0 B13R1.133 C/C(=C\C1=CC=C(C=C1)F)/C(=O)O MCULE-9125817227 [0,0,0,0,0,0|2,0,1]=3 1 B13R1.133 C=C(C)C(=O)NC1=CC=C(C=C1)Br MCULE-6125088731 [0,0,0,0,0,0|4,0,0]=4 2 B13R1.133 C=C(C)C(=O)NC1=CC=C(C=C1)C MCULE-1997329205 [0,0,0,0,0,0|4,0,0]=4 3 B13R1.133 C=C(C)C(=O)NC1=CC=C(C=C1)Cl MCULE-8384111789 [0,0,0,0,0,0|4,0,0]=4 4 B13R1.133 C=C(C)C(=O)NC1=CC=C(C=C1)O MCULE-6155332488 [0,0,0,0,0,0|3,0,0]=3 5 B13R1.133 C=C(C)C(=O)OC1=CC=C(C=C1)O MCULE-1982174581 [0,0,0,0,0,0|3,0,0]=3 6 B13R1.133 C=C(Cl)C(=O)NC1=CC=C(C=C1)Cl MCULE-9183092405 [0,0,0,0,0,0|4,0,0]=4 7 B13R1.133 CC(=CC1=CC=C(C=C1)Cl)C(=O)O MCULE-3905010340 [0,0,0,0,0,0|2,0,1]=3 8 B13R1.133 CC(=CC1=CC=C(C=C1)F)C(=O)O MCULE-7582483106 [0,0,0,0,0,0|2,0,1]=3 9 B13R1.133 CC(=CC1=CC=C(C=C1)O)[N+](=O)[O-] MCULE-8508269082 [0,0,0,0,0,0|2,0,2]=4 10 B13R1.133 CC(=O)C(=CC1=CC=C(C=C1)Cl)Br MCULE-1911636549 [0,0,0,0,0,0|3,0,1]=4 11 B13R1.133 CC(=O)C(=O)CC1=CC=C(C=C1)Br MCULE-8584708680 [0,0,0,0,0,0|2,0,0]=2 12 B13R1.133 CC(=O)C(=O)CC1=CC=C(C=C1)C MCULE-4909741651 [0,0,0,0,0,0|2,0,0]=2 13 B13R1.133 CC(=O)C(=O)CC1=CC=C(C=C1)Cl MCULE-4851750628 [0,0,0,0,0,0|2,0,0]=2 14 B13R1.133 CC(=O)C(=O)CC1=CC=C(C=C1)F MCULE-6298679807 [0,0,0,0,0,0|2,0,0]=2 15 B13R1.133 CC(=O)C(=O)NC1=CC=C(C=C1)Cl MCULE-9288580012 [0,0,0,0,0,0|3,0,0]=3 16 B13R1.133 CC(=O)C(Cl)CC1=CC=C(C=C1)Cl MCULE-1359763762 [0,0,0,0,0,0|3,0,1]=4 17 B13R1.133 CC(=O)N(C)CC1=CC=C(C=C1)Cl MCULE-6733198040 [0,0,0,0,0,0|4,0,0]=4 18 B13R1.133 CC(C)C(=O)CC1=CC=C(C=C1)Br MCULE-1176922682 [0,0,0,0,0,0|3,0,1]=4 19 B13R1.133 CC(C)C(=O)CC1=CC=C(C=C1)Cl MCULE-2326355702 [0,0,0,0,0,0|3,0,1]=4 20 B13R1.133 CC(C)C(=O)CC1=CC=C(C=C1)F MCULE-2060529357 [0,0,0,0,0,0|3,0,1]=4 21 B13R1.133 CC(C)C(=O)NC1=CC=C(C=C1)O MCULE-7115776051 [0,0,0,0,0,0|3,0,1]=4 22 B13R1.133 CC(CC1=CC=C(C=C1)Br)C(=O)O MCULE-6683812666 [0,0,0,0,0,0|2,0,1]=3 23 B13R1.133 CC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-1280505558 [0,0,0,0,0,0|2,0,1]=3 24 B13R1.133 CC(CC1=CC=C(C=C1)F)C(=O)Cl MCULE-3149956298 [0,0,0,0,0,0|3,0,1]=4 25 B13R1.133 CC(CC1=CC=C(C=C1)F)C(=O)O MCULE-5939301963 [0,0,0,0,0,0|2,0,1]=3 26 B13R1.133 CC(CC1=CC=C(C=C1)N)C(=O)O MCULE-5845815463 [0,0,0,0,0,0|2,0,1]=3 27 B13R1.133 CC(CC1=CC=C(C=C1)O)C(=O)O MCULE-2516510846 [0,0,0,0,0,0|1,0,1]=2 28 B13R1.133 CC(Cl)C(=O)NC1=CC=C(C=C1)O