4162 B16R1.6958 CNC(=O)C(C)Oc1cnccc1C(=O)N 7a_100012022987_100000209862 [0,2,0,0,0,0|2,0,0]=4 4163 B16R1.6958 CNC(=O)C(C)Sc1ccccc1C(=O)N 62a_100000162227_100000731044 [0,2,0,0,0,0|1,1,0]=4 4164 B16R1.6958 CNC(=O)C(C)Sc1ccccc1C(=O)N 62a_100000209862_100000162227 [0,2,0,0,0,0|1,1,0]=4 4165 B16R1.6958 CNC(=O)C(F)Nc1ccccc1C(=O)N 34a_100000185089_100009813575 [0,2,0,0,0,0|2,0,0]=4 4166 B16R1.6958 CNC(=O)C(F)Oc1ccccc1C(=O)N 34a_100000192804_100009813575 [0,2,0,0,0,0|1,0,0]=3 4167 B16R1.6958 CNC(=O)C(F)Oc1ccccc1C(=O)N 7a_100000192804_100009813575 [0,2,0,0,0,0|1,0,0]=3 4168 B16R1.6958 CNC(=O)C(F)Oc1ccccc1C(=O)[O-] 7a_100015234032_100009813575 [0,2,0,0,0,0|2,0,0]=4 4169 B16R1.6958 CNC(=O)C(F)Oc1ccccc1C(=S)N 7a_100000745089_100009813575 [0,2,0,0,0,0|1,1,0]=4 4170 B16R1.6958 CNC(=O)C(F)Oc1cccnc1C(=O)N 34a_200011215183_100009813575 [0,2,0,0,0,0|2,0,0]=4 4171 B16R1.6958 CNC(=O)C(F)Oc1cccnc1C(=O)N 7a_200011215183_100009813575 [0,2,0,0,0,0|2,0,0]=4 4172 B16R1.6958 CNC(=O)C(F)Oc1ccncc1C(=O)N 34a_200011998761_100009813575 [0,2,0,0,0,0|2,0,0]=4 4173 B16R1.6958 CNC(=O)C(F)Oc1cnccc1C(=O)N 7a_100012022987_100009813575 [0,2,0,0,0,0|2,0,0]=4 4174 B16R1.6958 CNC(=O)C(F)Sc1ccccc1C(=O)N 62a_100000162227_100009813575 [0,2,0,0,0,0|1,1,0]=4 4175 B16R1.6958 CNC(=O)C(F)Sc1ccccc1C(=O)N 62a_100009813575_100000162227 [0,2,0,0,0,0|1,1,0]=4 4176 B16R1.6958 COC(=O)C(=O)Nc1ccccc1C(=O)N 11a_100000185089_100000024059 [0,2,0,0,0,0|1,0,1]=4 4177 B16R1.6958 COC(=O)C(=O)Nc1ccccc1C(=O)N 1626a_100000185089_100000024059 [0,2,0,0,0,0|1,0,1]=4 4178 B16R1.6958 COC(=O)C(C)Nc1ccccc1C(=O)N 34a_100000185089_100000211248 [0,2,0,0,0,0|1,0,0]=3 4179 B16R1.6958 COC(=O)C(C)Oc1ccccc1C(=O)N 34a_100000192804_100000211248 [0,2,0,0,0,0|0,0,0]=2 4180 B16R1.6958 COC(=O)C(C)Oc1ccccc1C(=O)N 7a_100000192804_100000211248 [0,2,0,0,0,0|0,0,0]=2 4181 B16R1.6958 COC(=O)C(C)Oc1ccccc1C(=O)[O-] 7a_100015234032_100000211248 [0,2,0,0,0,0|1,0,0]=3 4182 B16R1.6958 COC(=O)C(C)Oc1ccccc1C(=S)N 7a_100000745089_100000211248 [0,2,0,0,0,0|0,1,0]=3 4183 B16R1.6958 COC(=O)C(C)Oc1ccccc1[C@@H](C)N 34a_100025703389_100000211248 [0,2,0,0,0,0|1,0,1]=4 4184 B16R1.6958 COC(=O)C(C)Oc1ccccc1[N+](=O)[O-] 34a_100000186319_100000211248 [0,2,0,0,0,0|2,0,0]=4 4185 B16R1.6958 COC(=O)C(C)Oc1ccccc1[N+](=O)[O-] 7a_100000186319_100000211248 [0,2,0,0,0,0|2,0,0]=4 4186 B16R1.6958 COC(=O)C(C)Oc1cccnc1C(=O)C 34a_100000087166_100000211248 [0,2,0,0,0,0|2,0,0]=4 4187 B16R1.6958 COC(=O)C(C)Oc1cccnc1C(=O)C 7a_100000087166_100000211248 [0,2,0,0,0,0|2,0,0]=4 4188 B16R1.6958 COC(=O)C(C)Oc1cccnc1C(=O)N 34a_200011215183_100000211248 [0,2,0,0,0,0|1,0,0]=3 4189 B16R1.6958 COC(=O)C(C)Oc1cccnc1C(=O)N 7a_200011215183_100000211248 [0,2,0,0,0,0|1,0,0]=3 4190 B16R1.6958 COC(=O)C(C)Oc1ccncc1C(=O)N 34a_200011998761_100000211248 [0,2,0,0,0,0|1,0,0]=3 4191 B16R1.6958 COC(=O)C(C)Oc1cnccc1C(=O)C 7a_100009872882_100000211248 [0,2,0,0,0,0|2,0,0]=4 4192 B16R1.6958 COC(=O)C(C)Oc1cnccc1C(=O)N 7a_100012022987_100000211248 [0,2,0,0,0,0|1,0,0]=3 4193 B16R1.6958 COC(=O)C(C)Oc1nccnc1C(=O)N 34a_100011830332_100000211248 [0,2,0,0,0,0|2,0,0]=4 4194 B16R1.6958 COC(=O)C(C)Sc1ccccc1C(=O)C 62a_100000751169_100000211248 [0,2,0,0,0,0|1,1,0]=4 4195 B16R1.6958 COC(=O)C(C)Sc1ccccc1C(=O)N 62a_100000162227_100000211248 [0,2,0,0,0,0|0,1,0]=3 4196 B16R1.6958 COC(=O)C(C)Sc1ccccc1C(=O)N 62a_100000211248_100000162227 [0,2,0,0,0,0|0,1,0]=3 4197 B16R1.6958 COC(=O)C(C)Sc1ccccc1C(=O)O 62a_100000211248_100000734275 [0,2,0,0,0,0|1,1,0]=4 4198 B16R1.6958 COC(=O)C(C)Sc1ccccc1C(=O)O 62a_202125556159_100000211248 [0,2,0,0,0,0|1,1,0]=4 4199 B16R1.6958 COC(=O)C(C)Sc1cccnc1C(=O)N 62a_100000211248_200012359670 [0,2,0,0,0,0|1,1,0]=4 4200 B16R1.6958 COC(=O)C(C)Sc1cccnc1C(=O)N 62a_200012359670_100000211248 [0,2,0,0,0,0|1,1,0]=4 4201 B16R1.6958 COC(=O)C(C)Sc1ccncc1C(=O)N 62a_100000211248_100000697804 [0,2,0,0,0,0|1,1,0]=4 4202 B16R1.6958 COC(=O)C(C)Sc1ccncc1C(=O)N 62a_100000697804_100000211248 [0,2,0,0,0,0|1,1,0]=4 4203 B16R1.6958 COC(=O)C(C)Sc1cnccc1C(=O)N 62a_100000211248_100010205435 [0,2,0,0,0,0|1,1,0]=4 4204 B16R1.6958 COC(=O)C(C)Sc1cnccc1C(=O)N 62a_100010205435_100000211248 [0,2,0,0,0,0|1,1,0]=4 4205 B16R1.6958 COC(=O)C(C)Sc1ncccc1C(=O)N 62a_100000162199_100000211248 [0,2,0,0,0,0|1,1,0]=4 4206 B16R1.6958 COC(=O)C(C)Sc1ncccc1C(=O)N 62a_100000211248_100000162199 [0,2,0,0,0,0|1,1,0]=4 4207 B16R1.14339 COC(COc1ccccc1C(=O)N)OC 34a_100000192804_100000211822 [0,2,0,0,0,0|0,0,2]=4 4208 B16R1.14339 COC(COc1ccccc1C(=O)N)OC 7a_100000192804_100000751394 [0,2,0,0,0,0|0,0,2]=4 4209 B16R1.16824 C=C(C#N)COc1cccc(c1C(=O)N)F 34a_100000701607_100000694840 [0,2,0,0,0,0|2,0,0]=4 4210 B16R1.16824 C=CC(O)COc1cccc(c1C(=O)N)F 34a_100000701607_100000730141 [0,2,0,0,0,0|1,0,1]=4 4211 B16R1.16824 C=CC(O)COc1cccc(c1C(=O)N)F 7a_100000701607_100000730141 [0,2,0,0,0,0|1,0,1]=4 4212 B16R1.16824 CCC(=O)CNc1cccc(c1C(=O)N)C 7a_100102558177_100000747405 [0,2,0,0,0,0|2,0,0]=4 4213 B16R1.16824 CCC(=O)CNc1cccc(c1C(=O)N)Cl 7a_100000764435_100000747405 [0,2,0,0,0,0|2,0,0]=4 4214 B16R1.16824 CCC(=O)CNc1cccc(c1C(=O)N)F 7a_100000036109_100000747405 [0,2,0,0,0,0|2,0,0]=4 4215 B16R1.16824 CCC(=O)COc1cccc(c1C(=O)C)Br 7a_100010174959_100000747405 [0,2,0,0,0,0|2,0,0]=4 4216 B16R1.16824 CCC(=O)COc1cccc(c1C(=O)C)C 7a_100009860897_100000747405 [0,2,0,0,0,0|2,0,0]=4 4217 B16R1.16824 CCC(=O)COc1cccc(c1C(=O)C)Cl 7a_100000730630_100000747405 [0,2,0,0,0,0|2,0,0]=4 4218 B16R1.16824 CCC(=O)COc1cccc(c1C(=O)C)F 7a_100011216272_100000747405 [0,2,0,0,0,0|2,0,0]=4 4219 B16R1.16824 CCC(=O)COc1cccc(c1C(=O)N)F 7a_100000701607_100000747405 [0,2,0,0,0,0|1,0,0]=3 4220 B16R1.16824 CCC(=O)CSc1cccc(c1C(=O)N)Cl 62a_100010147686_100000747405 [0,2,0,0,0,0|1,1,0]=4 4221 B16R1.16824 CCC(=O)CSc1cccc(c1C(=O)N)F 62a_100011219063_100000747405 [0,2,0,0,0,0|1,1,0]=4 4222 B16R1.16824 CCC(O)COc1cccc(c1C(=O)N)F 34a_100000701607_100011218378 [0,2,0,0,0,0|1,0,1]=4 4223 B16R1.16824 CCC(O)COc1cccc(c1C(=O)N)F 7a_100000701607_100011218378 [0,2,0,0,0,0|1,0,1]=4 4224 B16R1.16824 CNC(=O)CNc1cccc(c1C(=O)N)C 34a_100102558177_100000183359 [0,2,0,0,0,0|2,0,0]=4 4225 B16R1.16824 CNC(=O)CNc1cccc(c1C(=O)N)C 7a_100102558177_100000183359 [0,2,0,0,0,0|2,0,0]=4 4226 B16R1.16824 CNC(=O)CNc1cccc(c1C(=O)N)Cl 34a_100000764435_100000183359 [0,2,0,0,0,0|2,0,0]=4 4227 B16R1.16824 CNC(=O)CNc1cccc(c1C(=O)N)Cl 7a_100000764435_100000183359 [0,2,0,0,0,0|2,0,0]=4 4228 B16R1.16824 CNC(=O)CNc1cccc(c1C(=O)N)F 27a_100000693194_100011219063 [0,2,0,0,0,0|2,0,0]=4 4229 B16R1.16824 CNC(=O)CNc1cccc(c1C(=O)N)F 34a_100000036109_100000183359 [0,2,0,0,0,0|2,0,0]=4 4230 B16R1.16824 CNC(=O)CNc1cccc(c1C(=O)N)F 7a_100000036109_100000183359 [0,2,0,0,0,0|2,0,0]=4 4231 B16R1.16824 CNC(=O)COc1cccc(c1C(=O)C)Br 34a_100010174959_100000183359 [0,2,0,0,0,0|2,0,0]=4 4232 B16R1.16824 CNC(=O)COc1cccc(c1C(=O)C)Br 7a_100010174959_100000183359 [0,2,0,0,0,0|2,0,0]=4 4233 B16R1.16824 CNC(=O)COc1cccc(c1C(=O)C)C 34a_100009860897_100000183359 [0,2,0,0,0,0|2,0,0]=4 4234 B16R1.16824 CNC(=O)COc1cccc(c1C(=O)C)C 7a_100009860897_100000183359 [0,2,0,0,0,0|2,0,0]=4 4235 B16R1.16824 CNC(=O)COc1cccc(c1C(=O)C)Cl 34a_100000730630_100000183359 [0,2,0,0,0,0|2,0,0]=4 4236 B16R1.16824 CNC(=O)COc1cccc(c1C(=O)C)Cl 7a_100000730630_100000183359 [0,2,0,0,0,0|2,0,0]=4 4237 B16R1.16824 CNC(=O)COc1cccc(c1C(=O)C)F 34a_100011216272_100000183359 [0,2,0,0,0,0|2,0,0]=4 4238 B16R1.16824 CNC(=O)COc1cccc(c1C(=O)C)F 7a_100011216272_100000183359 [0,2,0,0,0,0|2,0,0]=4 4239 B16R1.16824 CNC(=O)COc1cccc(c1C(=O)N)F 34a_100000701607_100000183359 [0,2,0,0,0,0|1,0,0]=3 4240 B16R1.16824 CNC(=O)COc1cccc(c1C(=O)N)F 7a_100000701607_100000183359 [0,2,0,0,0,0|1,0,0]=3 4241 B16R1.16824 CNC(=O)CSc1cccc(c1C(=O)N)Cl 62a_100010147686_100000183359 [0,2,0,0,0,0|1,1,0]=4 4242 B16R1.16824 CNC(=O)CSc1cccc(c1C(=O)N)F 62a_100011219063_100000183359 [0,2,0,0,0,0|1,1,0]=4 4243 B16R1.16824 COC(=O)CNc1cccc(c1C(=O)N)C 34a_100102558177_100000747449 [0,2,0,0,0,0|1,0,0]=3 4244 B16R1.16824 COC(=O)CNc1cccc(c1C(=O)N)C 7a_100102558177_100000747449 [0,2,0,0,0,0|1,0,0]=3 4245 B16R1.16824 COC(=O)CNc1cccc(c1C(=O)N)Cl 34a_100000764435_100000747449 [0,2,0,0,0,0|1,0,0]=3 4246 B16R1.16824 COC(=O)CNc1cccc(c1C(=O)N)Cl 7a_100000764435_100000747449 [0,2,0,0,0,0|1,0,0]=3 4247 B16R1.16824 COC(=O)CNc1cccc(c1C(=O)N)F 34a_100000036109_100000747449 [0,2,0,0,0,0|1,0,0]=3 4248 B16R1.16824 COC(=O)CNc1cccc(c1C(=O)N)F 7a_100000036109_100000747449 [0,2,0,0,0,0|1,0,0]=3 4249 B16R1.16824 COC(=O)COc1cccc(c1C(=O)C)Br 34a_100010174959_100000747449 [0,2,0,0,0,0|1,0,0]=3 4250 B16R1.16824 COC(=O)COc1cccc(c1C(=O)C)Br 7a_100010174959_100000747449 [0,2,0,0,0,0|1,0,0]=3 4251 B16R1.16824 COC(=O)COc1cccc(c1C(=O)C)C 34a_100009860897_100000747449 [0,2,0,0,0,0|1,0,0]=3 4252 B16R1.16824 COC(=O)COc1cccc(c1C(=O)C)C 7a_100009860897_100000747449 [0,2,0,0,0,0|1,0,0]=3 4253 B16R1.16824 COC(=O)COc1cccc(c1C(=O)C)Cl 34a_100000730630_100000747449 [0,2,0,0,0,0|1,0,0]=3 4254 B16R1.16824 COC(=O)COc1cccc(c1C(=O)C)Cl 7a_100000730630_100000747449 [0,2,0,0,0,0|1,0,0]=3 4255 B16R1.16824 COC(=O)COc1cccc(c1C(=O)C)F 34a_100011216272_100000747449 [0,2,0,0,0,0|1,0,0]=3 4256 B16R1.16824 COC(=O)COc1cccc(c1C(=O)C)F 7a_100011216272_100000747449 [0,2,0,0,0,0|1,0,0]=3 4257 B16R1.16824 COC(=O)COc1cccc(c1C(=O)N)F 34a_100000701607_100000747449 [0,2,0,0,0,0|0,0,0]=2 4258 B16R1.16824 COC(=O)COc1cccc(c1C(=O)N)F 7a_100000701607_100000747449 [0,2,0,0,0,0|0,0,0]=2 4259 B16R1.16824 COC(=O)COc1cccc(c1[N+](=O)[O-])Br 34a_100011934925_100000747449 [0,2,0,0,0,0|2,0,0]=4 4260 B16R1.16824 COC(=O)COc1cccc(c1[N+](=O)[O-])Br 7a_100011934925_100000747449 [0,2,0,0,0,0|2,0,0]=4 4261 B16R1.16824 COC(=O)COc1cccc(c1[N+](=O)[O-])C 34a_100000740142_100000747449 [0,2,0,0,0,0|2,0,0]=4 4262 B16R1.16824 COC(=O)COc1cccc(c1[N+](=O)[O-])C 7a_100000740142_100000747449 [0,2,0,0,0,0|2,0,0]=4 4263 B16R1.16824 COC(=O)COc1cccc(c1[N+](=O)[O-])Cl 34a_100011999376_100000747449 [0,2,0,0,0,0|2,0,0]=4 4264 B16R1.16824 COC(=O)COc1cccc(c1[N+](=O)[O-])Cl 7a_100011999376_100000747449 [0,2,0,0,0,0|2,0,0]=4 4265 B16R1.16824 COC(=O)COc1cccc(c1[N+](=O)[O-])F 34a_100011217962_100000747449 [0,2,0,0,0,0|2,0,0]=4 4266 B16R1.16824 COC(=O)COc1cccc(c1[N+](=O)[O-])F 7a_100011217962_100000747449 [0,2,0,0,0,0|2,0,0]=4 4267 B16R1.16824 COC(=O)COc1cccc(c1[N+](=O)[O-])I 7a_100010150324_100000747449 [0,2,0,0,0,0|2,0,0]=4 4268 B16R1.16824 COC(=O)CSc1cccc(c1C(=O)C)F 62a_100012351873_100000747449 [0,2,0,0,0,0|1,1,0]=4 4269 B16R1.16824 COC(=O)CSc1cccc(c1C(=O)N)Cl 62a_100010147686_100000747449 [0,2,0,0,0,0|0,1,0]=3 4270 B16R1.16824 COC(=O)CSc1cccc(c1C(=O)N)F 62a_100011219063_100000747449 [0,2,0,0,0,0|0,1,0]=3 4271 B16R1.16824 COC(=O)CSc1cncc(c1C(=O)N)F 62a_100000747449_100010271514 [0,2,0,0,0,0|1,1,0]=4 4272 B16R1.16824 COC(=O)CSc1cncc(c1C(=O)N)F 62a_100010271514_100000747449 [0,2,0,0,0,0|1,1,0]=4 4273 B16R1.16824 C[C@@H](CO)COc1cccc(c1C(=O)N)F 34a_100000701607_100000059175 [0,2,0,0,0,0|1,0,1]=4 4274 B16R1.16824 C[C@@H](CO)COc1cccc(c1C(=O)N)F 7a_100000701607_100000059175 [0,2,0,0,0,0|1,0,1]=4 4275 B16R1.16824 NC(=O)c1c(cccc1OCC(O)CO)F 34a_100000701607_100011219619 [0,2,0,0,0,0|0,0,2]=4 4276 B16R1.16824 NC(=O)c1c(cccc1OCC(O)CO)F 7a_100000701607_100011219619 [0,2,0,0,0,0|0,0,2]=4 4277 B16R1.16824 NC(=O)c1c(cccc1OC[C@@H](O)CF)F 34a_100000701607_100015614560 [0,2,0,0,0,0|1,0,1]=4 4278 B16R1.16824 NC(=O)c1c(cccc1OC[C@@H](O)CF)F 7a_100000701607_100015614560 [0,2,0,0,0,0|1,0,1]=4 4279 B16R1.16824 NC(=O)c1c(cccc1OC[C@@H](O)CO)F 34a_100000701607_100009815848 [0,2,0,0,0,0|0,0,2]=4 4280 B16R1.16824 NC(=O)c1c(cccc1OC[C@@H](O)CO)F 7a_100000701607_100009815848 [0,2,0,0,0,0|0,0,2]=4 4281 B16R1.18406 C=C(C#N)COc1c(cccc1C(=O)N)Cl 34a_100009868166_100000694840 [0,2,0,0,0,0|2,0,0]=4 4282 B16R1.18406 C=C(C#N)COc1c(cccc1C(=O)N)F 34a_100009886295_100000694840 [0,2,0,0,0,0|2,0,0]=4 4283 B16R1.18406 C=CC(O)COc1c(cccc1C(=O)N)Cl 34a_100009868166_100000730141 [0,2,0,0,0,0|1,0,1]=4 4284 B16R1.18406 C=CC(O)COc1c(cccc1C(=O)N)Cl 7a_100009868166_100000730141 [0,2,0,0,0,0|1,0,1]=4 4285 B16R1.18406 C=CC(O)COc1c(cccc1C(=O)N)F 34a_100009886295_100000730141 [0,2,0,0,0,0|1,0,1]=4 4286 B16R1.18406 C=CC(O)COc1c(cccc1C(=O)N)F 7a_100009886295_100000730141 [0,2,0,0,0,0|1,0,1]=4 4287 B16R1.18406 CCC(=O)COc1c(cccc1C(=O)C)C 7a_100009847209_100000747405 [0,2,0,0,0,0|2,0,0]=4 4288 B16R1.18406 CCC(=O)COc1c(cccc1C(=O)C)Cl 7a_100000043392_100000747405 [0,2,0,0,0,0|2,0,0]=4 4289 B16R1.18406 CCC(=O)COc1c(cccc1C(=O)C)F 7a_100011246037_100000747405 [0,2,0,0,0,0|2,0,0]=4 4290 B16R1.18406 CCC(=O)COc1c(cccc1C(=O)N)Cl 7a_100009868166_100000747405 [0,2,0,0,0,0|1,0,0]=3 4291 B16R1.18406 CCC(=O)COc1c(cccc1C(=O)N)F 7a_100009886295_100000747405 [0,2,0,0,0,0|1,0,0]=3 4292 B16R1.18406 CCC(=O)CSc1c(cccc1C(=O)N)C 62a_100000747405_200011409216 [0,2,0,0,0,0|1,1,0]=4 4293 B16R1.18406 CCC(=O)CSc1c(cccc1C(=O)N)C 62a_200011409216_100000747405 [0,2,0,0,0,0|1,1,0]=4 4294 B16R1.18406 CCC(=O)CSc1c(cccc1C(=O)N)F 62a_100000747405_200012351544 [0,2,0,0,0,0|1,1,0]=4 4295 B16R1.18406 CCC(=O)CSc1c(cccc1C(=O)N)F 62a_200012351544_100000747405 [0,2,0,0,0,0|1,1,0]=4 4296 B16R1.18406 CCC(O)COc1c(cccc1C(=O)N)Cl 34a_100009868166_100011218378 [0,2,0,0,0,0|1,0,1]=4 4297 B16R1.18406 CCC(O)COc1c(cccc1C(=O)N)Cl 7a_100009868166_100011218378 [0,2,0,0,0,0|1,0,1]=4 4298 B16R1.18406 CCC(O)COc1c(cccc1C(=O)N)F 34a_100009886295_100011218378 [0,2,0,0,0,0|1,0,1]=4 4299 B16R1.18406 CCC(O)COc1c(cccc1C(=O)N)F 7a_100009886295_100011218378 [0,2,0,0,0,0|1,0,1]=4 4300 B16R1.18406 CNC(=O)CNc1c(cccc1C(=O)N)C 34a_100000223273_100000183359 [0,2,0,0,0,0|2,0,0]=4 4301 B16R1.18406 CNC(=O)CNc1c(cccc1C(=O)N)Cl 34a_200011997947_100000183359 [0,2,0,0,0,0|2,0,0]=4 4302 B16R1.18406 CNC(=O)CNc1c(cccc1C(=O)N)F 34a_100011722151_100000183359 [0,2,0,0,0,0|2,0,0]=4 4303 B16R1.18406 CNC(=O)COc1c(cccc1C(=O)C)C 34a_100009847209_100000183359 [0,2,0,0,0,0|2,0,0]=4 4304 B16R1.18406 CNC(=O)COc1c(cccc1C(=O)C)C 7a_100009847209_100000183359 [0,2,0,0,0,0|2,0,0]=4 4305 B16R1.18406 CNC(=O)COc1c(cccc1C(=O)C)Cl 34a_100000043392_100000183359 [0,2,0,0,0,0|2,0,0]=4 4306 B16R1.18406 CNC(=O)COc1c(cccc1C(=O)C)Cl 7a_100000043392_100000183359 [0,2,0,0,0,0|2,0,0]=4 4307 B16R1.18406 CNC(=O)COc1c(cccc1C(=O)C)F 34a_100011246037_100000183359 [0,2,0,0,0,0|2,0,0]=4 4308 B16R1.18406 CNC(=O)COc1c(cccc1C(=O)C)F 7a_100011246037_100000183359 [0,2,0,0,0,0|2,0,0]=4 4309 B16R1.18406 CNC(=O)COc1c(cccc1C(=O)N)Cl 34a_100009868166_100000183359 [0,2,0,0,0,0|1,0,0]=3 4310 B16R1.18406 CNC(=O)COc1c(cccc1C(=O)N)Cl 7a_100009868166_100000183359 [0,2,0,0,0,0|1,0,0]=3 4311 B16R1.18406 CNC(=O)COc1c(cccc1C(=O)N)F 34a_100009886295_100000183359 [0,2,0,0,0,0|1,0,0]=3 4312 B16R1.18406 CNC(=O)COc1c(cccc1C(=O)N)F 7a_100009886295_100000183359 [0,2,0,0,0,0|1,0,0]=3 4313 B16R1.18406 CNC(=O)CSc1c(cccc1C(=O)N)C 62a_100000183359_200011409216 [0,2,0,0,0,0|1,1,0]=4 4314 B16R1.18406 CNC(=O)CSc1c(cccc1C(=O)N)C 62a_200011409216_100000183359 [0,2,0,0,0,0|1,1,0]=4 4315 B16R1.18406 CNC(=O)CSc1c(cccc1C(=O)N)F 62a_100000183359_200012351544 [0,2,0,0,0,0|1,1,0]=4 4316 B16R1.18406 CNC(=O)CSc1c(cccc1C(=O)N)F 62a_200012351544_100000183359 [0,2,0,0,0,0|1,1,0]=4 4317 B16R1.18406 COC(=O)CNc1c(cccc1C(=O)N)C 34a_100000223273_100000747449 [0,2,0,0,0,0|1,0,0]=3 4318 B16R1.18406 COC(=O)CNc1c(cccc1C(=O)N)Cl 34a_200011997947_100000747449 [0,2,0,0,0,0|1,0,0]=3 4319 B16R1.18406 COC(=O)CNc1c(cccc1C(=O)N)F 34a_100011722151_100000747449 [0,2,0,0,0,0|1,0,0]=3 4320 B16R1.18406 COC(=O)COc1c(cccc1C(=O)C)C 34a_100009847209_100000747449 [0,2,0,0,0,0|1,0,0]=3 4321 B16R1.18406 COC(=O)COc1c(cccc1C(=O)C)C 7a_100009847209_100000747449 [0,2,0,0,0,0|1,0,0]=3 4322 B16R1.18406 COC(=O)COc1c(cccc1C(=O)C)Cl 34a_100000043392_100000747449 [0,2,0,0,0,0|1,0,0]=3 4323 B16R1.18406 COC(=O)COc1c(cccc1C(=O)C)Cl 7a_100000043392_100000747449 [0,2,0,0,0,0|1,0,0]=3 4324 B16R1.18406 COC(=O)COc1c(cccc1C(=O)C)F 34a_100011246037_100000747449 [0,2,0,0,0,0|1,0,0]=3 4325 B16R1.18406 COC(=O)COc1c(cccc1C(=O)C)F 7a_100011246037_100000747449 [0,2,0,0,0,0|1,0,0]=3 4326 B16R1.18406 COC(=O)COc1c(cccc1C(=O)N)Cl 34a_100009868166_100000747449 [0,2,0,0,0,0|0,0,0]=2 4327 B16R1.18406 COC(=O)COc1c(cccc1C(=O)N)Cl 7a_100009868166_100000747449 [0,2,0,0,0,0|0,0,0]=2 4328 B16R1.18406 COC(=O)COc1c(cccc1C(=O)N)F 34a_100009886295_100000747449 [0,2,0,0,0,0|0,0,0]=2 4329 B16R1.18406 COC(=O)COc1c(cccc1C(=O)N)F 7a_100009886295_100000747449 [0,2,0,0,0,0|0,0,0]=2 4330 B16R1.18406 COC(=O)COc1c(cccc1[N+](=O)[O-])Br 34a_100000689966_100000747449 [0,2,0,0,0,0|2,0,0]=4 4331 B16R1.18406 COC(=O)COc1c(cccc1[N+](=O)[O-])C 34a_100000763257_100000747449 [0,2,0,0,0,0|2,0,0]=4 4332 B16R1.18406 COC(=O)COc1c(cccc1[N+](=O)[O-])C 7a_100000763257_100000747449 [0,2,0,0,0,0|2,0,0]=4 4333 B16R1.18406 COC(=O)COc1c(cccc1[N+](=O)[O-])Cl 34a_100000686934_100000747449 [0,2,0,0,0,0|2,0,0]=4 4334 B16R1.18406 COC(=O)COc1c(cccc1[N+](=O)[O-])Cl 7a_100000686934_100000747449 [0,2,0,0,0,0|2,0,0]=4 4335 B16R1.18406 COC(=O)COc1c(cccc1[N+](=O)[O-])F 34a_100000690172_100000747449 [0,2,0,0,0,0|2,0,0]=4 4336 B16R1.18406 COC(=O)CSc1c(cccc1C(=O)C)F 62a_100000747449_100012362612 [0,2,0,0,0,0|1,1,0]=4 4337 B16R1.18406 COC(=O)CSc1c(cccc1C(=O)C)F 62a_100012362612_100000747449 [0,2,0,0,0,0|1,1,0]=4 4338 B16R1.18406 COC(=O)CSc1c(cccc1C(=O)N)C 62a_100000747449_200011409216 [0,2,0,0,0,0|0,1,0]=3 4339 B16R1.18406 COC(=O)CSc1c(cccc1C(=O)N)C 62a_200011409216_100000747449 [0,2,0,0,0,0|0,1,0]=3 4340 B16R1.18406 COC(=O)CSc1c(cccc1C(=O)N)F 62a_100000747449_200012351544 [0,2,0,0,0,0|0,1,0]=3 4341 B16R1.18406 COC(=O)CSc1c(cccc1C(=O)N)F 62a_200012351544_100000747449 [0,2,0,0,0,0|0,1,0]=3 4342 B16R1.18406 C[C@@H](CO)COc1c(cccc1C(=O)N)Cl 34a_100009868166_100000059175 [0,2,0,0,0,0|1,0,1]=4 4343 B16R1.18406 C[C@@H](CO)COc1c(cccc1C(=O)N)Cl 7a_100009868166_100000059175 [0,2,0,0,0,0|1,0,1]=4 4344 B16R1.18406 C[C@@H](CO)COc1c(cccc1C(=O)N)F 34a_100009886295_100000059175 [0,2,0,0,0,0|1,0,1]=4 4345 B16R1.18406 C[C@@H](CO)COc1c(cccc1C(=O)N)F 7a_100009886295_100000059175 [0,2,0,0,0,0|1,0,1]=4 4346 B16R1.18406 NC(=O)c1cccc(c1OCC(O)CO)Cl 34a_100009868166_100011219619 [0,2,0,0,0,0|0,0,2]=4 4347 B16R1.18406 NC(=O)c1cccc(c1OCC(O)CO)Cl 7a_100009868166_100011219619 [0,2,0,0,0,0|0,0,2]=4 4348 B16R1.18406 NC(=O)c1cccc(c1OCC(O)CO)F 34a_100009886295_100011219619 [0,2,0,0,0,0|0,0,2]=4 4349 B16R1.18406 NC(=O)c1cccc(c1OCC(O)CO)F 7a_100009886295_100011219619 [0,2,0,0,0,0|0,0,2]=4 4350 B16R1.18406 NC(=O)c1cccc(c1OC[C@@H](O)CF)Cl 34a_100009868166_100015614560 [0,2,0,0,0,0|1,0,1]=4 4351 B16R1.18406 NC(=O)c1cccc(c1OC[C@@H](O)CF)Cl 7a_100009868166_100015614560 [0,2,0,0,0,0|1,0,1]=4 4352 B16R1.18406 NC(=O)c1cccc(c1OC[C@@H](O)CF)F 34a_100009886295_100015614560 [0,2,0,0,0,0|1,0,1]=4 4353 B16R1.18406 NC(=O)c1cccc(c1OC[C@@H](O)CF)F 7a_100009886295_100015614560 [0,2,0,0,0,0|1,0,1]=4 4354 B16R1.18406 NC(=O)c1cccc(c1OC[C@@H](O)CO)Cl 34a_100009868166_100009815848 [0,2,0,0,0,0|0,0,2]=4 4355 B16R1.18406 NC(=O)c1cccc(c1OC[C@@H](O)CO)Cl 7a_100009868166_100009815848 [0,2,0,0,0,0|0,0,2]=4 4356 B16R1.18406 NC(=O)c1cccc(c1OC[C@@H](O)CO)F 34a_100009886295_100009815848 [0,2,0,0,0,0|0,0,2]=4 4357 B16R1.18406 NC(=O)c1cccc(c1OC[C@@H](O)CO)F 7a_100009886295_100009815848 [0,2,0,0,0,0|0,0,2]=4 4358 B16R1.3147 CCN(CC(=O)N)c1ccccc1C(=O)N 2230a_100000020997_100000210202 [0,2,0,0,0,0|2,0,0]=4 4359 B16R1.11220 CN(CC(=O)N)c1cccc(c1C(=O)N)F 27a_100000739694_100011219063 [0,2,0,0,0,0|2,0,0]=4 4360 B16R1.11392 CN(CC(=O)N)c1cc(ccc1C(=O)N)Br 27a_100000739694_100009815748 [0,2,0,0,0,0|2,0,0]=4 4361 B16R1.11392 CN(CC(=O)N)c1cc(ccc1C(=O)N)F 27a_100000739694_100000206404 [0,2,0,0,0,0|2,0,0]=4 4362 B16R1.11452 CN(CC(=O)N)c1ccc(cc1C(=O)N)Br 269982a_200010114593_100000187820 [0,2,0,0,0,0|2,0,0]=4 4363 B16R1.11452 CN(CC(=O)N)c1ccc(cc1C(=O)N)Br 27a_100000739694_200000162314 [0,2,0,0,0,0|2,0,0]=4 4364 B16R1.11452 CN(CC(=O)N)c1ccc(cc1C(=O)N)Br 34a_200010114593_100000187820 [0,2,0,0,0,0|2,0,0]=4 4365 B16R1.11452 CN(CC(=O)[O-])c1ccc(cc1C(=O)N)Br 269982a_200010114593_100020667443 [0,2,0,0,0,0|1,0,1]=4 4366 B16R1.11452 CN(CC(=O)[O-])c1ccc(cc1C(=O)N)Br 34a_200010114593_100020667443 [0,2,0,0,0,0|1,0,1]=4 4367 B16R1.12215 CC(=O)C(C)N(C)c1ccccc1C(=O)N 269982a_100000184419_100009814033 [0,2,0,0,0,0|2,0,0]=4 4368 B16R1.12215 CC(C(=O)N)N(C)c1ccccc1C(=O)N 269982a_100000184419_100000184083 [0,2,0,0,0,0|2,0,0]=4 4369 B16R1.12215 CN(c1ccccc1C(=O)N)C(F)C(=O)N 269982a_100000184419_100009813875 [0,2,0,0,0,0|2,0,0]=4 4370 B16R1.11204 CC(=O)C(C)Oc1c(cccc1C(=O)N)Cl 7a_100009868166_100000179758 [0,2,0,0,0,0|1,0,0]=3 4371 B16R1.11204 CC(=O)C(C)Oc1c(cccc1C(=O)N)F 7a_100009886295_100000179758 [0,2,0,0,0,0|1,0,0]=3 4372 B16R1.11204 CC(=O)C(C)Sc1c(cccc1C(=O)N)C 62a_100009814033_200011409216 [0,2,0,0,0,0|1,1,0]=4 4373 B16R1.11204 CC(=O)C(C)Sc1c(cccc1C(=O)N)C 62a_200011409216_100009814033 [0,2,0,0,0,0|1,1,0]=4 4374 B16R1.11204 CC(=O)C(C)Sc1c(cccc1C(=O)N)F 62a_100009814033_200012351544 [0,2,0,0,0,0|1,1,0]=4 4375 B16R1.11204 CC(=O)C(C)Sc1c(cccc1C(=O)N)F 62a_200012351544_100009814033 [0,2,0,0,0,0|1,1,0]=4 4376 B16R1.11204 CC(=O)c1cccc(c1OC(C)C(=O)C)C 7a_100009847209_100000179758 [0,2,0,0,0,0|2,0,0]=4 4377 B16R1.11204 CC(=O)c1cccc(c1OC(C)C(=O)C)Cl 7a_100000043392_100000179758 [0,2,0,0,0,0|2,0,0]=4 4378 B16R1.11204 CC(=O)c1cccc(c1OC(C)C(=O)C)F 7a_100011246037_100000179758 [0,2,0,0,0,0|2,0,0]=4 4379 B16R1.11204 CC(=O)c1cccc(c1OC(C)C(=O)N)C 34a_100009847209_100000702099 [0,2,0,0,0,0|2,0,0]=4 4380 B16R1.11204 CC(=O)c1cccc(c1OC(C)C(=O)N)C 7a_100009847209_100000702099 [0,2,0,0,0,0|2,0,0]=4 4381 B16R1.11204 CC(=O)c1cccc(c1OC(C)C(=O)N)Cl 34a_100000043392_100000702099 [0,2,0,0,0,0|2,0,0]=4 4382 B16R1.11204 CC(=O)c1cccc(c1OC(C)C(=O)N)Cl 7a_100000043392_100000702099 [0,2,0,0,0,0|2,0,0]=4 4383 B16R1.11204 CC(=O)c1cccc(c1OC(C)C(=O)N)F 34a_100011246037_100000702099 [0,2,0,0,0,0|2,0,0]=4 4384 B16R1.11204 CC(=O)c1cccc(c1OC(C)C(=O)N)F 7a_100011246037_100000702099 [0,2,0,0,0,0|2,0,0]=4 4385 B16R1.11204 CC(=O)c1cccc(c1OC(F)C(=O)N)C 34a_100009847209_100009813875 [0,2,0,0,0,0|2,0,0]=4 4386 B16R1.11204 CC(=O)c1cccc(c1OC(F)C(=O)N)C 7a_100009847209_100009813875 [0,2,0,0,0,0|2,0,0]=4 4387 B16R1.11204 CC(=O)c1cccc(c1OC(F)C(=O)N)Cl 34a_100000043392_100009813875 [0,2,0,0,0,0|2,0,0]=4 4388 B16R1.11204 CC(=O)c1cccc(c1OC(F)C(=O)N)Cl 7a_100000043392_100009813875 [0,2,0,0,0,0|2,0,0]=4 4389 B16R1.11204 CC(=O)c1cccc(c1OC(F)C(=O)N)F 34a_100011246037_100009813875 [0,2,0,0,0,0|2,0,0]=4 4390 B16R1.11204 CC(=O)c1cccc(c1OC(F)C(=O)N)F 7a_100011246037_100009813875 [0,2,0,0,0,0|2,0,0]=4 4391 B16R1.11204 CC(=O)c1cccc(c1OC(F)C(=O)[O-])C 34a_100009847209_100020610796 [0,2,0,0,0,0|1,0,1]=4 4392 B16R1.11204 CC(=O)c1cccc(c1OC(F)C(=O)[O-])Cl 34a_100000043392_100020610796 [0,2,0,0,0,0|1,0,1]=4 4393 B16R1.11204 CC(=O)c1cccc(c1OC(F)C(=O)[O-])F 34a_100011246037_100020610796 [0,2,0,0,0,0|1,0,1]=4 4394 B16R1.11204 CC(Nc1c(cccc1C(=O)N)Cl)C(=O)N 34a_200011997947_100000702099 [0,2,0,0,0,0|2,0,0]=4 4395 B16R1.11204 CC(Nc1c(cccc1C(=O)N)F)C(=O)N 34a_100011722151_100000702099 [0,2,0,0,0,0|2,0,0]=4 4396 B16R1.11204 CC(Oc1c(cccc1C(=O)N)Cl)C(=O)N 34a_100009868166_100000702099 [0,2,0,0,0,0|1,0,0]=3 4397 B16R1.11204 CC(Oc1c(cccc1C(=O)N)Cl)C(=O)N 7a_100009868166_100000702099 [0,2,0,0,0,0|1,0,0]=3 4398 B16R1.11204 CC(Oc1c(cccc1C(=O)N)F)C(=O)N 34a_100009886295_100000702099 [0,2,0,0,0,0|1,0,0]=3 4399 B16R1.11204 CC(Oc1c(cccc1C(=O)N)F)C(=O)N 7a_100009886295_100000702099 [0,2,0,0,0,0|1,0,0]=3 4400 B16R1.11204 CC(Sc1c(cccc1C(=O)N)F)C(=O)N 62a_100000702099_200012351544 [0,2,0,0,0,0|1,1,0]=4 4401 B16R1.11204 CC(Sc1c(cccc1C(=O)N)F)C(=O)N 62a_200012351544_100000702099 [0,2,0,0,0,0|1,1,0]=4 4402 B16R1.11204 Cc1cccc(c1NC(C)C(=O)N)C(=O)N 34a_100000223273_100000702099 [0,2,0,0,0,0|2,0,0]=4 4403 B16R1.11204 Cc1cccc(c1NC(F)C(=O)N)C(=O)N 34a_100000223273_100009813875 [0,2,0,0,0,0|2,0,0]=4 4404 B16R1.11204 Cc1cccc(c1NC(F)C(=O)[O-])C(=O)N 34a_100000223273_100020610796 [0,2,0,0,0,0|1,0,1]=4 4405 B16R1.11204 Cc1cccc(c1SC(C)C(=O)N)C(=O)N 62a_100000702099_200011409216 [0,2,0,0,0,0|1,1,0]=4 4406 B16R1.11204 Cc1cccc(c1SC(C)C(=O)N)C(=O)N 62a_200011409216_100000702099 [0,2,0,0,0,0|1,1,0]=4 4407 B16R1.11204 Cc1cccc(c1SC(F)C(=O)N)C(=O)N 62a_100009813875_200011409216 [0,2,0,0,0,0|1,1,0]=4 4408 B16R1.11204 Cc1cccc(c1SC(F)C(=O)N)C(=O)N 62a_200011409216_100009813875 [0,2,0,0,0,0|1,1,0]=4 4409 B16R1.11204 Cc1cccc(c1SC(F)C(=O)[O-])C(=O)N 62a_100020610796_200011409216 [0,2,0,0,0,0|0,1,1]=4 4410 B16R1.11204 Cc1cccc(c1SC(F)C(=O)[O-])C(=O)N 62a_200011409216_100020610796 [0,2,0,0,0,0|0,1,1]=4 4411 B16R1.11204 NC(=O)c1cccc(c1NC(F)C(=O)N)Cl 34a_200011997947_100009813875 [0,2,0,0,0,0|2,0,0]=4 4412 B16R1.11204 NC(=O)c1cccc(c1NC(F)C(=O)N)F 34a_100011722151_100009813875 [0,2,0,0,0,0|2,0,0]=4 4413 B16R1.11204 NC(=O)c1cccc(c1NC(F)C(=O)[O-])Cl 34a_200011997947_100020610796 [0,2,0,0,0,0|1,0,1]=4 4414 B16R1.11204 NC(=O)c1cccc(c1NC(F)C(=O)[O-])F 34a_100011722151_100020610796 [0,2,0,0,0,0|1,0,1]=4 4415 B16R1.11204 NC(=O)c1cccc(c1OC(F)C(=O)N)Cl 34a_100009868166_100009813875 [0,2,0,0,0,0|1,0,0]=3 4416 B16R1.11204 NC(=O)c1cccc(c1OC(F)C(=O)N)Cl 7a_100009868166_100009813875 [0,2,0,0,0,0|1,0,0]=3 4417 B16R1.11204 NC(=O)c1cccc(c1OC(F)C(=O)N)F 34a_100009886295_100009813875 [0,2,0,0,0,0|1,0,0]=3 4418 B16R1.11204 NC(=O)c1cccc(c1OC(F)C(=O)N)F 7a_100009886295_100009813875 [0,2,0,0,0,0|1,0,0]=3 4419 B16R1.11204 NC(=O)c1cccc(c1OC(F)C(=O)[O-])Cl 34a_100009868166_100020610796 [0,2,0,0,0,0|0,0,1]=3 4420 B16R1.11204 NC(=O)c1cccc(c1OC(F)C(=O)[O-])F 34a_100009886295_100020610796 [0,2,0,0,0,0|0,0,1]=3 4421 B16R1.11204 NC(=O)c1cccc(c1SC(F)C(=O)N)F 62a_100009813875_200012351544 [0,2,0,0,0,0|1,1,0]=4 4422 B16R1.11204 NC(=O)c1cccc(c1SC(F)C(=O)N)F 62a_200012351544_100009813875 [0,2,0,0,0,0|1,1,0]=4 4423 B16R1.11204 NC(=O)c1cccc(c1SC(F)C(=O)[O-])F 62a_100020610796_200012351544 [0,2,0,0,0,0|0,1,1]=4 4424 B16R1.11204 NC(=O)c1cccc(c1SC(F)C(=O)[O-])F 62a_200012351544_100020610796 [0,2,0,0,0,0|0,1,1]=4 4425 B16R1.23825 C=C(C)COc1c(cc(cc1C(=O)N)Br)Br 34a_200009812496_100000748629 [0,2,0,0,0,0|2,0,0]=4 4426 B16R1.23825 C=C(C)COc1c(cc(cc1C(=O)N)Br)Br 7a_200009812496_100000748629 [0,2,0,0,0,0|2,0,0]=4 4427 B16R1.23825 C=C(C)COc1c(cc(cc1C(=O)N)F)I 34a_200135271384_100000748629 [0,2,0,0,0,0|2,0,0]=4 4428 B16R1.23825 C=C(C)COc1c(cc(cc1C(=O)N)F)I 7a_200135271384_100000748629 [0,2,0,0,0,0|2,0,0]=4 4429 B16R1.23825 C=C(F)COc1c(cc(cc1C(=O)N)Br)Br 34a_200009812496_100009893438 [0,2,0,0,0,0|2,0,0]=4 4430 B16R1.23825 C=C(F)COc1c(cc(cc1C(=O)N)Br)Br 7a_200009812496_100000042424 [0,2,0,0,0,0|2,0,0]=4 4431 B16R1.23825 C=C(F)COc1c(cc(cc1C(=O)N)F)I 34a_200135271384_100009893438 [0,2,0,0,0,0|2,0,0]=4 4432 B16R1.23825 C=C(F)COc1c(cc(cc1C(=O)N)F)I 7a_200135271384_100000042424 [0,2,0,0,0,0|2,0,0]=4 4433 B16R1.23825 CC(=O)c1cc(cc(c1OCC(=O)N)Br)Br 7a_100000212130_100000187820 [0,2,0,0,0,0|2,0,0]=4 4434 B16R1.23825 CC(=O)c1cc(cc(c1OCC(=O)N)Br)C 7a_100011659362_100000187820 [0,2,0,0,0,0|2,0,0]=4 4435 B16R1.23825 CC(=O)c1cc(cc(c1OCC(=O)N)Br)Cl 7a_100011218835_100000187820 [0,2,0,0,0,0|2,0,0]=4 4436 B16R1.23825 CC(=O)c1cc(cc(c1OCC(=O)N)C)C 34a_100000188341_100000187820 [0,2,0,0,0,0|2,0,0]=4 4437 B16R1.23825 CC(=O)c1cc(cc(c1OCC(=O)N)C)C 7a_100000188341_100000187820 [0,2,0,0,0,0|2,0,0]=4 4438 B16R1.23825 CC(=O)c1cc(cc(c1OCC(=O)N)Cl)C 34a_100010659243_100000187820 [0,2,0,0,0,0|2,0,0]=4 4439 B16R1.23825 CC(=O)c1cc(cc(c1OCC(=O)N)Cl)C 7a_100010659243_100000187820 [0,2,0,0,0,0|2,0,0]=4 4440 B16R1.23825 CC(=O)c1cc(cc(c1OCC(=O)N)Cl)Cl 7a_100000182809_100000187820 [0,2,0,0,0,0|2,0,0]=4 4441 B16R1.23825 CC(=O)c1cc(cc(c1OCC(=O)N)Cl)F 34a_100011659368_100000187820 [0,2,0,0,0,0|2,0,0]=4 4442 B16R1.23825 CC(=O)c1cc(cc(c1OCC(=O)N)Cl)F 7a_100011659368_100000187820 [0,2,0,0,0,0|2,0,0]=4 4443 B16R1.23825 CC(=O)c1cc(cc(c1OCC(=O)N)F)F 34a_100000751779_100000187820 [0,2,0,0,0,0|2,0,0]=4 4444 B16R1.23825 CC(=O)c1cc(cc(c1OCC(=O)N)F)F 7a_100000751779_100000187820 [0,2,0,0,0,0|2,0,0]=4 4445 B16R1.23825 CC(=O)c1cc(cc(c1OCC(=O)[O-])C)C 34a_100000188341_100020667443 [0,2,0,0,0,0|1,0,1]=4 4446 B16R1.23825 CC(=O)c1cc(cc(c1OCC(=O)[O-])Cl)C 34a_100010659243_100020667443 [0,2,0,0,0,0|1,0,1]=4 4447 B16R1.23825 CC(=O)c1cc(cc(c1OCC(=O)[O-])Cl)F 34a_100011659368_100020667443 [0,2,0,0,0,0|1,0,1]=4 4448 B16R1.23825 CC(=O)c1cc(cc(c1OCC(=O)[O-])F)F 34a_100000751779_100020667443 [0,2,0,0,0,0|1,0,1]=4 4449 B16R1.23825 CC(O)COc1c(cc(cc1C(=O)N)Br)Br 34a_200009812496_100011218427 [0,2,0,0,0,0|1,0,1]=4 4450 B16R1.23825 CC(O)COc1c(cc(cc1C(=O)N)Br)Br 7a_200009812496_100011218427 [0,2,0,0,0,0|1,0,1]=4 4451 B16R1.23825 CC(O)COc1c(cc(cc1C(=O)N)F)I 34a_200135271384_100011218427 [0,2,0,0,0,0|1,0,1]=4 4452 B16R1.23825 CC(O)COc1c(cc(cc1C(=O)N)F)I 7a_200135271384_100011218427 [0,2,0,0,0,0|1,0,1]=4 4453 B16R1.23825 C[C@@H](O)COc1c(cc(cc1C(=O)N)Br)Br 34a_200009812496_100009817552 [0,2,0,0,0,0|1,0,1]=4 4454 B16R1.23825 C[C@@H](O)COc1c(cc(cc1C(=O)N)Br)Br 7a_200009812496_100009817552 [0,2,0,0,0,0|1,0,1]=4 4455 B16R1.23825 C[C@@H](O)COc1c(cc(cc1C(=O)N)F)I 34a_200135271384_100009817552 [0,2,0,0,0,0|1,0,1]=4 4456 B16R1.23825 C[C@@H](O)COc1c(cc(cc1C(=O)N)F)I 7a_200135271384_100009817552 [0,2,0,0,0,0|1,0,1]=4 4457 B16R1.23825 Cc1cc(cc(c1NCC(=O)N)C(=O)N)Cl 34a_200000101212_100000187820 [0,2,0,0,0,0|2,0,0]=4 4458 B16R1.23825 Cc1cc(cc(c1NCC(=O)N)C(=O)N)Cl 7a_200000101212_100000187820 [0,2,0,0,0,0|2,0,0]=4 4459 B16R1.23825 Cc1cc(cc(c1NCC(=O)[O-])C(=O)N)Cl 34a_200000101212_100020667443 [0,2,0,0,0,0|1,0,1]=4 4460 B16R1.23825 NC(=O)COc1c(cc(cc1C(=O)N)Br)Br 34a_200009812496_100000187820 [0,2,0,0,0,0|1,0,0]=3 4461 B16R1.23825 NC(=O)COc1c(cc(cc1C(=O)N)Br)Br 7a_200009812496_100000187820 [0,2,0,0,0,0|1,0,0]=3 4462 B16R1.23825 NC(=O)COc1c(cc(cc1C(=O)N)F)I 34a_200135271384_100000187820 [0,2,0,0,0,0|1,0,0]=3 4463 B16R1.23825 NC(=O)COc1c(cc(cc1C(=O)N)F)I 7a_200135271384_100000187820 [0,2,0,0,0,0|1,0,0]=3 4464 B16R1.23825 NC(=O)c1cc(cc(c1OCC(=O)[O-])Br)Br 34a_200009812496_100020667443 [0,2,0,0,0,0|0,0,1]=3 4465 B16R1.23825 NC(=O)c1cc(cc(c1OCC(=O)[O-])I)F 34a_200135271384_100020667443 [0,2,0,0,0,0|0,0,1]=3 4466 B16R1.23825 NC(=O)c1cc(cc(c1OC[N+](=O)[O-])Br)Br 34a_200009812496_100000761209 [0,2,0,0,0,0|1,0,1]=4 4467 B16R1.23825 NC(=O)c1cc(cc(c1OC[N+](=O)[O-])I)F 34a_200135271384_100000761209 [0,2,0,0,0,0|1,0,1]=4 4468 B16R1.3922 CC(=O)c1c(cc(cc1OCC(=O)N)Br)F 34a_100010734142_100000187820 [0,2,0,0,0,0|2,0,0]=4 4469 B16R1.3922 CC(=O)c1c(cc(cc1OCC(=O)N)Br)F 7a_100010734142_100000187820 [0,2,0,0,0,0|2,0,0]=4 4470 B16R1.3922 CC(=O)c1c(cc(cc1OCC(=O)N)Cl)F 34a_100009859732_100000187820 [0,2,0,0,0,0|2,0,0]=4 4471 B16R1.3922 CC(=O)c1c(cc(cc1OCC(=O)N)Cl)F 7a_100009859732_100000187820 [0,2,0,0,0,0|2,0,0]=4 4472 B16R1.3922 CC(=O)c1c(cc(cc1OCC(=O)[O-])Br)F 34a_100010734142_100020667443 [0,2,0,0,0,0|1,0,1]=4 4473 B16R1.3922 CC(=O)c1c(cc(cc1OCC(=O)[O-])Cl)F 34a_100009859732_100020667443 [0,2,0,0,0,0|1,0,1]=4 4474 B16R1.11221 CC(=O)C(C)Nc1cccc(c1C(=O)N)C 7a_100102558177_100000179758 [0,2,0,0,0,0|2,0,0]=4 4475 B16R1.11221 CC(=O)C(C)Nc1cccc(c1C(=O)N)Cl 7a_100000764435_100000179758 [0,2,0,0,0,0|2,0,0]=4 4476 B16R1.11221 CC(=O)C(C)Nc1cccc(c1C(=O)N)F 7a_100000036109_100000179758 [0,2,0,0,0,0|2,0,0]=4 4477 B16R1.11221 CC(=O)C(C)Oc1cccc(c1C(=O)N)F 7a_100000701607_100000179758 [0,2,0,0,0,0|1,0,0]=3 4478 B16R1.11221 CC(=O)C(C)Sc1cccc(c1C(=O)N)Cl 62a_100010147686_100009814033 [0,2,0,0,0,0|1,1,0]=4 4479 B16R1.11221 CC(=O)C(C)Sc1cccc(c1C(=O)N)F 62a_100011219063_100009814033 [0,2,0,0,0,0|1,1,0]=4 4480 B16R1.11221 CC(=O)c1c(cccc1OC(C)C(=O)C)Br 7a_100010174959_100000179758 [0,2,0,0,0,0|2,0,0]=4 4481 B16R1.11221 CC(=O)c1c(cccc1OC(C)C(=O)C)C 7a_100009860897_100000179758 [0,2,0,0,0,0|2,0,0]=4 4482 B16R1.11221 CC(=O)c1c(cccc1OC(C)C(=O)C)Cl 7a_100000730630_100000179758 [0,2,0,0,0,0|2,0,0]=4 4483 B16R1.11221 CC(=O)c1c(cccc1OC(C)C(=O)C)F 7a_100011216272_100000179758 [0,2,0,0,0,0|2,0,0]=4 4484 B16R1.11221 CC(=O)c1c(cccc1OC(C)C(=O)N)Br 34a_100010174959_100000702099 [0,2,0,0,0,0|2,0,0]=4 4485 B16R1.11221 CC(=O)c1c(cccc1OC(C)C(=O)N)Br 7a_100010174959_100000702099 [0,2,0,0,0,0|2,0,0]=4 4486 B16R1.11221 CC(=O)c1c(cccc1OC(C)C(=O)N)C 34a_100009860897_100000702099 [0,2,0,0,0,0|2,0,0]=4 4487 B16R1.11221 CC(=O)c1c(cccc1OC(C)C(=O)N)C 7a_100009860897_100000702099 [0,2,0,0,0,0|2,0,0]=4 4488 B16R1.11221 CC(=O)c1c(cccc1OC(C)C(=O)N)Cl 34a_100000730630_100000702099 [0,2,0,0,0,0|2,0,0]=4 4489 B16R1.11221 CC(=O)c1c(cccc1OC(C)C(=O)N)Cl 7a_100000730630_100000702099 [0,2,0,0,0,0|2,0,0]=4 4490 B16R1.11221 CC(=O)c1c(cccc1OC(C)C(=O)N)F 34a_100011216272_100000702099 [0,2,0,0,0,0|2,0,0]=4 4491 B16R1.11221 CC(=O)c1c(cccc1OC(C)C(=O)N)F 7a_100011216272_100000702099 [0,2,0,0,0,0|2,0,0]=4 4492 B16R1.11221 CC(=O)c1c(cccc1OC(F)C(=O)N)Br 34a_100010174959_100009813875 [0,2,0,0,0,0|2,0,0]=4 4493 B16R1.11221 CC(=O)c1c(cccc1OC(F)C(=O)N)Br 7a_100010174959_100009813875 [0,2,0,0,0,0|2,0,0]=4 4494 B16R1.11221 CC(=O)c1c(cccc1OC(F)C(=O)N)C 34a_100009860897_100009813875 [0,2,0,0,0,0|2,0,0]=4 4495 B16R1.11221 CC(=O)c1c(cccc1OC(F)C(=O)N)C 7a_100009860897_100009813875 [0,2,0,0,0,0|2,0,0]=4 4496 B16R1.11221 CC(=O)c1c(cccc1OC(F)C(=O)N)Cl 34a_100000730630_100009813875 [0,2,0,0,0,0|2,0,0]=4 4497 B16R1.11221 CC(=O)c1c(cccc1OC(F)C(=O)N)Cl 7a_100000730630_100009813875 [0,2,0,0,0,0|2,0,0]=4 4498 B16R1.11221 CC(=O)c1c(cccc1OC(F)C(=O)N)F 34a_100011216272_100009813875 [0,2,0,0,0,0|2,0,0]=4 4499 B16R1.11221 CC(=O)c1c(cccc1OC(F)C(=O)N)F 7a_100011216272_100009813875 [0,2,0,0,0,0|2,0,0]=4 4500 B16R1.11221 CC(=O)c1c(cccc1OC(F)C(=O)[O-])Br 34a_100010174959_100020610796 [0,2,0,0,0,0|1,0,1]=4 4501 B16R1.11221 CC(=O)c1c(cccc1OC(F)C(=O)[O-])C 34a_100009860897_100020610796 [0,2,0,0,0,0|1,0,1]=4 4502 B16R1.11221 CC(=O)c1c(cccc1OC(F)C(=O)[O-])Cl 34a_100000730630_100020610796 [0,2,0,0,0,0|1,0,1]=4 4503 B16R1.11221 CC(=O)c1c(cccc1OC(F)C(=O)[O-])F 34a_100011216272_100020610796 [0,2,0,0,0,0|1,0,1]=4 4504 B16R1.11221 CC(Nc1cccc(c1C(=O)N)Cl)C(=O)N 34a_100000764435_100000702099 [0,2,0,0,0,0|2,0,0]=4 4505 B16R1.11221 CC(Nc1cccc(c1C(=O)N)Cl)C(=O)N 7a_100000764435_100000702099 [0,2,0,0,0,0|2,0,0]=4 4506 B16R1.11221 CC(Nc1cccc(c1C(=O)N)F)C(=O)N 34a_100000036109_100000702099 [0,2,0,0,0,0|2,0,0]=4 4507 B16R1.11221 CC(Nc1cccc(c1C(=O)N)F)C(=O)N 7a_100000036109_100000702099 [0,2,0,0,0,0|2,0,0]=4 4508 B16R1.11221 CC(Oc1cccc(c1C(=O)N)F)C(=O)N 34a_100000701607_100000702099 [0,2,0,0,0,0|1,0,0]=3 4509 B16R1.11221 CC(Oc1cccc(c1C(=O)N)F)C(=O)N 7a_100000701607_100000702099 [0,2,0,0,0,0|1,0,0]=3 4510 B16R1.11221 CC(Sc1cccc(c1C(=O)N)Cl)C(=O)N 62a_100010147686_100000702099 [0,2,0,0,0,0|1,1,0]=4 4511 B16R1.11221 CC(Sc1cccc(c1C(=O)N)F)C(=O)N 62a_100011219063_100000702099 [0,2,0,0,0,0|1,1,0]=4 4512 B16R1.11221 C[C@@H](Nc1cccc(c1C(=O)N)F)C(=O)N 27a_100000119354_100011219063 [0,2,0,0,0,0|2,0,0]=4 4513 B16R1.11221 Cc1cccc(c1C(=O)N)NC(C)C(=O)N 34a_100102558177_100000702099 [0,2,0,0,0,0|2,0,0]=4 4514 B16R1.11221 Cc1cccc(c1C(=O)N)NC(C)C(=O)N 7a_100102558177_100000702099 [0,2,0,0,0,0|2,0,0]=4 4515 B16R1.11221 Cc1cccc(c1C(=O)N)NC(F)C(=O)N 34a_100102558177_100009813875 [0,2,0,0,0,0|2,0,0]=4 4516 B16R1.11221 Cc1cccc(c1C(=O)N)NC(F)C(=O)N 7a_100102558177_100009813875 [0,2,0,0,0,0|2,0,0]=4 4517 B16R1.11221 Cc1cccc(c1C(=O)N)NC(F)C(=O)[O-] 34a_100102558177_100020610796 [0,2,0,0,0,0|1,0,1]=4 4518 B16R1.11221 NC(=O)c1c(cccc1NC(F)C(=O)N)Cl 34a_100000764435_100009813875 [0,2,0,0,0,0|2,0,0]=4 4519 B16R1.11221 NC(=O)c1c(cccc1NC(F)C(=O)N)Cl 7a_100000764435_100009813875 [0,2,0,0,0,0|2,0,0]=4 4520 B16R1.11221 NC(=O)c1c(cccc1NC(F)C(=O)N)F 34a_100000036109_100009813875 [0,2,0,0,0,0|2,0,0]=4 4521 B16R1.11221 NC(=O)c1c(cccc1NC(F)C(=O)N)F 7a_100000036109_100009813875 [0,2,0,0,0,0|2,0,0]=4 4522 B16R1.11221 NC(=O)c1c(cccc1NC(F)C(=O)[O-])Cl 34a_100000764435_100020610796 [0,2,0,0,0,0|1,0,1]=4 4523 B16R1.11221 NC(=O)c1c(cccc1NC(F)C(=O)[O-])F 34a_100000036109_100020610796 [0,2,0,0,0,0|1,0,1]=4 4524 B16R1.11221 NC(=O)c1c(cccc1OC(F)C(=O)N)F 34a_100000701607_100009813875 [0,2,0,0,0,0|1,0,0]=3 4525 B16R1.11221 NC(=O)c1c(cccc1OC(F)C(=O)N)F 7a_100000701607_100009813875 [0,2,0,0,0,0|1,0,0]=3 4526 B16R1.11221 NC(=O)c1c(cccc1OC(F)C(=O)[O-])F 34a_100000701607_100020610796 [0,2,0,0,0,0|0,0,1]=3 4527 B16R1.11221 NC(=O)c1c(cccc1SC(F)C(=O)N)Cl 62a_100010147686_100009813875 [0,2,0,0,0,0|1,1,0]=4 4528 B16R1.11221 NC(=O)c1c(cccc1SC(F)C(=O)N)F 62a_100011219063_100009813875 [0,2,0,0,0,0|1,1,0]=4 4529 B16R1.11221 NC(=O)c1c(cccc1SC(F)C(=O)[O-])Cl 62a_100010147686_100020610796 [0,2,0,0,0,0|0,1,1]=4 4530 B16R1.11221 NC(=O)c1c(cccc1SC(F)C(=O)[O-])F 62a_100011219063_100020610796 [0,2,0,0,0,0|0,1,1]=4 4531 B16R1.19704 COc1cccc(c1C(=O)C)OCC(=O)N 34a_100000691520_100000187820 [0,2,0,0,0,0|2,0,0]=4 4532 B16R1.19704 COc1cccc(c1C(=O)C)OCC(=O)N 7a_100000691520_100000187820 [0,2,0,0,0,0|2,0,0]=4 4533 B16R1.19704 COc1cccc(c1C(=O)C)OCC(=O)[O-] 34a_100000691520_100020667443 [0,2,0,0,0,0|1,0,1]=4 4534 B16R1.19704 COc1cccc(c1C(=O)N)NCC(=O)N 34a_200012186629_100000187820 [0,2,0,0,0,0|2,0,0]=4 4535 B16R1.19704 COc1cccc(c1C(=O)N)NCC(=O)[O-] 34a_200012186629_100020667443 [0,2,0,0,0,0|1,0,1]=4 4536 B16R1.19704 COc1cccc(c1C(=O)N)SCC(=O)N 62a_200010146778_100000747473 [0,2,0,0,0,0|1,1,0]=4 4537 B16R1.19704 COc1cccc(c1C(=O)N)SCC(=O)[O-] 62a_200010146778_100020667443 [0,2,0,0,0,0|0,1,1]=4 4538 B16R1.11342 CC(=O)c1cc(c(cc1OCC(=O)N)Br)C 34a_100009816031_100000187820 [0,2,0,0,0,0|2,0,0]=4 4539 B16R1.11342 CC(=O)c1cc(c(cc1OCC(=O)N)Br)C 7a_100009816031_100000187820 [0,2,0,0,0,0|2,0,0]=4 4540 B16R1.11342 CC(=O)c1cc(c(cc1OCC(=O)N)Br)F 34a_200010245088_100000187820 [0,2,0,0,0,0|2,0,0]=4 4541 B16R1.11342 CC(=O)c1cc(c(cc1OCC(=O)N)Br)F 7a_200010245088_100000187820 [0,2,0,0,0,0|2,0,0]=4 4542 B16R1.11342 CC(=O)c1cc(c(cc1OCC(=O)N)C)Br 34a_200010233951_100000187820 [0,2,0,0,0,0|2,0,0]=4 4543 B16R1.11342 CC(=O)c1cc(c(cc1OCC(=O)N)C)Br 7a_200010233951_100000187820 [0,2,0,0,0,0|2,0,0]=4 4544 B16R1.11342 CC(=O)c1cc(c(cc1OCC(=O)N)C)C 34a_100000014572_100000187820 [0,2,0,0,0,0|2,0,0]=4 4545 B16R1.11342 CC(=O)c1cc(c(cc1OCC(=O)N)C)C 7a_100000014572_100000187820 [0,2,0,0,0,0|2,0,0]=4 4546 B16R1.11342 CC(=O)c1cc(c(cc1OCC(=O)N)C)Cl 34a_100000014566_100000187820 [0,2,0,0,0,0|2,0,0]=4 4547 B16R1.11342 CC(=O)c1cc(c(cc1OCC(=O)N)C)Cl 7a_100000014566_100000187820 [0,2,0,0,0,0|2,0,0]=4 4548 B16R1.11342 CC(=O)c1cc(c(cc1OCC(=O)N)Cl)Cl 34a_100000720105_100000187820 [0,2,0,0,0,0|2,0,0]=4 4549 B16R1.11342 CC(=O)c1cc(c(cc1OCC(=O)N)Cl)Cl 7a_100000720105_100000187820 [0,2,0,0,0,0|2,0,0]=4 4550 B16R1.11342 CC(=O)c1cc(c(cc1OCC(=O)N)F)Br 34a_100000691652_100000187820 [0,2,0,0,0,0|2,0,0]=4 4551 B16R1.11342 CC(=O)c1cc(c(cc1OCC(=O)N)F)Br 7a_100000691652_100000187820 [0,2,0,0,0,0|2,0,0]=4 4552 B16R1.11342 CC(=O)c1cc(c(cc1OCC(=O)[O-])Br)C 34a_100009816031_100020667443 [0,2,0,0,0,0|1,0,1]=4 4553 B16R1.11342 CC(=O)c1cc(c(cc1OCC(=O)[O-])Br)F 34a_200010245088_100020667443 [0,2,0,0,0,0|1,0,1]=4 4554 B16R1.11342 CC(=O)c1cc(c(cc1OCC(=O)[O-])C)Br 34a_200010233951_100020667443 [0,2,0,0,0,0|1,0,1]=4 4555 B16R1.11342 CC(=O)c1cc(c(cc1OCC(=O)[O-])C)C 34a_100000014572_100020667443 [0,2,0,0,0,0|1,0,1]=4 4556 B16R1.11342 CC(=O)c1cc(c(cc1OCC(=O)[O-])C)Cl 34a_100000014566_100020667443 [0,2,0,0,0,0|1,0,1]=4 4557 B16R1.11342 CC(=O)c1cc(c(cc1OCC(=O)[O-])Cl)Cl 34a_100000720105_100020667443 [0,2,0,0,0,0|1,0,1]=4 4558 B16R1.11342 CC(=O)c1cc(c(cc1OCC(=O)[O-])F)Br 34a_100000691652_100020667443 [0,2,0,0,0,0|1,0,1]=4 4559 B16R1.11342 NC(=O)CNc1cc(c(cc1C(=O)N)Br)F 34a_100015444839_100000187820 [0,2,0,0,0,0|2,0,0]=4 4560 B16R1.11342 NC(=O)CNc1cc(c(cc1C(=O)N)Br)F 7a_100015444839_100000187820 [0,2,0,0,0,0|2,0,0]=4 4561 B16R1.11342 NC(=O)c1cc(c(cc1NCC(=O)[O-])F)Br 34a_100015444839_100020667443 [0,2,0,0,0,0|1,0,1]=4 4562 B16R1.11453 CC(=O)C(C)Nc1ccc(cc1C(=O)N)Br 7a_100000740421_100000179758 [0,2,0,0,0,0|2,0,0]=4 4563 B16R1.11453 CC(=O)C(C)Nc1ccc(cc1C(=O)N)Cl 7a_100000743835_100000179758 [0,2,0,0,0,0|2,0,0]=4 4564 B16R1.11453 CC(=O)C(C)Nc1ccc(cc1C(=O)N)F 7a_100000741173_100000179758 [0,2,0,0,0,0|2,0,0]=4 4565 B16R1.11453 CC(=O)C(C)Oc1ccc(cc1C(=O)N)Br 7a_100000192807_100000179758 [0,2,0,0,0,0|1,0,0]=3 4566 B16R1.11453 CC(=O)C(C)Oc1ccc(cc1C(=O)N)C 7a_200000192840_100000179758 [0,2,0,0,0,0|1,0,0]=3 4567 B16R1.11453 CC(=O)C(C)Oc1ccc(cc1C(=O)N)Cl 7a_100000185026_100000179758 [0,2,0,0,0,0|1,0,0]=3 4568 B16R1.11453 CC(=O)C(C)Oc1ccc(cc1C(=O)N)F 7a_100012186459_100000179758 [0,2,0,0,0,0|1,0,0]=3 4569 B16R1.11453 CC(=O)C(C)Oc1ccc(cc1C(=O)N)I 7a_100000192813_100000179758 [0,2,0,0,0,0|1,0,0]=3 4570 B16R1.11453 CC(=O)C(C)Sc1ccc(cc1C(=O)N)Br 62a_200000162314_100009814033 [0,2,0,0,0,0|1,1,0]=4 4571 B16R1.11453 CC(=O)C(C)Sc1ccc(cc1C(=O)N)C 62a_100009814033_200012349609 [0,2,0,0,0,0|1,1,0]=4 4572 B16R1.11453 CC(=O)C(C)Sc1ccc(cc1C(=O)N)C 62a_200012349609_100009814033 [0,2,0,0,0,0|1,1,0]=4 4573 B16R1.11453 CC(=O)C(C)Sc1ccc(cc1C(=O)N)F 62a_100000206434_100009814033 [0,2,0,0,0,0|1,1,0]=4 4574 B16R1.11453 CC(=O)C(C)Sc1ccc(cc1C(=O)N)F 62a_100009814033_100000206434 [0,2,0,0,0,0|1,1,0]=4 4575 B16R1.11453 CC(=O)C(C)Sc1ccc(cc1C(=O)N)N 62a_100015186447_100009814033 [0,2,0,0,0,0|1,1,0]=4 4576 B16R1.11453 CC(=O)c1cc(ccc1OC(C)C(=O)C)Br 7a_100000212127_100000179758 [0,2,0,0,0,0|2,0,0]=4 4577 B16R1.11453 CC(=O)c1cc(ccc1OC(C)C(=O)C)C 7a_100000195442_100000179758 [0,2,0,0,0,0|2,0,0]=4 4578 B16R1.11453 CC(=O)c1cc(ccc1OC(C)C(=O)C)Cl 7a_100000185566_100000179758 [0,2,0,0,0,0|2,0,0]=4 4579 B16R1.11453 CC(=O)c1cc(ccc1OC(C)C(=O)C)F 7a_100000182812_100000179758 [0,2,0,0,0,0|2,0,0]=4 4580 B16R1.11453 CC(=O)c1cc(ccc1OC(C)C(=O)C)I 7a_100010712555_100000179758 [0,2,0,0,0,0|2,0,0]=4 4581 B16R1.11453 CC(=O)c1cc(ccc1OC(C)C(=O)N)Br 34a_100000212127_100000702099 [0,2,0,0,0,0|2,0,0]=4 4582 B16R1.11453 CC(=O)c1cc(ccc1OC(C)C(=O)N)Br 7a_100000212127_100000702099 [0,2,0,0,0,0|2,0,0]=4 4583 B16R1.11453 CC(=O)c1cc(ccc1OC(C)C(=O)N)C 34a_100000195442_100000702099 [0,2,0,0,0,0|2,0,0]=4 4584 B16R1.11453 CC(=O)c1cc(ccc1OC(C)C(=O)N)C 7a_100000195442_100000702099 [0,2,0,0,0,0|2,0,0]=4 4585 B16R1.11453 CC(=O)c1cc(ccc1OC(C)C(=O)N)Cl 34a_100000185566_100000702099 [0,2,0,0,0,0|2,0,0]=4 4586 B16R1.11453 CC(=O)c1cc(ccc1OC(C)C(=O)N)Cl 7a_100000185566_100000702099 [0,2,0,0,0,0|2,0,0]=4 4587 B16R1.11453 CC(=O)c1cc(ccc1OC(C)C(=O)N)F 7a_100000182812_100000702099 [0,2,0,0,0,0|2,0,0]=4 4588 B16R1.11453 CC(=O)c1cc(ccc1OC(C)C(=O)N)I 7a_100010712555_100000702099 [0,2,0,0,0,0|2,0,0]=4 4589 B16R1.11453 CC(=O)c1cc(ccc1OC(C)C(=O)N)N 34a_100011218865_100000702099 [0,2,0,0,0,0|2,0,0]=4 4590 B16R1.11453 CC(=O)c1cc(ccc1OC(F)C(=O)N)Br 34a_100000212127_100009813875 [0,2,0,0,0,0|2,0,0]=4 4591 B16R1.11453 CC(=O)c1cc(ccc1OC(F)C(=O)N)Br 7a_100000212127_100009813875 [0,2,0,0,0,0|2,0,0]=4 4592 B16R1.11453 CC(=O)c1cc(ccc1OC(F)C(=O)N)C 34a_100000195442_100009813875 [0,2,0,0,0,0|2,0,0]=4 4593 B16R1.11453 CC(=O)c1cc(ccc1OC(F)C(=O)N)C 7a_100000195442_100009813875 [0,2,0,0,0,0|2,0,0]=4 4594 B16R1.11453 CC(=O)c1cc(ccc1OC(F)C(=O)N)Cl 34a_100000185566_100009813875 [0,2,0,0,0,0|2,0,0]=4 4595 B16R1.11453 CC(=O)c1cc(ccc1OC(F)C(=O)N)Cl 7a_100000185566_100009813875 [0,2,0,0,0,0|2,0,0]=4 4596 B16R1.11453 CC(=O)c1cc(ccc1OC(F)C(=O)N)F 7a_100000182812_100009813875 [0,2,0,0,0,0|2,0,0]=4 4597 B16R1.11453 CC(=O)c1cc(ccc1OC(F)C(=O)N)I 7a_100010712555_100009813875 [0,2,0,0,0,0|2,0,0]=4 4598 B16R1.11453 CC(=O)c1cc(ccc1OC(F)C(=O)N)N 34a_100011218865_100009813875 [0,2,0,0,0,0|2,0,0]=4 4599 B16R1.11453 CC(=O)c1cc(ccc1OC(F)C(=O)[O-])Br 34a_100000212127_100020610796 [0,2,0,0,0,0|1,0,1]=4 4600 B16R1.11453 CC(=O)c1cc(ccc1OC(F)C(=O)[O-])C 34a_100000195442_100020610796 [0,2,0,0,0,0|1,0,1]=4 4601 B16R1.11453 CC(=O)c1cc(ccc1OC(F)C(=O)[O-])Cl 34a_100000185566_100020610796 [0,2,0,0,0,0|1,0,1]=4 4602 B16R1.11453 CC(=O)c1cc(ccc1OC(F)C(=O)[O-])N 34a_100011218865_100020610796 [0,2,0,0,0,0|1,0,1]=4 4603 B16R1.11453 CC(Nc1ccc(cc1C(=O)N)Br)C(=O)N 34a_100000740421_100000702099 [0,2,0,0,0,0|2,0,0]=4 4604 B16R1.11453 CC(Nc1ccc(cc1C(=O)N)Br)C(=O)N 7a_100000740421_100000702099 [0,2,0,0,0,0|2,0,0]=4 4605 B16R1.11453 CC(Nc1ccc(cc1C(=O)N)Cl)C(=O)N 34a_100000743835_100000702099 [0,2,0,0,0,0|2,0,0]=4 4606 B16R1.11453 CC(Nc1ccc(cc1C(=O)N)Cl)C(=O)N 7a_100000743835_100000702099 [0,2,0,0,0,0|2,0,0]=4 4607 B16R1.11453 CC(Nc1ccc(cc1C(=O)N)F)C(=O)N 34a_100000741173_100000702099 [0,2,0,0,0,0|2,0,0]=4 4608 B16R1.11453 CC(Nc1ccc(cc1C(=O)N)F)C(=O)N 7a_100000741173_100000702099 [0,2,0,0,0,0|2,0,0]=4 4609 B16R1.11453 CC(Oc1ccc(cc1C(=O)N)Br)C(=O)N 34a_100000192807_100000702099 [0,2,0,0,0,0|1,0,0]=3 4610 B16R1.11453 CC(Oc1ccc(cc1C(=O)N)Br)C(=O)N 7a_100000192807_100000702099 [0,2,0,0,0,0|1,0,0]=3 4611 B16R1.11453 CC(Oc1ccc(cc1C(=O)N)Cl)C(=O)N 34a_100000185026_100000702099 [0,2,0,0,0,0|1,0,0]=3 4612 B16R1.11453 CC(Oc1ccc(cc1C(=O)N)Cl)C(=O)N 7a_100000185026_100000702099 [0,2,0,0,0,0|1,0,0]=3 4613 B16R1.11453 CC(Oc1ccc(cc1C(=O)N)F)C(=O)N 34a_100012186459_100000702099 [0,2,0,0,0,0|1,0,0]=3 4614 B16R1.11453 CC(Oc1ccc(cc1C(=O)N)F)C(=O)N 7a_100012186459_100000702099 [0,2,0,0,0,0|1,0,0]=3 4615 B16R1.11453 CC(Oc1ccc(cc1C(=O)N)I)C(=O)N 34a_100000192813_100000702099 [0,2,0,0,0,0|1,0,0]=3 4616 B16R1.11453 CC(Oc1ccc(cc1C(=O)N)I)C(=O)N 7a_100000192813_100000702099 [0,2,0,0,0,0|1,0,0]=3 4617 B16R1.11453 CC(Sc1ccc(cc1C(=O)N)Br)C(=O)N 62a_200000162314_100000702099 [0,2,0,0,0,0|1,1,0]=4 4618 B16R1.11453 CC(Sc1ccc(cc1C(=O)N)F)C(=O)N 62a_100000206434_100000702099 [0,2,0,0,0,0|1,1,0]=4 4619 B16R1.11453 CC(Sc1ccc(cc1C(=O)N)F)C(=O)N 62a_100000702099_100000206434 [0,2,0,0,0,0|1,1,0]=4 4620 B16R1.11453 CC(Sc1ccc(cc1C(=O)N)N)C(=O)N 62a_100015186447_100000702099 [0,2,0,0,0,0|1,1,0]=4 4621 B16R1.11453 C[C@@H](Nc1ccc(cc1C(=O)N)Br)C(=O)N 27a_100000119354_200000162314 [0,2,0,0,0,0|2,0,0]=4 4622 B16R1.11453 Cc1ccc(c(c1)C(=O)N)NC(C)C(=O)N 34a_100011692829_100000702099 [0,2,0,0,0,0|2,0,0]=4 4623 B16R1.11453 Cc1ccc(c(c1)C(=O)N)NC(F)C(=O)N 34a_100011692829_100009813875 [0,2,0,0,0,0|2,0,0]=4 4624 B16R1.11453 Cc1ccc(c(c1)C(=O)N)NC(F)C(=O)[O-] 34a_100011692829_100020610796 [0,2,0,0,0,0|1,0,1]=4 4625 B16R1.11453 Cc1ccc(c(c1)C(=O)N)OC(C)C(=O)N 34a_200000192840_100000702099 [0,2,0,0,0,0|1,0,0]=3 4626 B16R1.11453 Cc1ccc(c(c1)C(=O)N)OC(C)C(=O)N 7a_200000192840_100000702099 [0,2,0,0,0,0|1,0,0]=3 4627 B16R1.11453 Cc1ccc(c(c1)C(=O)N)OC(F)C(=O)N 34a_200000192840_100009813875 [0,2,0,0,0,0|1,0,0]=3 4628 B16R1.11453 Cc1ccc(c(c1)C(=O)N)OC(F)C(=O)N 7a_200000192840_100009813875 [0,2,0,0,0,0|1,0,0]=3 4629 B16R1.11453 Cc1ccc(c(c1)C(=O)N)OC(F)C(=O)[O-] 34a_200000192840_100020610796 [0,2,0,0,0,0|0,0,1]=3 4630 B16R1.11453 Cc1ccc(c(c1)C(=O)N)SC(C)C(=O)N 62a_100000702099_200012349609 [0,2,0,0,0,0|1,1,0]=4 4631 B16R1.11453 Cc1ccc(c(c1)C(=O)N)SC(C)C(=O)N 62a_200012349609_100000702099 [0,2,0,0,0,0|1,1,0]=4 4632 B16R1.11453 Cc1ccc(c(c1)C(=O)N)SC(F)C(=O)N 62a_100009813875_200012349609 [0,2,0,0,0,0|1,1,0]=4 4633 B16R1.11453 Cc1ccc(c(c1)C(=O)N)SC(F)C(=O)N 62a_200012349609_100009813875 [0,2,0,0,0,0|1,1,0]=4 4634 B16R1.11453 Cc1ccc(c(c1)C(=O)N)SC(F)C(=O)[O-] 62a_100020610796_200012349609 [0,2,0,0,0,0|0,1,1]=4 4635 B16R1.11453 Cc1ccc(c(c1)C(=O)N)SC(F)C(=O)[O-] 62a_200012349609_100020610796 [0,2,0,0,0,0|0,1,1]=4 4636 B16R1.11453 NC(=O)c1cc(ccc1NC(F)C(=O)N)Br 34a_100000740421_100009813875 [0,2,0,0,0,0|2,0,0]=4 4637 B16R1.11453 NC(=O)c1cc(ccc1NC(F)C(=O)N)Br 7a_100000740421_100009813875 [0,2,0,0,0,0|2,0,0]=4 4638 B16R1.11453 NC(=O)c1cc(ccc1NC(F)C(=O)N)Cl 34a_100000743835_100009813875 [0,2,0,0,0,0|2,0,0]=4 4639 B16R1.11453 NC(=O)c1cc(ccc1NC(F)C(=O)N)Cl 7a_100000743835_100009813875 [0,2,0,0,0,0|2,0,0]=4 4640 B16R1.11453 NC(=O)c1cc(ccc1NC(F)C(=O)N)F 34a_100000741173_100009813875 [0,2,0,0,0,0|2,0,0]=4 4641 B16R1.11453 NC(=O)c1cc(ccc1NC(F)C(=O)N)F 7a_100000741173_100009813875 [0,2,0,0,0,0|2,0,0]=4 4642 B16R1.11453 NC(=O)c1cc(ccc1NC(F)C(=O)[O-])Br 34a_100000740421_100020610796 [0,2,0,0,0,0|1,0,1]=4 4643 B16R1.11453 NC(=O)c1cc(ccc1NC(F)C(=O)[O-])Cl 34a_100000743835_100020610796 [0,2,0,0,0,0|1,0,1]=4 4644 B16R1.11453 NC(=O)c1cc(ccc1NC(F)C(=O)[O-])F 34a_100000741173_100020610796 [0,2,0,0,0,0|1,0,1]=4 4645 B16R1.11453 NC(=O)c1cc(ccc1OC(F)C(=O)N)Br 34a_100000192807_100009813875 [0,2,0,0,0,0|1,0,0]=3 4646 B16R1.11453 NC(=O)c1cc(ccc1OC(F)C(=O)N)Br 7a_100000192807_100009813875 [0,2,0,0,0,0|1,0,0]=3 4647 B16R1.11453 NC(=O)c1cc(ccc1OC(F)C(=O)N)Cl 34a_100000185026_100009813875 [0,2,0,0,0,0|1,0,0]=3 4648 B16R1.11453 NC(=O)c1cc(ccc1OC(F)C(=O)N)Cl 7a_100000185026_100009813875 [0,2,0,0,0,0|1,0,0]=3 4649 B16R1.11453 NC(=O)c1cc(ccc1OC(F)C(=O)N)F 34a_100012186459_100009813875 [0,2,0,0,0,0|1,0,0]=3 4650 B16R1.11453 NC(=O)c1cc(ccc1OC(F)C(=O)N)F 7a_100012186459_100009813875 [0,2,0,0,0,0|1,0,0]=3 4651 B16R1.11453 NC(=O)c1cc(ccc1OC(F)C(=O)N)I 34a_100000192813_100009813875 [0,2,0,0,0,0|1,0,0]=3 4652 B16R1.11453 NC(=O)c1cc(ccc1OC(F)C(=O)N)I 7a_100000192813_100009813875 [0,2,0,0,0,0|1,0,0]=3 4653 B16R1.11453 NC(=O)c1cc(ccc1OC(F)C(=O)[O-])Br 34a_100000192807_100020610796 [0,2,0,0,0,0|0,0,1]=3 4654 B16R1.11453 NC(=O)c1cc(ccc1OC(F)C(=O)[O-])Cl 34a_100000185026_100020610796 [0,2,0,0,0,0|0,0,1]=3 4655 B16R1.11453 NC(=O)c1cc(ccc1OC(F)C(=O)[O-])F 34a_100012186459_100020610796 [0,2,0,0,0,0|0,0,1]=3 4656 B16R1.11453 NC(=O)c1cc(ccc1OC(F)C(=O)[O-])I 34a_100000192813_100020610796 [0,2,0,0,0,0|0,0,1]=3 4657 B16R1.11453 NC(=O)c1cc(ccc1SC(F)C(=O)N)Br 62a_200000162314_100009813875 [0,2,0,0,0,0|1,1,0]=4 4658 B16R1.11453 NC(=O)c1cc(ccc1SC(F)C(=O)N)F 62a_100000206434_100009813875 [0,2,0,0,0,0|1,1,0]=4 4659 B16R1.11453 NC(=O)c1cc(ccc1SC(F)C(=O)N)F 62a_100009813875_100000206434 [0,2,0,0,0,0|1,1,0]=4 4660 B16R1.11453 NC(=O)c1cc(ccc1SC(F)C(=O)N)N 62a_100015186447_100009813875 [0,2,0,0,0,0|1,1,0]=4 4661 B16R1.11453 NC(=O)c1cc(ccc1SC(F)C(=O)[O-])Br 62a_200000162314_100020610796 [0,2,0,0,0,0|0,1,1]=4 4662 B16R1.11453 NC(=O)c1cc(ccc1SC(F)C(=O)[O-])F 62a_100000206434_100020610796 [0,2,0,0,0,0|0,1,1]=4 4663 B16R1.11453 NC(=O)c1cc(ccc1SC(F)C(=O)[O-])F 62a_100020610796_100000206434 [0,2,0,0,0,0|0,1,1]=4 4664 B16R1.11453 NC(=O)c1cc(ccc1SC(F)C(=O)[O-])N 62a_100015186447_100020610796 [0,2,0,0,0,0|0,1,1]=4 4665 B16R1.20139 CC(=O)c1cc(ccc1OCC(=O)N)C#N 34a_100000074817_100000187820 [0,2,0,0,0,0|2,0,0]=4 4666 B16R1.20139 CC(=O)c1cc(ccc1OCC(=O)N)C#N 7a_100000074817_100000187820 [0,2,0,0,0,0|2,0,0]=4 4667 B16R1.20139 CC(=O)c1cc(ccc1OCC(=O)[O-])C#N 34a_100000074817_100020667443 [0,2,0,0,0,0|1,0,1]=4 4668 B16R1.20139 CCc1ccc(c(c1)C(=O)C)OCC(=O)N 34a_100000230022_100000187820 [0,2,0,0,0,0|2,0,0]=4 4669 B16R1.20139 CCc1ccc(c(c1)C(=O)C)OCC(=O)N 7a_100000230022_100000187820 [0,2,0,0,0,0|2,0,0]=4 4670 B16R1.20139 CCc1ccc(c(c1)C(=O)C)OCC(=O)[O-] 34a_100000230022_100020667443 [0,2,0,0,0,0|1,0,1]=4 4671 B16R1.20139 CCc1ccc(c(c1)C(=O)N)NCC(=O)N 34a_100014932089_100000187820 [0,2,0,0,0,0|2,0,0]=4 4672 B16R1.20139 CCc1ccc(c(c1)C(=O)N)NCC(=O)N 7a_100014932089_100000187820 [0,2,0,0,0,0|2,0,0]=4 4673 B16R1.20139 CCc1ccc(c(c1)C(=O)N)NCC(=O)[O-] 34a_100014932089_100020667443 [0,2,0,0,0,0|1,0,1]=4 4674 B16R1.20139 COc1ccc(c(c1)C(=O)C)OCC(=O)N 34a_100000211518_100000187820 [0,2,0,0,0,0|2,0,0]=4 4675 B16R1.20139 COc1ccc(c(c1)C(=O)C)OCC(=O)N 7a_100000211518_100000187820 [0,2,0,0,0,0|2,0,0]=4 4676 B16R1.20139 COc1ccc(c(c1)C(=O)C)OCC(=O)[O-] 34a_100000211518_100020667443 [0,2,0,0,0,0|1,0,1]=4 4677 B16R1.20139 COc1ccc(c(c1)C(=O)N)NCC(=O)N 34a_100011380456_100000187820 [0,2,0,0,0,0|2,0,0]=4 4678 B16R1.20139 COc1ccc(c(c1)C(=O)N)NCC(=O)[O-] 34a_100011380456_100020667443 [0,2,0,0,0,0|1,0,1]=4 4679 B16R1.20139 COc1ccc(c(c1)C(=O)N)SCC(=O)N 62a_100000162014_100000747473 [0,2,0,0,0,0|1,1,0]=4 4680 B16R1.20139 COc1ccc(c(c1)C(=O)N)SCC(=O)[O-] 62a_100000162014_100020667443 [0,2,0,0,0,0|0,1,1]=4 4681 B16R1.11435 CC(=O)C(C)Nc1cc(ccc1C(=O)N)Br 7a_100012349972_100000179758 [0,2,0,0,0,0|2,0,0]=4 4682 B16R1.11435 CC(=O)C(C)Nc1cc(ccc1C(=O)N)C 7a_100011219537_100000179758 [0,2,0,0,0,0|2,0,0]=4 4683 B16R1.11435 CC(=O)C(C)Nc1cc(ccc1C(=O)N)Cl 7a_100000738103_100000179758 [0,2,0,0,0,0|2,0,0]=4 4684 B16R1.11435 CC(=O)C(C)Oc1cc(ccc1C(=O)N)Br 7a_100011550861_100000179758 [0,2,0,0,0,0|1,0,0]=3 4685 B16R1.11435 CC(=O)C(C)Oc1cc(ccc1C(=O)N)C 7a_100000192831_100000179758 [0,2,0,0,0,0|1,0,0]=3 4686 B16R1.11435 CC(=O)C(C)Oc1cc(ccc1C(=O)N)Cl 7a_100000192836_100000179758 [0,2,0,0,0,0|1,0,0]=3 4687 B16R1.11435 CC(=O)C(C)Oc1cc(ccc1C(=O)N)N 7a_100000223280_100000179758 [0,2,0,0,0,0|1,0,0]=3 4688 B16R1.11435 CC(=O)C(C)Sc1cc(ccc1C(=O)N)Br 62a_100009815748_100009814033 [0,2,0,0,0,0|1,1,0]=4 4689 B16R1.11435 CC(=O)C(C)Sc1cc(ccc1C(=O)N)F 62a_100000206404_100009814033 [0,2,0,0,0,0|1,1,0]=4 4690 B16R1.11435 CC(=O)C(C)Sc1cc(ccc1C(=O)N)F 62a_100009814033_100000206404 [0,2,0,0,0,0|1,1,0]=4 4691 B16R1.11435 CC(=O)c1ccc(cc1OC(C)C(=O)C)Br 7a_100000188348_100000179758 [0,2,0,0,0,0|2,0,0]=4 4692 B16R1.11435 CC(=O)c1ccc(cc1OC(C)C(=O)C)C 7a_100000234885_100000179758 [0,2,0,0,0,0|2,0,0]=4 4693 B16R1.11435 CC(=O)c1ccc(cc1OC(C)C(=O)C)Cl 7a_100000061402_100000179758 [0,2,0,0,0,0|2,0,0]=4 4694 B16R1.11435 CC(=O)c1ccc(cc1OC(C)C(=O)C)F 7a_100011215782_100000179758 [0,2,0,0,0,0|2,0,0]=4 4695 B16R1.11435 CC(=O)c1ccc(cc1OC(C)C(=O)N)Br 7a_100000188348_100000702099 [0,2,0,0,0,0|2,0,0]=4 4696 B16R1.11435 CC(=O)c1ccc(cc1OC(C)C(=O)N)C 34a_100000234885_100000702099 [0,2,0,0,0,0|2,0,0]=4 4697 B16R1.11435 CC(=O)c1ccc(cc1OC(C)C(=O)N)C 7a_100000234885_100000702099 [0,2,0,0,0,0|2,0,0]=4 4698 B16R1.11435 CC(=O)c1ccc(cc1OC(C)C(=O)N)Cl 34a_100000061402_100000702099 [0,2,0,0,0,0|2,0,0]=4 4699 B16R1.11435 CC(=O)c1ccc(cc1OC(C)C(=O)N)Cl 7a_100000061402_100000702099 [0,2,0,0,0,0|2,0,0]=4 4700 B16R1.11435 CC(=O)c1ccc(cc1OC(C)C(=O)N)F 7a_100011215782_100000702099 [0,2,0,0,0,0|2,0,0]=4 4701 B16R1.11435 CC(=O)c1ccc(cc1OC(F)C(=O)N)Br 7a_100000188348_100009813875 [0,2,0,0,0,0|2,0,0]=4 4702 B16R1.11435 CC(=O)c1ccc(cc1OC(F)C(=O)N)C 34a_100000234885_100009813875 [0,2,0,0,0,0|2,0,0]=4 4703 B16R1.11435 CC(=O)c1ccc(cc1OC(F)C(=O)N)C 7a_100000234885_100009813875 [0,2,0,0,0,0|2,0,0]=4 4704 B16R1.11435 CC(=O)c1ccc(cc1OC(F)C(=O)N)Cl 34a_100000061402_100009813875 [0,2,0,0,0,0|2,0,0]=4 4705 B16R1.11435 CC(=O)c1ccc(cc1OC(F)C(=O)N)Cl 7a_100000061402_100009813875 [0,2,0,0,0,0|2,0,0]=4 4706 B16R1.11435 CC(=O)c1ccc(cc1OC(F)C(=O)N)F 7a_100011215782_100009813875 [0,2,0,0,0,0|2,0,0]=4 4707 B16R1.11435 CC(=O)c1ccc(cc1OC(F)C(=O)[O-])C 34a_100000234885_100020610796 [0,2,0,0,0,0|1,0,1]=4 4708 B16R1.11435 CC(=O)c1ccc(cc1OC(F)C(=O)[O-])Cl 34a_100000061402_100020610796 [0,2,0,0,0,0|1,0,1]=4 4709 B16R1.11435 CC(Nc1cc(ccc1C(=O)N)Br)C(=O)N 7a_100012349972_100000702099 [0,2,0,0,0,0|2,0,0]=4 4710 B16R1.11435 CC(Nc1cc(ccc1C(=O)N)Cl)C(=O)N 34a_100000738103_100000702099 [0,2,0,0,0,0|2,0,0]=4 4711 B16R1.11435 CC(Nc1cc(ccc1C(=O)N)Cl)C(=O)N 7a_100000738103_100000702099 [0,2,0,0,0,0|2,0,0]=4 4712 B16R1.11435 CC(Nc1cc(ccc1C(=O)N)F)C(=O)N 34a_100011298637_100000702099 [0,2,0,0,0,0|2,0,0]=4 4713 B16R1.11435 CC(Oc1cc(ccc1C(=O)N)Br)C(=O)N 34a_100011550861_100000702099 [0,2,0,0,0,0|1,0,0]=3 4714 B16R1.11435 CC(Oc1cc(ccc1C(=O)N)Br)C(=O)N 7a_100011550861_100000702099 [0,2,0,0,0,0|1,0,0]=3 4715 B16R1.11435 CC(Oc1cc(ccc1C(=O)N)Cl)C(=O)N 34a_100000192836_100000702099 [0,2,0,0,0,0|1,0,0]=3 4716 B16R1.11435 CC(Oc1cc(ccc1C(=O)N)Cl)C(=O)N 7a_100000192836_100000702099 [0,2,0,0,0,0|1,0,0]=3 4717 B16R1.11435 CC(Oc1cc(ccc1C(=O)N)N)C(=O)N 34a_100000223280_100000702099 [0,2,0,0,0,0|1,0,0]=3 4718 B16R1.11435 CC(Oc1cc(ccc1C(=O)N)N)C(=O)N 7a_100000223280_100000702099 [0,2,0,0,0,0|1,0,0]=3 4719 B16R1.11435 CC(Sc1cc(ccc1C(=O)N)Br)C(=O)N 62a_100009815748_100000702099 [0,2,0,0,0,0|1,1,0]=4 4720 B16R1.11435 CC(Sc1cc(ccc1C(=O)N)F)C(=O)N 62a_100000206404_100000702099 [0,2,0,0,0,0|1,1,0]=4 4721 B16R1.11435 CC(Sc1cc(ccc1C(=O)N)F)C(=O)N 62a_100000702099_100000206404 [0,2,0,0,0,0|1,1,0]=4 4722 B16R1.11435 C[C@@H](Nc1cc(ccc1C(=O)N)Br)C(=O)N 27a_100000119354_100009815748 [0,2,0,0,0,0|2,0,0]=4 4723 B16R1.11435 C[C@@H](Nc1cc(ccc1C(=O)N)F)C(=O)N 27a_100000119354_100000206404 [0,2,0,0,0,0|2,0,0]=4 4724 B16R1.11435 Cc1ccc(c(c1)NC(C)C(=O)N)C(=O)N 34a_100011219537_100000702099 [0,2,0,0,0,0|2,0,0]=4 4725 B16R1.11435 Cc1ccc(c(c1)NC(C)C(=O)N)C(=O)N 7a_100011219537_100000702099 [0,2,0,0,0,0|2,0,0]=4 4726 B16R1.11435 Cc1ccc(c(c1)NC(F)C(=O)N)C(=O)N 34a_100011219537_100009813875 [0,2,0,0,0,0|2,0,0]=4 4727 B16R1.11435 Cc1ccc(c(c1)NC(F)C(=O)N)C(=O)N 7a_100011219537_100009813875 [0,2,0,0,0,0|2,0,0]=4 4728 B16R1.11435 Cc1ccc(c(c1)NC(F)C(=O)[O-])C(=O)N 34a_100011219537_100020610796 [0,2,0,0,0,0|1,0,1]=4 4729 B16R1.11435 Cc1ccc(c(c1)OC(C)C(=O)N)C(=O)N 34a_100000192831_100000702099 [0,2,0,0,0,0|1,0,0]=3 4730 B16R1.11435 Cc1ccc(c(c1)OC(C)C(=O)N)C(=O)N 7a_100000192831_100000702099 [0,2,0,0,0,0|1,0,0]=3 4731 B16R1.11435 Cc1ccc(c(c1)OC(F)C(=O)N)C(=O)N 34a_100000192831_100009813875 [0,2,0,0,0,0|1,0,0]=3 4732 B16R1.11435 Cc1ccc(c(c1)OC(F)C(=O)N)C(=O)N 7a_100000192831_100009813875 [0,2,0,0,0,0|1,0,0]=3 4733 B16R1.11435 Cc1ccc(c(c1)OC(F)C(=O)[O-])C(=O)N 34a_100000192831_100020610796 [0,2,0,0,0,0|0,0,1]=3 4734 B16R1.11435 NC(=O)c1ccc(cc1NC(F)C(=O)N)Br 7a_100012349972_100009813875 [0,2,0,0,0,0|2,0,0]=4 4735 B16R1.11435 NC(=O)c1ccc(cc1NC(F)C(=O)N)Cl 34a_100000738103_100009813875 [0,2,0,0,0,0|2,0,0]=4 4736 B16R1.11435 NC(=O)c1ccc(cc1NC(F)C(=O)N)Cl 7a_100000738103_100009813875 [0,2,0,0,0,0|2,0,0]=4 4737 B16R1.11435 NC(=O)c1ccc(cc1NC(F)C(=O)N)F 34a_100011298637_100009813875 [0,2,0,0,0,0|2,0,0]=4 4738 B16R1.11435 NC(=O)c1ccc(cc1NC(F)C(=O)[O-])Cl 34a_100000738103_100020610796 [0,2,0,0,0,0|1,0,1]=4 4739 B16R1.11435 NC(=O)c1ccc(cc1NC(F)C(=O)[O-])F 34a_100011298637_100020610796 [0,2,0,0,0,0|1,0,1]=4 4740 B16R1.11435 NC(=O)c1ccc(cc1OC(F)C(=O)N)Br 34a_100011550861_100009813875 [0,2,0,0,0,0|1,0,0]=3 4741 B16R1.11435 NC(=O)c1ccc(cc1OC(F)C(=O)N)Br 7a_100011550861_100009813875 [0,2,0,0,0,0|1,0,0]=3 4742 B16R1.11435 NC(=O)c1ccc(cc1OC(F)C(=O)N)Cl 34a_100000192836_100009813875 [0,2,0,0,0,0|1,0,0]=3 4743 B16R1.11435 NC(=O)c1ccc(cc1OC(F)C(=O)N)Cl 7a_100000192836_100009813875 [0,2,0,0,0,0|1,0,0]=3 4744 B16R1.11435 NC(=O)c1ccc(cc1OC(F)C(=O)N)N 34a_100000223280_100009813875 [0,2,0,0,0,0|1,0,0]=3 4745 B16R1.11435 NC(=O)c1ccc(cc1OC(F)C(=O)N)N 7a_100000223280_100009813875 [0,2,0,0,0,0|1,0,0]=3 4746 B16R1.11435 NC(=O)c1ccc(cc1OC(F)C(=O)[O-])Br 34a_100011550861_100020610796 [0,2,0,0,0,0|0,0,1]=3 4747 B16R1.11435 NC(=O)c1ccc(cc1OC(F)C(=O)[O-])Cl 34a_100000192836_100020610796 [0,2,0,0,0,0|0,0,1]=3 4748 B16R1.11435 NC(=O)c1ccc(cc1OC(F)C(=O)[O-])N 34a_100000223280_100020610796 [0,2,0,0,0,0|0,0,1]=3 4749 B16R1.11435 NC(=O)c1ccc(cc1SC(F)C(=O)N)Br 62a_100009815748_100009813875 [0,2,0,0,0,0|1,1,0]=4 4750 B16R1.11435 NC(=O)c1ccc(cc1SC(F)C(=O)N)F 62a_100000206404_100009813875 [0,2,0,0,0,0|1,1,0]=4 4751 B16R1.11435 NC(=O)c1ccc(cc1SC(F)C(=O)N)F 62a_100009813875_100000206404 [0,2,0,0,0,0|1,1,0]=4 4752 B16R1.11435 NC(=O)c1ccc(cc1SC(F)C(=O)[O-])Br 62a_100009815748_100020610796 [0,2,0,0,0,0|0,1,1]=4 4753 B16R1.11435 NC(=O)c1ccc(cc1SC(F)C(=O)[O-])F 62a_100000206404_100020610796 [0,2,0,0,0,0|0,1,1]=4 4754 B16R1.11435 NC(=O)c1ccc(cc1SC(F)C(=O)[O-])F 62a_100020610796_100000206404 [0,2,0,0,0,0|0,1,1]=4 4755 B16R1.20203 C=C(C)COc1cc(ccc1C(=O)N)OC 34a_100000185031_100000748629 [0,2,0,0,0,0|2,0,0]=4 4756 B16R1.20203 C=C(C)COc1cc(ccc1C(=O)N)OC 7a_100000185031_100000748629 [0,2,0,0,0,0|2,0,0]=4 4757 B16R1.20203 C=C(F)COc1cc(ccc1C(=O)N)OC 34a_100000185031_100009893438 [0,2,0,0,0,0|2,0,0]=4 4758 B16R1.20203 C=C(F)COc1cc(ccc1C(=O)N)OC 7a_100000185031_100000042424 [0,2,0,0,0,0|2,0,0]=4 4759 B16R1.20203 COc1ccc(c(c1)OCC(=O)N)C(=O)C 34a_100000185565_100000187820 [0,2,0,0,0,0|2,0,0]=4 4760 B16R1.20203 COc1ccc(c(c1)OCC(=O)N)C(=O)C 7a_100000185565_100000187820 [0,2,0,0,0,0|2,0,0]=4 4761 B16R1.20203 COc1ccc(c(c1)OCC(=O)N)C(=O)N 34a_100000185031_100000187820 [0,2,0,0,0,0|1,0,0]=3 4762 B16R1.20203 COc1ccc(c(c1)OCC(=O)N)C(=O)N 7a_100000185031_100000187820 [0,2,0,0,0,0|1,0,0]=3 4763 B16R1.20203 COc1ccc(c(c1)OCC(=O)[O-])C(=O)C 34a_100000185565_100020667443 [0,2,0,0,0,0|1,0,1]=4 4764 B16R1.20203 COc1ccc(c(c1)OCC(=O)[O-])C(=O)N 34a_100000185031_100020667443 [0,2,0,0,0,0|0,0,1]=3 4765 B16R1.20203 COc1ccc(c(c1)OCC(C)O)C(=O)N 34a_100000185031_100011218427 [0,2,0,0,0,0|1,0,1]=4 4766 B16R1.20203 COc1ccc(c(c1)OCC(C)O)C(=O)N 7a_100000185031_100011218427 [0,2,0,0,0,0|1,0,1]=4 4767 B16R1.20203 COc1ccc(c(c1)OC[C@@H](C)O)C(=O)N 34a_100000185031_100009817552 [0,2,0,0,0,0|1,0,1]=4 4768 B16R1.20203 COc1ccc(c(c1)OC[C@@H](C)O)C(=O)N 7a_100000185031_100009817552 [0,2,0,0,0,0|1,0,1]=4 4769 B16R1.20203 COc1ccc(c(c1)OC[N+](=O)[O-])C(=O)N 34a_100000185031_100000761209 [0,2,0,0,0,0|1,0,1]=4 4770 B16R1.20203 COc1ccc(c(c1)SCC(=O)N)C(=O)N 62a_200009815664_100000747473 [0,2,0,0,0,0|1,1,0]=4 4771 B16R1.20203 COc1ccc(c(c1)SCC(=O)[O-])C(=O)N 62a_200009815664_100020667443 [0,2,0,0,0,0|0,1,1]=4 4772 B16R1.773 CCC(Nc1ccccc1C(=O)N)C(=O)N 34a_100000185089_100000750255 [0,2,0,0,0,0|2,0,0]=4 4773 B16R1.773 CCC(Oc1ccccc1C(=O)N)C(=O)N 34a_100000192804_100000750255 [0,2,0,0,0,0|1,0,0]=3 4774 B16R1.773 CCC(Oc1ccccc1C(=O)N)C(=O)N 7a_100000192804_100000750255 [0,2,0,0,0,0|1,0,0]=3 4775 B16R1.773 CCC(Oc1ccccc1C(=O)[O-])C(=O)N 7a_100015234032_100000750255 [0,2,0,0,0,0|2,0,0]=4 4776 B16R1.773 CCC(Oc1ccccc1C(=S)N)C(=O)N 7a_100000745089_100000750255 [0,2,0,0,0,0|1,1,0]=4 4777 B16R1.773 CCC(Oc1cccnc1C(=O)N)C(=O)N 34a_200011215183_100000750255 [0,2,0,0,0,0|2,0,0]=4 4778 B16R1.773 CCC(Oc1cccnc1C(=O)N)C(=O)N 7a_200011215183_100000750255 [0,2,0,0,0,0|2,0,0]=4 4779 B16R1.773 CCC(Oc1ccncc1C(=O)N)C(=O)N 34a_200011998761_100000750255 [0,2,0,0,0,0|2,0,0]=4 4780 B16R1.773 CCC(Oc1cnccc1C(=O)N)C(=O)N 7a_100012022987_100000750255 [0,2,0,0,0,0|2,0,0]=4 4781 B16R1.773 CCC(Sc1ccccc1C(=O)N)C(=O)N 62a_100000162227_100000750255 [0,2,0,0,0,0|1,1,0]=4 4782 B16R1.773 CCC(Sc1ccccc1C(=O)N)C(=O)N 62a_100000750255_100000162227 [0,2,0,0,0,0|1,1,0]=4 4783 B16R1.58506 CC(=O)C(C)(C)Oc1ccccc1C(=O)N 7a_100000192804_100000075568 [0,2,0,0,0,0|1,0,0]=3 4784 B16R1.58506 CC(=O)C(C)(C)Oc1ccccc1C(=O)[O-] 7a_100015234032_100000075568 [0,2,0,0,0,0|2,0,0]=4 4785 B16R1.58506 CC(=O)C(C)(C)Oc1ccccc1C(=S)N 7a_100000745089_100000075568 [0,2,0,0,0,0|1,1,0]=4 4786 B16R1.58506 CC(=O)C(C)(C)Oc1cccnc1C(=O)N 7a_200011215183_100000075568 [0,2,0,0,0,0|2,0,0]=4 4787 B16R1.58506 CC(=O)C(C)(C)Oc1cnccc1C(=O)N 7a_100012022987_100000075568 [0,2,0,0,0,0|2,0,0]=4 4788 B16R1.58506 CC(=O)C(C)(C)Sc1ccccc1C(=O)N 62a_100000075568_100000162227 [0,2,0,0,0,0|1,1,0]=4 4789 B16R1.58506 CC(=O)C(C)(C)Sc1ccccc1C(=O)N 62a_100000162227_100000075568 [0,2,0,0,0,0|1,1,0]=4 4790 B16R1.58506 CC(C)(Nc1ccccc1C(=O)N)C(=O)N 34a_100000185089_100000702505 [0,2,0,0,0,0|2,0,0]=4 4791 B16R1.58506 CC(C)(Oc1ccccc1C(=O)N)C(=O)N 34a_100000192804_100000702505 [0,2,0,0,0,0|1,0,0]=3 4792 B16R1.58506 CC(C)(Oc1ccccc1C(=O)N)C(=O)N 7a_100000192804_100000702505 [0,2,0,0,0,0|1,0,0]=3 4793 B16R1.58506 CC(C)(Oc1ccccc1C(=O)[O-])C(=O)N 7a_100015234032_100000702505 [0,2,0,0,0,0|2,0,0]=4 4794 B16R1.58506 CC(C)(Oc1ccccc1C(=S)N)C(=O)N 7a_100000745089_100000702505 [0,2,0,0,0,0|1,1,0]=4 4795 B16R1.58506 CC(C)(Oc1cccnc1C(=O)N)C(=O)N 34a_200011215183_100000702505 [0,2,0,0,0,0|2,0,0]=4 4796 B16R1.58506 CC(C)(Oc1cccnc1C(=O)N)C(=O)N 7a_200011215183_100000702505 [0,2,0,0,0,0|2,0,0]=4 4797 B16R1.58506 CC(C)(Oc1ccncc1C(=O)N)C(=O)N 34a_200011998761_100000702505 [0,2,0,0,0,0|2,0,0]=4 4798 B16R1.58506 CC(C)(Oc1cnccc1C(=O)N)C(=O)N 7a_100012022987_100000702505 [0,2,0,0,0,0|2,0,0]=4 4799 B16R1.58506 CC(C)(Sc1ccccc1C(=O)N)C(=O)N 62a_100000162227_100000702505 [0,2,0,0,0,0|1,1,0]=4 4800 B16R1.58506 CC(C)(Sc1ccccc1C(=O)N)C(=O)N 62a_100000702505_100000162227 [0,2,0,0,0,0|1,1,0]=4 4801 B16R1.58506 NC(=O)C(F)(F)Oc1ccccc1C(=O)[O-] 7a_100015234032_100009811971 [0,2,0,0,0,0|2,0,0]=4 4802 B16R1.58506 NC(=O)C(F)(F)Oc1ccccc1C(=S)N 7a_100000745089_100009811971 [0,2,0,0,0,0|1,1,0]=4 4803 B16R1.58506 NC(=O)c1ccccc1NC(F)(F)C(=O)[O-] 34a_100000185089_100020612412 [0,2,0,0,0,0|1,0,1]=4 4804 B16R1.58506 NC(=O)c1ccccc1OC(F)(F)C(=O)N 7a_100000192804_100009811971 [0,2,0,0,0,0|1,0,0]=3 4805 B16R1.58506 NC(=O)c1ccccc1OC(F)(F)C(=O)[O-] 34a_100000192804_100020612412 [0,2,0,0,0,0|0,0,1]=3 4806 B16R1.58506 NC(=O)c1ccccc1SC(F)(F)C(=O)N 62a_100000162227_100009811971 [0,2,0,0,0,0|1,1,0]=4 4807 B16R1.58506 NC(=O)c1ccccc1SC(F)(F)C(=O)N 62a_100009811971_100000162227 [0,2,0,0,0,0|1,1,0]=4 4808 B16R1.58506 NC(=O)c1ccccc1SC(F)(F)C(=O)[O-] 62a_100000162227_100000745680 [0,2,0,0,0,0|0,1,1]=4 4809 B16R1.58506 NC(=O)c1ccccc1SC(F)(F)C(=O)[O-] 62a_100000745680_100000162227 [0,2,0,0,0,0|0,1,1]=4 4810 B16R1.58506 NC(=O)c1ccncc1OC(F)(F)C(=O)N 7a_100012022987_100009811971 [0,2,0,0,0,0|2,0,0]=4 4811 B16R1.58506 NC(=O)c1cnccc1OC(F)(F)C(=O)[O-] 34a_200011998761_100020612412 [0,2,0,0,0,0|1,0,1]=4 4812 B16R1.58506 NC(=O)c1ncccc1OC(F)(F)C(=O)N 7a_200011215183_100009811971 [0,2,0,0,0,0|2,0,0]=4 4813 B16R1.58506 NC(=O)c1ncccc1OC(F)(F)C(=O)[O-] 34a_200011215183_100020612412 [0,2,0,0,0,0|1,0,1]=4 4814 B14R2.450 CC(=O)C1Cc2ccccc2C1=O 1458a_100000070787_100011218503 [1,0,0,1,0,0|2,0,0]=4 4815 B14R2.1073 C=Cc1cccc2c1CCC(=O)O2 271570a_100011290941_200015620928 [1,0,0,1,0,0|2,0,0]=4 4816 B14R2.1073 C=Cc1cccc2c1OCC(=O)N2 271570a_100011290941_100012355675 [1,0,0,1,0,0|2,0,0]=4 4817 B14R2.4 C=C(C)c1cccc2c1OCC2=O 271570a_100000694244_100011230590 [1,0,0,1,0,0|2,0,0]=4 4818 B14R2.9513 NC(=O)c1ccccc1OC2CC2 34a_100000192804_100000211595 [1,0,0,1,0,0|1,0,1]=4 4819 B14R2.31359 CC(=O)c1cccc2c1OCCO2 1458a_100000026678_200000210301 [1,0,0,1,0,0|1,0,1]=4 4820 B14R2.31359 [13CH3]C(=O)c1cccc2c1OCCO2 1458a_100000026678_200025704644 [1,0,0,1,0,0|1,0,1]=4 4821 B14R2.25733 CC(=O)C1CC(=O)c2c1cccc2 1458a_100000070787_100010208147 [0,0,0,1,1,0|2,0,0]=4 4822 B16R2.232 Cc1cc2c(cccc2[nH]1)OCC(=O)N 34a_200000059750_100000187820 [0,0,0,1,0,1|2,0,0]=4 4823 B16R2.232 Cc1cc2c(cccc2[nH]1)OCC(=O)[O-] 34a_200000059750_100020667443 [0,0,0,1,0,1|1,0,1]=4 4824 B16R2.232 NC(=O)COc1cccc2c1nc(o2)N 7a_100009892541_100000187820 [0,0,0,1,0,1|1,0,1]=4 4825 B16R2.232 NC(=O)COc1cccc2c1nc(s2)N 7a_100000065795_100000187820 [0,0,0,1,0,1|1,1,0]=4 4826 B16R2.232 NC(=O)CSc1cccc2c1CC(=O)N2 62a_100000747473_100009816812 [0,0,0,1,0,1|1,1,0]=4 4827 B16R2.232 O=C([O-])CSc1cccc2c1CC(=O)N2 62a_100020667443_100009816812 [0,0,0,1,0,1|0,1,1]=4 4828 B16R2.2986 CC(=O)Nc1cccc2c1OCC(=O)N2 11a_100000685337_100015343762 [0,0,0,1,0,1|2,0,0]=4 4829 B16R2.2986 CC(=O)Nc1cccc2c1OCC(=O)N2 1626a_100000685337_100015343762 [0,0,0,1,0,1|2,0,0]=4 4830 B16R2.2986 CC(=O)Nc1cccc2c1OCC(=O)N2 22a_100000685337_100000070787 [0,0,0,1,0,1|2,0,0]=4 4831 B16R2.2986 CC(=O)Nc1cccc2c1OCC(=O)N2 527a_100000685337_100103153847 [0,0,0,1,0,1|2,0,0]=4 4832 B16R2.214 NC(=O)c1ccccc1SC2CC(=O)C2 62a_100009894365_100000162227 [0,0,0,1,0,1|1,1,0]=4 4833 B16R2.2838 NC(=O)c1ccccc1C2=CC(=O)CC2 271570a_100010737933_100000162227 [0,0,0,1,0,1|2,0,0]=4 4834 B16R2.24933 CC(=O)Cc1nc2ccccc2c(=O)[nH]1 1458a_100000070787_100000182789 [0,0,0,1,0,1|2,0,0]=4 4835 B16R2.27522 NC(=O)c1ccccc1OCCC2CO2 34a_100000192804_100000732470 [0,0,0,1,0,1|1,0,1]=4 4836 B16R2.27522 NC(=O)c1ccccc1OCCC2CO2 7a_100000192804_100000732470 [0,0,0,1,0,1|1,0,1]=4 4837 B16R2.104522 O=C(O)CNC1CC(=O)c2c1cccc2 269956a_100016091260_100010208147 [0,0,0,1,0,1|2,0,0]=4 4838 B16R2.104522 O=C(O)CNC1OC(=O)c2c1cccc2 269956a_100016091260_100009813457 [0,0,0,1,0,1|2,0,0]=4 4839 B16R2.27462 CC1(CO1)COc2ccccc2C(=O)N 34a_100000192804_100000760498 [0,1,0,1,0,0|1,0,1]=4 4840 B16R2.24414 CC(=O)Cc1n[nH]c(=O)c2c1cccc2 1458a_100000010072_200000210301 [0,1,0,1,0,0|2,0,0]=4 4841 B16R2.24414 [13CH3]C(=O)Cc1n[nH]c(=O)c2c1cccc2 1458a_100000010072_200025704644 [0,1,0,1,0,0|2,0,0]=4 4842 B16R2.33901 CCC(=O)c1cccc2c1OCC(=O)N2 1458a_100000060354_100000210202 [0,1,0,1,0,0|2,0,0]=4 4843 B16R2.33901 CNC(=O)c1cccc2c1OCC(=O)N2 11a_106832991635_100000060354 [0,1,0,1,0,0|1,0,0]=3 4844 B16R2.33901 CNC(=O)c1cccc2c1OCC(=O)N2 1626a_100102657272_100000060354 [0,1,0,1,0,0|1,0,0]=3 4845 B16R2.33901 CNC(=O)c1cccc2c1OCC(=O)N2 240690a_100102657272_100000060354 [0,1,0,1,0,0|1,0,0]=3 4846 B16R2.33901 CNC(=O)c1cccc2c1OCC(=O)N2 527a_100102657272_100000060354 [0,1,0,1,0,0|1,0,0]=3 4847 B16R2.33901 O=C1COc2c(cccc2C(=O)CF)N1 1458a_100000060354_100015361967 [0,1,0,1,0,0|2,0,0]=4 4848 B16R2.34081 CNC(=O)c1ccccc1OCC2CO2 34a_100000185920_102125554688 [0,1,0,1,0,0|1,0,1]=4 4849 B16R2.34081 CNC(=O)c1ccccc1OCC2CO2 7a_100000185920_102125554688 [0,1,0,1,0,0|1,0,1]=4 4850 B16R2.34081 CNC(=O)c1ccccc1OC[C@@H]2CO2 7a_100000185920_100000745022 [0,1,0,1,0,0|1,0,1]=4 4851 B16R2.34081 NNC(=O)c1ccccc1OCC2CO2 34a_100000186518_102125554688 [0,1,0,1,0,0|1,0,1]=4 4852 B16R2.34081 O=C(NO)c1ccccc1OCC2CO2 34a_100000188472_102125554688 [0,1,0,1,0,0|1,0,1]=4 4853 B16R2.97896 NC(=O)COc1cccc2c1C(=O)CC2 34a_100000066596_100000187820 [0,1,0,1,0,0|2,0,0]=4 4854 B16R2.97896 NC(=O)COc1cccc2c1C(=O)CC2 7a_100000066596_100000187820 [0,1,0,1,0,0|2,0,0]=4 4855 B16R2.97896 NC(=O)COc1cccc2c1C(=O)CO2 34a_200009856558_100000187820 [0,1,0,1,0,0|2,0,0]=4 4856 B16R2.97896 NC(=O)CSc1cccc2c1C(=O)NC2 62a_100000724024_100000747473 [0,1,0,1,0,0|1,1,0]=4 4857 B16R2.97896 NC(=O)CSc1cccc2c1C(=O)NC2 62a_100000747473_100000724024 [0,1,0,1,0,0|1,1,0]=4 4858 B16R2.97896 O=C([O-])COc1cccc2c1C(=O)CC2 34a_100000066596_100020667443 [0,1,0,1,0,0|1,0,1]=4 4859 B16R2.97896 O=C([O-])COc1cccc2c1C(=O)CO2 34a_200009856558_100020667443 [0,1,0,1,0,0|1,0,1]=4 4860 B16R2.97896 O=C([O-])CSc1cccc2c1C(=O)NC2 62a_100000724024_100020667443 [0,1,0,1,0,0|0,1,1]=4 4861 B16R2.97896 O=C([O-])CSc1cccc2c1C(=O)NC2 62a_100020667443_100000724024 [0,1,0,1,0,0|0,1,1]=4 4862 B16R2.3924 NC(=O)c1ccccc1NC2CCC2=O 34a_100000185089_100009892977 [0,1,0,1,0,0|2,0,0]=4 4863 B16R2.3924 NC(=O)c1ccccc1OC2CCC2=O 34a_100000192804_100009892977 [0,1,0,1,0,0|1,0,0]=3 4864 B16R2.3924 NC(=O)c1ccccc1OC2CCC2=O 7a_100000192804_100009892977 [0,1,0,1,0,0|1,0,0]=3 4865 B16R2.3924 NC(=O)c1ccccc1SC2CCC2=O 62a_100000162227_100009892977 [0,1,0,1,0,0|1,1,0]=4 4866 B16R2.3924 NC(=O)c1ccccc1SC2CCC2=O 62a_100009892977_100000162227 [0,1,0,1,0,0|1,1,0]=4 4867 B16R2.3924 NC(=O)c1ccncc1OC2CCC2=O 7a_100012022987_100009892977 [0,1,0,1,0,0|2,0,0]=4 4868 B16R2.3924 NC(=O)c1cnccc1OC2CCC2=O 34a_200011998761_100009892977 [0,1,0,1,0,0|2,0,0]=4 4869 B16R2.3924 NC(=O)c1ncccc1OC2CCC2=O 34a_200011215183_100009892977 [0,1,0,1,0,0|2,0,0]=4 4870 B16R2.3924 NC(=O)c1ncccc1OC2CCC2=O 7a_200011215183_100009892977 [0,1,0,1,0,0|2,0,0]=4 4871 B16R2.3924 NC(=S)c1ccccc1OC2CCC2=O 7a_100000745089_100009892977 [0,1,0,1,0,0|1,1,0]=4 4872 B16R2.3924 O=C([O-])c1ccccc1OC2CCC2=O 7a_100015234032_100009892977 [0,1,0,1,0,0|2,0,0]=4 4873 B16R2.27531 NC(=O)c1ccccc1OCC2CCO2 34a_100000192804_100000103362 [0,1,0,1,0,0|1,0,1]=4 4874 B16R2.27531 NC(=O)c1ccccc1OCC2CCO2 7a_100000192804_100000103362 [0,1,0,1,0,0|1,0,1]=4 4875 B16R2.27531 NC(=O)c1ccccc1OCC2COC2 34a_100000192804_100010264016 [0,1,0,1,0,0|1,0,1]=4 4876 B16R2.27531 NC(=O)c1ccccc1OCC2COC2 7a_100000192804_100010264016 [0,1,0,1,0,0|1,0,1]=4 4877 B16R2.33556 CCC(=O)CC1NC(=O)c2c1cccc2 1458a_100000066322_100000210202 [0,1,0,1,0,0|2,0,0]=4 4878 B16R2.33556 CNC(=O)CC1NC(=O)c2c1cccc2 11a_106832991635_100000066322 [0,1,0,1,0,0|2,0,0]=4 4879 B16R2.33556 CNC(=O)CC1NC(=O)c2c1cccc2 1626a_100102657272_100000066322 [0,1,0,1,0,0|2,0,0]=4 4880 B16R2.33556 CNC(=O)CC1NC(=O)c2c1cccc2 240690a_100102657272_100000066322 [0,1,0,1,0,0|2,0,0]=4 4881 B16R2.33556 CNC(=O)CC1NC(=O)c2c1cccc2 527a_100102657272_100000066322 [0,1,0,1,0,0|2,0,0]=4 4882 B16R2.33556 O=C(CF)CC1NC(=O)c2c1cccc2 1458a_100000066322_100015361967 [0,1,0,1,0,0|2,0,0]=4 4883 B16R2.33556 O=C(CO)NC1NC(=O)c2c1cccc2 240690a_100016086272_100000210174 [0,1,0,1,0,0|2,0,0]=4 4884 B16R2.33556 O=C(CO)NC1NC(=O)c2c1cccc2 527a_100016086272_100000210174 [0,1,0,1,0,0|2,0,0]=4 4885 B16R2.25780 NC(=O)c1cccc(c1OCC2CO2)Cl 34a_100009868166_102125554688 [0,1,0,1,0,0|1,0,1]=4 4886 B16R2.25780 NC(=O)c1cccc(c1OCC2CO2)Cl 7a_100009868166_102125554688 [0,1,0,1,0,0|1,0,1]=4 4887 B16R2.25780 NC(=O)c1cccc(c1OCC2CO2)F 34a_100009886295_102125554688 [0,1,0,1,0,0|1,0,1]=4 4888 B16R2.25780 NC(=O)c1cccc(c1OCC2CO2)F 7a_100009886295_102125554688 [0,1,0,1,0,0|1,0,1]=4 4889 B16R2.25780 NC(=O)c1cccc(c1OC[C@@H]2CO2)Cl 7a_100009868166_100000745022 [0,1,0,1,0,0|1,0,1]=4 4890 B16R2.25780 NC(=O)c1cccc(c1OC[C@@H]2CO2)F 7a_100009886295_100000745022 [0,1,0,1,0,0|1,0,1]=4 4891 B16R2.136422 NC(=O)c1c(cccc1OCC2CO2)F 34a_100000701607_102125554688 [0,1,0,1,0,0|1,0,1]=4 4892 B16R2.136422 NC(=O)c1c(cccc1OCC2CO2)F 7a_100000701607_102125554688 [0,1,0,1,0,0|1,0,1]=4 4893 B16R2.136422 NC(=O)c1c(cccc1OC[C@@H]2CO2)F 7a_100000701607_100000745022 [0,1,0,1,0,0|1,0,1]=4 4894 B16R2.138130 Cc1ccc(c(c1)C(=O)N)OCC2CO2 34a_200000192840_102125554688 [0,1,0,1,0,0|1,0,1]=4 4895 B16R2.138130 Cc1ccc(c(c1)C(=O)N)OCC2CO2 7a_200000192840_102125554688 [0,1,0,1,0,0|1,0,1]=4 4896 B16R2.138130 Cc1ccc(c(c1)C(=O)N)OC[C@@H]2CO2 7a_200000192840_100000745022 [0,1,0,1,0,0|1,0,1]=4 4897 B16R2.138130 NC(=O)c1cc(ccc1OCC2CO2)Br 34a_100000192807_102125554688 [0,1,0,1,0,0|1,0,1]=4 4898 B16R2.138130 NC(=O)c1cc(ccc1OCC2CO2)Br 7a_100000192807_102125554688 [0,1,0,1,0,0|1,0,1]=4 4899 B16R2.138130 NC(=O)c1cc(ccc1OCC2CO2)Cl 34a_100000185026_102125554688 [0,1,0,1,0,0|1,0,1]=4 4900 B16R2.138130 NC(=O)c1cc(ccc1OCC2CO2)Cl 7a_100000185026_102125554688 [0,1,0,1,0,0|1,0,1]=4 4901 B16R2.138130 NC(=O)c1cc(ccc1OCC2CO2)F 34a_100012186459_102125554688 [0,1,0,1,0,0|1,0,1]=4 4902 B16R2.138130 NC(=O)c1cc(ccc1OCC2CO2)F 7a_100012186459_102125554688 [0,1,0,1,0,0|1,0,1]=4 4903 B16R2.138130 NC(=O)c1cc(ccc1OCC2CO2)I 34a_100000192813_102125554688 [0,1,0,1,0,0|1,0,1]=4 4904 B16R2.138130 NC(=O)c1cc(ccc1OCC2CO2)I 7a_100000192813_102125554688 [0,1,0,1,0,0|1,0,1]=4 4905 B16R2.138130 NC(=O)c1cc(ccc1OC[C@@H]2CO2)Br 7a_100000192807_100000745022 [0,1,0,1,0,0|1,0,1]=4 4906 B16R2.138130 NC(=O)c1cc(ccc1OC[C@@H]2CO2)Cl 7a_100000185026_100000745022 [0,1,0,1,0,0|1,0,1]=4 4907 B16R2.138130 NC(=O)c1cc(ccc1OC[C@@H]2CO2)F 7a_100012186459_100000745022 [0,1,0,1,0,0|1,0,1]=4 4908 B16R2.138130 NC(=O)c1cc(ccc1OC[C@@H]2CO2)I 7a_100000192813_100000745022 [0,1,0,1,0,0|1,0,1]=4 4909 B16R2.12625 Cc1ccc(c(c1)OCC2CO2)C(=O)N 34a_100000192831_102125554688 [0,1,0,1,0,0|1,0,1]=4 4910 B16R2.12625 Cc1ccc(c(c1)OCC2CO2)C(=O)N 7a_100000192831_102125554688 [0,1,0,1,0,0|1,0,1]=4 4911 B16R2.12625 Cc1ccc(c(c1)OC[C@@H]2CO2)C(=O)N 7a_100000192831_100000745022 [0,1,0,1,0,0|1,0,1]=4 4912 B16R2.12625 NC(=O)c1ccc(cc1OCC2CO2)Br 34a_100011550861_102125554688 [0,1,0,1,0,0|1,0,1]=4 4913 B16R2.12625 NC(=O)c1ccc(cc1OCC2CO2)Br 7a_100011550861_102125554688 [0,1,0,1,0,0|1,0,1]=4 4914 B16R2.12625 NC(=O)c1ccc(cc1OCC2CO2)Cl 34a_100000192836_102125554688 [0,1,0,1,0,0|1,0,1]=4 4915 B16R2.12625 NC(=O)c1ccc(cc1OCC2CO2)Cl 7a_100000192836_102125554688 [0,1,0,1,0,0|1,0,1]=4 4916 B16R2.12625 NC(=O)c1ccc(cc1OCC2CO2)N 34a_100000223280_102125554688 [0,1,0,1,0,0|1,0,1]=4 4917 B16R2.12625 NC(=O)c1ccc(cc1OCC2CO2)N 7a_100000223280_102125554688 [0,1,0,1,0,0|1,0,1]=4 4918 B16R2.12625 NC(=O)c1ccc(cc1OC[C@@H]2CO2)Br 7a_100011550861_100000745022 [0,1,0,1,0,0|1,0,1]=4 4919 B16R2.12625 NC(=O)c1ccc(cc1OC[C@@H]2CO2)Cl 7a_100000192836_100000745022 [0,1,0,1,0,0|1,0,1]=4 4920 B16R2.12625 NC(=O)c1ccc(cc1OC[C@@H]2CO2)N 7a_100000223280_100000745022 [0,1,0,1,0,0|1,0,1]=4 4921 B16R2.223 CC(=O)c1cccc2c1OC(C(=O)N2)C 1458a_100000060355_200000210301 [0,1,0,1,0,0|2,0,0]=4 4922 B16R2.223 CC1Oc2c(cccc2C(=O)[13CH3])NC1=O 1458a_100000060355_200025704644 [0,1,0,1,0,0|2,0,0]=4 4923 B12R1.75 C=Cc1ccccc1CC(=O)C 271570a_100011290941_100011350739 [1,0,0,0,1,0|2,0,0]=4 4924 B12R1.75 C=Cc1ccccc1CC(=O)N 271570a_100011290941_200009814924 [1,0,0,0,1,0|2,0,0]=4 4925 B12R1.75 C=Cc1ccccc1OC(=O)C 271570a_100011290941_100000051690 [1,0,0,0,1,0|2,0,0]=4 4926 B12R1.75 CC(=O)Cc1ccccc1C=O 1458a_100000070787_200009853537 [1,0,0,0,1,0|1,0,0]=3 4927 B12R1.386 NC(=O)c1cscc1SCC=O 62a_100009817205_200015260668 [1,0,0,0,1,0|1,1,0]=4 4928 B12R1.386 NC(=O)c1cscc1SCC=O 62a_200015260668_100009817205 [1,0,0,0,1,0|1,1,0]=4 4929 B12R1.261 C=C(C)c1ccccc1C(=O)N 271570a_100000694244_100000162227 [0,0,0,0,2,0|2,0,0]=4 4930 B14R1.96 C=C(C)COCc1ccccc1C=O 34a_100000210245_200009853537 [1,0,0,0,0,1|2,0,0]=4 4931 B14R1.96 C=C(F)COCc1ccccc1C=O 34a_200010262243_200009853537 [1,0,0,0,0,1|2,0,0]=4 4932 B14R1.96 C=Cc1ccccc1COCC(=O)N 34a_200010883148_100000187820 [1,0,0,0,0,1|2,0,0]=4 4933 B14R1.96 C=Cc1ccccc1COCC(=O)N 7a_200010883148_100000187820 [1,0,0,0,0,1|2,0,0]=4 4934 B14R1.96 C=Cc1ccccc1COCC(=O)[O-] 34a_200010883148_100020667443 [1,0,0,0,0,1|1,0,1]=4 4935 B14R1.96 CC(=O)CCOc1ccccc1C=O 1458a_100000070787_100009990610 [1,0,0,0,0,1|1,0,0]=3 4936 B14R1.96 CC(=O)CCSc1ccccc1C=O 62a_100000053229_100000210073 [1,0,0,0,0,1|1,1,0]=4 4937 B14R1.96 CC(=O)CCSc1ccccc1C=O 62a_100000210073_100000053229 [1,0,0,0,0,1|1,1,0]=4 4938 B14R1.96 CC(=O)COCc1ccccc1C=O 34a_100000211253_200009853537 [1,0,0,0,0,1|1,0,0]=3 4939 B14R1.96 CC(=O)OCOc1ccccc1CN 34a_100000185550_100009813279 [1,0,0,0,0,1|1,0,1]=4 4940 B14R1.96 CC(=O)OCSc1ccccc1C=O 62a_100000076356_100000210073 [1,0,0,0,0,1|1,1,0]=4 4941 B14R1.96 CC(=O)OCSc1ccccc1C=O 62a_100000210073_100000076356 [1,0,0,0,0,1|1,1,0]=4 4942 B14R1.96 NC(=O)CCSc1ccccc1C=O 62a_100000210073_100000744528 [1,0,0,0,0,1|1,1,0]=4 4943 B14R1.96 NC(=O)CCSc1ccccc1C=O 62a_100000744528_100000210073 [1,0,0,0,0,1|1,1,0]=4 4944 B14R1.96 NC(=O)CNCc1ccccc1C=O 2230a_100000711301_200009853537 [1,0,0,0,0,1|2,0,0]=4 4945 B14R1.96 NC(=O)CSCc1ccccc1C=O 62a_100000747473_200009853537 [1,0,0,0,0,1|1,1,0]=4 4946 B14R1.96 NC(=O)CSCc1ccccc1C=O 62a_200009853537_100000747473 [1,0,0,0,0,1|1,1,0]=4 4947 B14R1.96 NCc1ccccc1COCC(=O)N 34a_100000743596_100000187820 [1,0,0,0,0,1|1,0,1]=4 4948 B14R1.96 NCc1ccccc1COCC(=O)[O-] 34a_100000743596_100020667443 [1,0,0,0,0,1|0,0,2]=4 4949 B14R1.96 NCc1ccccc1OCCC(=O)N 34a_100000185550_100000731001 [1,0,0,0,0,1|1,0,1]=4 4950 B14R1.96 O=Cc1ccccc1CNCC(=O)O 269956a_100016091260_200009853537 [1,0,0,0,0,1|1,0,0]=3 4951 B14R1.96 O=Cc1ccccc1CSCC(=O)[O-] 62a_100020667443_200009853537 [1,0,0,0,0,1|0,1,1]=4 4952 B14R1.96 O=Cc1ccccc1CSCC(=O)[O-] 62a_200009853537_100020667443 [1,0,0,0,0,1|0,1,1]=4 4953 B14R1.786 C=CCOc1ccccc1NC(=O)C 34a_100000185124_100015514636 [1,0,0,0,0,1|2,0,0]=4 4954 B14R1.786 C=CCOc1ccccc1NC(=O)C 7a_100000185124_100015514636 [1,0,0,0,0,1|2,0,0]=4 4955 B14R1.786 C=CCOc1ccccc1NC(=S)N 7a_200000011649_100015514636 [1,0,0,0,0,1|1,1,0]=4 4956 B14R1.786 C=CCSc1ccccc1CC(=O)N 62a_100000210623_200009814924 [1,0,0,0,0,1|1,1,0]=4 4957 B14R1.786 C=CCSc1ccccc1CC(=O)N 62a_200009814924_100000210623 [1,0,0,0,0,1|1,1,0]=4 4958 B14R1.786 C=CCSc1ccccc1NC(=O)N 62a_100000210623_100000742221 [1,0,0,0,0,1|1,1,0]=4 4959 B14R1.786 CC(=O)Cc1ccccc1SCC=O 62a_100011350739_200015260668 [1,0,0,0,0,1|1,1,0]=4 4960 B14R1.786 CC(=O)Cc1ccccc1SCC=O 62a_200015260668_100011350739 [1,0,0,0,0,1|1,1,0]=4 4961 B14R1.786 CC(=O)Nc1ccccc1NCC=O 34a_100011193560_200009817547 [1,0,0,0,0,1|2,0,0]=4 4962 B14R1.786 CC(=O)Nc1ccccc1OCC=O 34a_100000185124_200009817547 [1,0,0,0,0,1|1,0,0]=3 4963 B14R1.786 CC(=O)Nc1ccccc1OCC=O 7a_100000185124_200015260668 [1,0,0,0,0,1|1,0,0]=3 4964 B14R1.786 CC(=O)Nc1ccccc1OCCO 22a_100132302172_100000070787 [1,0,0,0,0,1|1,0,1]=4 4965 B14R1.786 CC(=O)Nc1ccccc1OCCO 34a_100000185124_100000211926 [1,0,0,0,0,1|1,0,1]=4 4966 B14R1.786 CC(=O)Nc1ccccc1OCCO 7a_100000185124_100000211926 [1,0,0,0,0,1|1,0,1]=4 4967 B14R1.786 CC(=O)Nc1ccccc1SCC=O 62a_200015260668_100000153524 [1,0,0,0,0,1|1,1,0]=4 4968 B14R1.786 CC(=O)Nc1ncccc1OCC=O 34a_200000022013_200009817547 [1,0,0,0,0,1|2,0,0]=4 4969 B14R1.786 CC(=O)Nc1ncccc1OCC=O 7a_200000022013_200015260668 [1,0,0,0,0,1|2,0,0]=4 4970 B14R1.786 CC(=O)Oc1ccccc1SCC=O 62a_100000051690_200015260668 [1,0,0,0,0,1|1,1,0]=4 4971 B14R1.786 CC(=O)Oc1ccccc1SCC=O 62a_200015260668_100000051690 [1,0,0,0,0,1|1,1,0]=4 4972 B14R1.786 NC(=O)Cc1ccccc1SCC=O 62a_200009814924_200015260668 [1,0,0,0,0,1|0,1,0]=3 4973 B14R1.786 NC(=O)Cc1ccccc1SCC=O 62a_200015260668_200009814924 [1,0,0,0,0,1|0,1,0]=3 4974 B14R1.786 NC(=O)Cc1ccccc1SCCO 62a_100000211926_200009814924 [1,0,0,0,0,1|0,1,1]=4 4975 B14R1.786 NC(=O)Cc1ccccc1SCCO 62a_200009814924_100000211926 [1,0,0,0,0,1|0,1,1]=4 4976 B14R1.786 NC(=O)Nc1ccccc1SCC=O 62a_200015260668_100000742221 [1,0,0,0,0,1|0,1,0]=3 4977 B14R1.786 NC(=O)Nc1ccccc1SCCO 62a_100000211926_100000742221 [1,0,0,0,0,1|0,1,1]=4 4978 B14R1.786 NC(=S)Nc1ccccc1OCC=O 7a_200000011649_200015260668 [1,0,0,0,0,1|0,1,0]=3 4979 B14R1.786 NC(=S)Nc1ccccc1OCCO 7a_200000011649_100000211926 [1,0,0,0,0,1|0,1,1]=4 4980 B14R1.6355 C=C(C)COc1cccc(c1)C(=O)N 34a_100000162170_100000748629 [0,0,0,0,1,1|2,0,0]=4 4981 B14R1.6355 C=C(C)COc1cccc(c1)C(=O)N 7a_100000162170_100000748629 [0,0,0,0,1,1|2,0,0]=4 4982 B14R1.6355 C=C(F)COc1cccc(c1)C(=O)N 34a_100000162170_100009893438 [0,0,0,0,1,1|2,0,0]=4 4983 B14R1.6355 C=C(F)COc1cccc(c1)C(=O)N 7a_100000162170_100000042424 [0,0,0,0,1,1|2,0,0]=4 4984 B14R1.6355 CC(=O)c1cccc(c1)OCC(=O)N 1458a_100000186838_200000210301 [0,0,0,0,1,1|2,0,0]=4 4985 B14R1.6355 CC(=O)c1cccc(c1)OCC(=O)N 34a_100000211620_100000187820 [0,0,0,0,1,1|2,0,0]=4 4986 B14R1.6355 CC(=O)c1cccc(c1)OCC(=O)N 7a_100000211620_100000187820 [0,0,0,0,1,1|2,0,0]=4 4987 B14R1.6355 CC(=O)c1cccc(c1)OCC(=O)[O-] 34a_100000211620_100020667443 [0,0,0,0,1,1|1,0,1]=4 4988 B14R1.6355 CC(O)COc1cccc(c1)C(=O)N 34a_100000162170_100011218427 [0,0,0,0,1,1|1,0,1]=4 4989 B14R1.6355 CC(O)COc1cccc(c1)C(=O)N 7a_100000162170_100011218427 [0,0,0,0,1,1|1,0,1]=4 4990 B14R1.6355 C[C@@H](O)COc1cccc(c1)C(=O)N 34a_100000162170_100009817552 [0,0,0,0,1,1|1,0,1]=4 4991 B14R1.6355 C[C@@H](O)COc1cccc(c1)C(=O)N 7a_100000162170_100009817552 [0,0,0,0,1,1|1,0,1]=4 4992 B14R1.6355 NC(=O)CNc1cccc(c1)C(=O)N 34a_100000217337_100000187820 [0,0,0,0,1,1|2,0,0]=4 4993 B14R1.6355 NC(=O)COc1cccc(c1)C(=O)N 34a_100000162170_100000187820 [0,0,0,0,1,1|1,0,0]=3 4994 B14R1.6355 NC(=O)COc1cccc(c1)C(=O)N 7a_100000162170_100000187820 [0,0,0,0,1,1|1,0,0]=3 4995 B14R1.6355 NC(=O)COc1cccc(c1)C(=S)N 7a_100000738086_100000187820 [0,0,0,0,1,1|1,1,0]=4 4996 B14R1.6355 NC(=O)COc1cncc(c1)C(=O)N 7a_100000698036_100000187820 [0,0,0,0,1,1|2,0,0]=4 4997 B14R1.6355 NC(=O)CSc1cccc(c1)C(=O)N 62a_100000162208_100000747473 [0,0,0,0,1,1|1,1,0]=4 4998 B14R1.6355 NC(=O)CSc1cccc(c1)C(=O)N 62a_100000747473_100000162208 [0,0,0,0,1,1|1,1,0]=4 4999 B14R1.6355 NC(=O)CSc1cccc(n1)C(=O)N 62a_100000747473_100011834053 [0,0,0,0,1,1|1,1,0]=4 5000 B14R1.6355 NC(=O)CSc1cccc(n1)C(=O)N 62a_100011834053_100000747473 [0,0,0,0,1,1|1,1,0]=4 5001 B14R1.6355 NC(=O)c1cccc(c1)NCC(=O)[O-] 34a_100000217337_100020667443 [0,0,0,0,1,1|1,0,1]=4 5002 B14R1.6355 NC(=O)c1cccc(c1)OCC(=O)[O-] 34a_100000162170_100020667443 [0,0,0,0,1,1|0,0,1]=3 5003 B14R1.6355 NC(=O)c1cccc(c1)OC[N+](=O)[O-] 34a_100000162170_100000761209 [0,0,0,0,1,1|1,0,1]=4 5004 B14R1.6355 NC(=O)c1cccc(c1)SCC(=O)[O-] 62a_100000162208_100020667443 [0,0,0,0,1,1|0,1,1]=4 5005 B14R1.6355 NC(=O)c1cccc(c1)SCC(=O)[O-] 62a_100020667443_100000162208 [0,0,0,0,1,1|0,1,1]=4 5006 B14R1.6355 NC(=O)c1cccc(n1)SCC(=O)[O-] 62a_100011834053_100020667443 [0,0,0,0,1,1|0,1,1]=4 5007 B14R1.6355 NC(=O)c1cccc(n1)SCC(=O)[O-] 62a_100020667443_100011834053 [0,0,0,0,1,1|0,1,1]=4 5008 B14R1.6355 [13CH3]C(=O)c1cccc(c1)OCC(=O)N 1458a_100000186838_200025704644 [0,0,0,0,1,1|2,0,0]=4 5009 B16R1.7619 C=C(C)COc1ccccc1CCC(=O)N 34a_100011200845_100000748629 [0,0,0,0,0,2|2,0,0]=4 5010 B16R1.7619 C=C(C)COc1ccccc1CCC(=O)N 7a_100011200845_100000748629 [0,0,0,0,0,2|2,0,0]=4 5011 B16R1.7619 C=C(C)COc1ccccc1NCC(=O)N 2230a_100000243823_100000747473 [0,0,0,0,0,2|2,0,0]=4 5012 B16R1.7619 C=C(C)COc1ccccc1NCC(=O)N 34a_100000243823_100000187820 [0,0,0,0,0,2|2,0,0]=4 5013 B16R1.7619 C=C(C)COc1ccccc1OCC(=O)N 7a_100000162348_100000748629 [0,0,0,0,0,2|2,0,0]=4 5014 B16R1.7619 C=C(F)COc1ccccc1CCC(=O)N 34a_100011200845_100009893438 [0,0,0,0,0,2|2,0,0]=4 5015 B16R1.7619 C=C(F)COc1ccccc1CCC(=O)N 7a_100011200845_100000042424 [0,0,0,0,0,2|2,0,0]=4 5016 B16R1.7619 C=C(F)COc1ccccc1OCC(=O)N 7a_100000162348_100000042424 [0,0,0,0,0,2|2,0,0]=4 5017 B16R1.7619 CC(=O)NCc1ccccc1OCC(=O)N 34a_200011628774_100000187820 [0,0,0,0,0,2|2,0,0]=4 5018 B16R1.7619 CC(=O)NCc1ccccc1OCC(=O)N 7a_200011628774_100000187820 [0,0,0,0,0,2|2,0,0]=4 5019 B16R1.7619 CC(=O)NCc1ccccc1OCC(=O)[O-] 34a_200011628774_100020667443 [0,0,0,0,0,2|1,0,1]=4 5020 B16R1.7619 CC(O)COc1ccccc1CCC(=O)N 34a_100011200845_100011218427 [0,0,0,0,0,2|1,0,1]=4 5021 B16R1.7619 CC(O)COc1ccccc1CCC(=O)N 7a_100011200845_100011218427 [0,0,0,0,0,2|1,0,1]=4 5022 B16R1.7619 CC(O)COc1ccccc1OCC(=O)N 7a_100000162348_100011218427 [0,0,0,0,0,2|1,0,1]=4 5023 B16R1.7619 C[C@@H](O)COc1ccccc1CCC(=O)N 34a_100011200845_100009817552 [0,0,0,0,0,2|1,0,1]=4 5024 B16R1.7619 C[C@@H](O)COc1ccccc1CCC(=O)N 7a_100011200845_100009817552 [0,0,0,0,0,2|1,0,1]=4 5025 B16R1.7619 C[C@@H](O)COc1ccccc1OCC(=O)N 7a_100000162348_100009817552 [0,0,0,0,0,2|1,0,1]=4 5026 B16R1.7619 NC(=O)CCc1ccccc1OCC(=O)N 34a_100011200845_100000187820 [0,0,0,0,0,2|1,0,0]=3 5027 B16R1.7619 NC(=O)CCc1ccccc1OCC(=O)N 7a_100011200845_100000187820 [0,0,0,0,0,2|1,0,0]=3 5028 B16R1.7619 NC(=O)CCc1ccccc1OCC(=O)[O-] 34a_100011200845_100020667443 [0,0,0,0,0,2|0,0,1]=3 5029 B16R1.7619 NC(=O)CCc1ccccc1OC[N+](=O)[O-] 34a_100011200845_100000761209 [0,0,0,0,0,2|1,0,1]=4 5030 B16R1.7619 NC(=O)CCc1ccccc1SCC(=O)N 62a_100000747473_100009814947 [0,0,0,0,0,2|1,1,0]=4 5031 B16R1.7619 NC(=O)CCc1ccccc1SCC(=O)N 62a_100009814947_100000747473 [0,0,0,0,0,2|1,1,0]=4 5032 B16R1.7619 NC(=O)CCc1ccccc1SCC(=O)[O-] 62a_100009814947_100020667443 [0,0,0,0,0,2|0,1,1]=4 5033 B16R1.7619 NC(=O)CCc1ccccc1SCC(=O)[O-] 62a_100020667443_100009814947 [0,0,0,0,0,2|0,1,1]=4 5034 B16R1.7619 NC(=O)CNc1ccccc1SCC(=O)N 7a_100000187061_100000187820 [0,0,0,0,0,2|1,1,0]=4 5035 B16R1.7619 NC(=O)COc1ccccc1OCC(=O)N 7a_100000162348_100000187820 [0,0,0,0,0,2|1,0,0]=3 5036 B16R1.7619 NC(=O)COc1ccccc1SCC(=O)N 62a_200000148491_100000747473 [0,0,0,0,0,2|1,0,0]=3 5037 B16R1.7619 NC(=O)COc1ccccc1SCC(=O)[O-] 62a_200000148491_100020667443 [0,0,0,0,0,2|0,1,1]=4 5038 B16R1.12221 CC(=O)CCOc1ccccc1NC(=O)C 7a_100000185124_100000053229 [0,0,0,0,0,2|2,0,0]=4 5039 B16R1.12221 CC(=O)CCOc1ccccc1NC(=S)N 7a_200000011649_100000053229 [0,0,0,0,0,2|1,1,0]=4 5040 B16R1.12221 CC(=O)CCSc1ccccc1CC(=O)N 62a_100000053229_200009814924 [0,0,0,0,0,2|1,1,0]=4 5041 B16R1.12221 CC(=O)CCSc1ccccc1CC(=O)N 62a_200009814924_100000053229 [0,0,0,0,0,2|1,1,0]=4 5042 B16R1.12221 CC(=O)CCSc1ccccc1NC(=O)N 62a_100000053229_100000742221 [0,0,0,0,0,2|1,1,0]=4 5043 B16R1.12221 CC(=O)Nc1ccccc1COCC(=O)N 34a_100000192217_100000187820 [0,0,0,0,0,2|2,0,0]=4 5044 B16R1.12221 CC(=O)Nc1ccccc1COCC(=O)N 7a_100000192217_100000187820 [0,0,0,0,0,2|2,0,0]=4 5045 B16R1.12221 CC(=O)Nc1ccccc1COCC(=O)[O-] 34a_100000192217_100020667443 [0,0,0,0,0,2|1,0,1]=4 5046 B16R1.12221 CC(=O)Nc1ccccc1OCCC(=O)N 34a_100000185124_100000731001 [0,0,0,0,0,2|2,0,0]=4 5047 B16R1.12221 CC(=O)Nc1ccccc1OCCC(=O)N 7a_100000185124_100000744528 [0,0,0,0,0,2|2,0,0]=4 5048 B16R1.12221 CC(=O)Nc1ccccc1OCOC(=O)C 34a_100000185124_100009813279 [0,0,0,0,0,2|2,0,0]=4 5049 B16R1.12221 CC(=O)OCSc1ccccc1CC(=O)N 62a_100000076356_200009814924 [0,0,0,0,0,2|1,1,0]=4 5050 B16R1.12221 CC(=O)OCSc1ccccc1CC(=O)N 62a_200009814924_100000076356 [0,0,0,0,0,2|1,1,0]=4 5051 B16R1.12221 CC(=O)OCSc1ccccc1NC(=O)N 62a_100000076356_100000742221 [0,0,0,0,0,2|1,1,0]=4 5052 B16R1.12221 NC(=O)CCOc1ccccc1NC(=S)N 7a_200000011649_100000744528 [0,0,0,0,0,2|1,1,0]=4 5053 B16R1.12221 NC(=O)CCSc1ccccc1CC(=O)N 62a_100000744528_200009814924 [0,0,0,0,0,2|1,1,0]=4 5054 B16R1.12221 NC(=O)CCSc1ccccc1CC(=O)N 62a_200009814924_100000744528 [0,0,0,0,0,2|1,1,0]=4 5055 B16R1.12221 NC(=O)CCSc1ccccc1NC(=O)N 62a_100000744528_100000742221 [0,0,0,0,0,2|1,1,0]=4 5056 B16R1.12322 CC(=CCCOc1ccccc1C(=O)N)C 34a_100000192804_100011217483 [0,0,0,0,0,2|2,0,0]=4 5057 B16R1.12322 CC(=CCCOc1ccccc1C(=O)N)C 7a_100000192804_100011217483 [0,0,0,0,0,2|2,0,0]=4 5058 B16R1.12322 CC(=O)CCCNc1ccccc1C(=O)N 34a_100000185089_100000685027 [0,0,0,0,0,2|2,0,0]=4 5059 B16R1.12322 CC(=O)CCCOc1ccccc1C(=O)N 34a_100000192804_100000685027 [0,0,0,0,0,2|1,0,0]=3 5060 B16R1.12322 CC(=O)CCCOc1ccccc1C(=O)N 7a_100000192804_100011215641 [0,0,0,0,0,2|1,0,0]=3 5061 B16R1.12322 CC(=O)CCCOc1ccccc1C(=O)[O-] 7a_100015234032_100011215641 [0,0,0,0,0,2|2,0,0]=4 5062 B16R1.12322 CC(=O)CCCOc1ccccc1C(=S)N 7a_100000745089_100011215641 [0,0,0,0,0,2|1,1,0]=4 5063 B16R1.12322 CC(=O)CCCOc1cccnc1C(=O)N 34a_200011215183_100000685027 [0,0,0,0,0,2|2,0,0]=4 5064 B16R1.12322 CC(=O)CCCOc1cccnc1C(=O)N 7a_200011215183_100011215641 [0,0,0,0,0,2|2,0,0]=4 5065 B16R1.12322 CC(=O)CCCOc1ccncc1C(=O)N 34a_200011998761_100000685027 [0,0,0,0,0,2|2,0,0]=4 5066 B16R1.12322 CC(=O)CCCOc1cnccc1C(=O)N 7a_100012022987_100011215641 [0,0,0,0,0,2|2,0,0]=4 5067 B16R1.12322 CC(=O)CCCSc1ccccc1C(=O)N 62a_100000162227_100011215641 [0,0,0,0,0,2|1,1,0]=4 5068 B16R1.12322 CC(=O)CCCSc1ccccc1C(=O)N 62a_100011215641_100000162227 [0,0,0,0,0,2|1,1,0]=4 5069 B16R1.12322 CC(=O)NCCOc1ccccc1C(=O)N 7a_100000192804_100000189650 [0,0,0,0,0,2|1,0,0]=3 5070 B16R1.12322 CC(=O)NCCOc1ccccc1C(=O)[O-] 7a_100015234032_100000189650 [0,0,0,0,0,2|2,0,0]=4 5071 B16R1.12322 CC(=O)NCCOc1ccccc1C(=S)N 7a_100000745089_100000189650 [0,0,0,0,0,2|1,1,0]=4 5072 B16R1.12322 CC(=O)NCCOc1cccnc1C(=O)N 7a_200011215183_100000189650 [0,0,0,0,0,2|2,0,0]=4 5073 B16R1.12322 CC(=O)NCCOc1cnccc1C(=O)N 7a_100012022987_100000189650 [0,0,0,0,0,2|2,0,0]=4 5074 B16R1.12322 CC(=O)NCCSc1ccccc1C(=O)N 62a_100000162227_100000189650 [0,0,0,0,0,2|1,1,0]=4 5075 B16R1.12322 CC(=O)NCCSc1ccccc1C(=O)N 62a_100000189650_100000162227 [0,0,0,0,0,2|1,1,0]=4 5076 B16R1.12322 CC(=O)OCC=Cc1ccccc1C(=O)N 271570a_200000047263_100000162227 [0,0,0,0,0,2|2,0,0]=4 5077 B16R1.12322 CC(=O)OCCNc1ccccc1C(=O)N 34a_100000185089_100009814007 [0,0,0,0,0,2|2,0,0]=4 5078 B16R1.12322 CC(=O)OCCOc1ccccc1C(=O)N 34a_100000192804_100009814007 [0,0,0,0,0,2|1,0,0]=3 5079 B16R1.12322 CC(=O)OCCOc1ccccc1C(=O)N 7a_100000192804_100009814007 [0,0,0,0,0,2|1,0,0]=3 5080 B16R1.12322 CC(=O)OCCOc1ccccc1C(=O)[O-] 7a_100015234032_100009814007 [0,0,0,0,0,2|2,0,0]=4 5081 B16R1.12322 CC(=O)OCCOc1ccccc1C(=S)N 7a_100000745089_100009814007 [0,0,0,0,0,2|1,1,0]=4 5082 B16R1.12322 CC(=O)OCCOc1cccnc1C(=O)N 34a_200011215183_100009814007 [0,0,0,0,0,2|2,0,0]=4 5083 B16R1.12322 CC(=O)OCCOc1cccnc1C(=O)N 7a_200011215183_100009814007 [0,0,0,0,0,2|2,0,0]=4 5084 B16R1.12322 CC(=O)OCCOc1ccncc1C(=O)N 34a_200011998761_100009814007 [0,0,0,0,0,2|2,0,0]=4 5085 B16R1.12322 CC(=O)OCCOc1cnccc1C(=O)N 7a_100012022987_100009814007 [0,0,0,0,0,2|2,0,0]=4 5086 B16R1.12322 CC(=O)OCCSc1ccccc1C(=O)N 62a_100000162227_100009814007 [0,0,0,0,0,2|1,1,0]=4 5087 B16R1.12322 CC(=O)OCCSc1ccccc1C(=O)N 62a_100009814007_100000162227 [0,0,0,0,0,2|1,1,0]=4 5088 B16R1.12322 CC(O)CCCOc1ccccc1C(=O)N 34a_100000192804_200000718107 [0,0,0,0,0,2|1,0,1]=4 5089 B16R1.12322 CC(O)CCCOc1ccccc1C(=O)N 7a_100000192804_200000718107 [0,0,0,0,0,2|1,0,1]=4 5090 B16R1.12322 NC(=O)CCCNc1ccccc1C(=O)N 34a_100000185089_100102525003 [0,0,0,0,0,2|2,0,0]=4 5091 B16R1.12322 NC(=O)CCCOc1ccccc1C(=O)N 34a_100000192804_100102525003 [0,0,0,0,0,2|1,0,0]=3 5092 B16R1.12322 NC(=O)CCCOc1ccccc1C(=O)N 7a_100000192804_100102525003 [0,0,0,0,0,2|1,0,0]=3 5093 B16R1.12322 NC(=O)CCCOc1ccccc1C(=O)[O-] 7a_100015234032_100102525003 [0,0,0,0,0,2|2,0,0]=4 5094 B16R1.12322 NC(=O)CCCOc1ccccc1C(=S)N 7a_100000745089_100102525003 [0,0,0,0,0,2|1,1,0]=4 5095 B16R1.12322 NC(=O)CCCOc1cccnc1C(=O)N 34a_200011215183_100102525003 [0,0,0,0,0,2|2,0,0]=4 5096 B16R1.12322 NC(=O)CCCOc1cccnc1C(=O)N 7a_200011215183_100102525003 [0,0,0,0,0,2|2,0,0]=4 5097 B16R1.12322 NC(=O)CCCOc1ccncc1C(=O)N 34a_200011998761_100102525003 [0,0,0,0,0,2|2,0,0]=4 5098 B16R1.12322 NC(=O)CCCOc1cnccc1C(=O)N 7a_100012022987_100102525003 [0,0,0,0,0,2|2,0,0]=4 5099 B16R1.12322 NC(=O)CCCSc1ccccc1C(=O)N 62a_100000162227_100102525003 [0,0,0,0,0,2|1,1,0]=4 5100 B16R1.12322 NC(=O)CCCSc1ccccc1C(=O)N 62a_100102525003_100000162227 [0,0,0,0,0,2|1,1,0]=4 5101 B16R1.12322 NC(=O)NCCOc1ccccc1C(=O)N 7a_100000192804_200000034859 [0,0,0,0,0,2|1,0,0]=3 5102 B16R1.12322 NC(=O)NCCOc1ccccc1C(=O)[O-] 7a_100015234032_200000034859 [0,0,0,0,0,2|2,0,0]=4 5103 B16R1.12322 NC(=O)NCCOc1ccccc1C(=S)N 7a_100000745089_200000034859 [0,0,0,0,0,2|1,1,0]=4 5104 B16R1.12322 NC(=O)NCCOc1cccnc1C(=O)N 7a_200011215183_200000034859 [0,0,0,0,0,2|2,0,0]=4 5105 B16R1.12322 NC(=O)NCCOc1cnccc1C(=O)N 7a_100012022987_200000034859 [0,0,0,0,0,2|2,0,0]=4 5106 B16R1.12322 NC(=O)NCCSc1ccccc1C(=O)N 62a_100000162227_200000034859 [0,0,0,0,0,2|1,1,0]=4 5107 B16R1.12322 NC(=O)NCCSc1ccccc1C(=O)N 62a_200000034859_100000162227 [0,0,0,0,0,2|1,1,0]=4 5108 B16R1.12322 NC(=O)OCCNc1ccccc1C(=O)N 34a_100000185089_200011214921 [0,0,0,0,0,2|2,0,0]=4 5109 B16R1.12322 NC(=O)OCCOc1ccccc1C(=O)N 34a_100000192804_200011214921 [0,0,0,0,0,2|1,0,0]=3 5110 B16R1.12322 NC(=O)OCCOc1ccccc1C(=O)N 7a_100000192804_200011214921 [0,0,0,0,0,2|1,0,0]=3 5111 B16R1.12322 NC(=O)OCCOc1ccccc1C(=O)[O-] 7a_100015234032_200011214921 [0,0,0,0,0,2|2,0,0]=4 5112 B16R1.12322 NC(=O)OCCOc1ccccc1C(=S)N 7a_100000745089_200011214921 [0,0,0,0,0,2|1,1,0]=4 5113 B16R1.12322 NC(=O)OCCOc1cccnc1C(=O)N 34a_200011215183_200011214921 [0,0,0,0,0,2|2,0,0]=4 5114 B16R1.12322 NC(=O)OCCOc1cccnc1C(=O)N 7a_200011215183_200011214921 [0,0,0,0,0,2|2,0,0]=4 5115 B16R1.12322 NC(=O)OCCOc1ccncc1C(=O)N 34a_200011998761_200011214921 [0,0,0,0,0,2|2,0,0]=4 5116 B16R1.12322 NC(=O)OCCOc1cnccc1C(=O)N 7a_100012022987_200011214921 [0,0,0,0,0,2|2,0,0]=4 5117 B16R1.12322 NC(=O)OCCSc1ccccc1C(=O)N 62a_100000162227_200011214921 [0,0,0,0,0,2|1,1,0]=4 5118 B16R1.12322 NC(=O)OCCSc1ccccc1C(=O)N 62a_200011214921_100000162227 [0,0,0,0,0,2|1,1,0]=4 5119 B16R1.12322 NC(=O)c1ccccc1OC/C=C/B(O)O 34a_100000192804_100016262062 [0,0,0,0,0,2|1,0,1]=4 5120 B16R1.12322 NC(=O)c1ccccc1OC/C=C/B(O)O 7a_100000192804_100016262062 [0,0,0,0,0,2|1,0,1]=4 5121 B16R1.12322 NC(=O)c1ccccc1OCCC=C(F)F 34a_100000192804_200009816681 [0,0,0,0,0,2|2,0,0]=4 5122 B16R1.12322 NC(=O)c1ccccc1OCCC=C(F)F 7a_100000192804_200009816681 [0,0,0,0,0,2|2,0,0]=4 5123 B16R1.12322 O=C(O)CONCc1ccccc1[N+](=O)[O-] 269956a_100000106656_100000181388 [0,0,0,0,0,2|2,0,0]=4