MCULE-9617976023 [0,0,0,0,0,0|3,0,1]=4 29 B13R1.133 CC(NC1=CC=C(C=C1)Br)C(=O)O MCULE-6489432108 [0,0,0,0,0,0|3,0,1]=4 30 B13R1.133 CC(NC1=CC=C(C=C1)Cl)C(=O)O MCULE-8986903361 [0,0,0,0,0,0|3,0,1]=4 31 B13R1.133 CC(NC1=CC=C(C=C1)F)C(=O)O MCULE-6392334081 [0,0,0,0,0,0|3,0,1]=4 32 B13R1.133 CC(O)C(O)CC1=CC=C(C=C1)O MCULE-5873805411 [0,0,0,0,0,0|1,0,3]=4 33 B13R1.133 CC(OC1=CC=C(C=C1)Br)C(=O)O MCULE-2899606616 [0,0,0,0,0,0|3,0,1]=4 34 B13R1.133 CC(OC1=CC=C(C=C1)Cl)C(=O)O MCULE-2806188004 [0,0,0,0,0,0|3,0,1]=4 35 B13R1.133 CC(OC1=CC=C(C=C1)F)C(=O)O MCULE-4636762506 [0,0,0,0,0,0|3,0,1]=4 36 B13R1.133 CC(OC1=CC=C(C=C1)I)C(=O)O MCULE-1220379374 [0,0,0,0,0,0|3,0,1]=4 37 B13R1.133 CC(OC1=CC=C(C=C1)O)C(=O)N MCULE-3442482535 [0,0,0,0,0,0|3,0,1]=4 38 B13R1.133 CC(OC1=CC=C(C=C1)O)C(=O)O MCULE-3910586263 [0,0,0,0,0,0|2,0,1]=3 39 B13R1.133 CC(OC1=CC=C(C=C1)O)C(=O)O MCULE-8109698642 [0,0,0,0,0,0|2,0,1]=3 40 B13R1.133 CC(OC1=NC=C(C=C1)O)C(=O)O MCULE-8981560377 [0,0,0,0,0,0|3,0,1]=4 41 B13R1.133 CC(SC1=CC=C(C=C1)Br)C(=O)O MCULE-1446499549 [0,0,0,0,0,0|3,0,1]=4 42 B13R1.133 CC(SC1=CC=C(C=C1)Cl)C(=O)O MCULE-8222588241 [0,0,0,0,0,0|3,0,1]=4 43 B13R1.133 CC(SC1=CC=C(C=C1)F)C(=O)O MCULE-3934690491 [0,0,0,0,0,0|3,0,1]=4 44 B13R1.133 CC(SC1=CC=C(C=C1)N)C(=O)O MCULE-3495898588 [0,0,0,0,0,0|3,0,1]=4 45 B13R1.133 CC(SC1=CC=C(C=C1)N)C(=O)O MCULE-7599867683 [0,0,0,0,0,0|3,0,1]=4 46 B13R1.133 CC1=CC=C(C=C1)CC(=O)C(=O)O MCULE-5364836033 [0,0,0,0,0,0|1,0,0]=1 47 B13R1.133 CC1=CC=C(C=C1)CC(=O)C(C)C MCULE-2257450897 [0,0,0,0,0,0|3,0,1]=4 48 B13R1.133 CC1=CC=C(C=C1)CC(C)C(=O)O MCULE-4590037722 [0,0,0,0,0,0|2,0,1]=3 49 B13R1.133 CC1=CC=C(C=C1)CC(N)C(=O)O MCULE-5938013882 [0,0,0,0,0,0|2,0,1]=3 50 B13R1.133 CC1=CC=C(C=C1)CC(N)C(=O)O MCULE-5941415626 [0,0,0,0,0,0|2,0,1]=3 51 B13R1.133 CC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-4074563438 [0,0,0,0,0,0|2,0,1]=3 52 B13R1.133 CC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-6283014667 [0,0,0,0,0,0|2,0,1]=3 53 B13R1.133 CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-4426041269 [0,0,0,0,0,0|2,0,1]=3 54 B13R1.133 CC1=CC=C(C=C1)NC(=O)C(=O)O MCULE-9008357683 [0,0,0,0,0,0|2,0,0]=2 55 B13R1.133 CC1=CC=C(C=C1)NC(C)C(=O)O MCULE-2473610216 [0,0,0,0,0,0|3,0,1]=4 56 B13R1.133 CC1=CC=C(C=C1)N[C@@H](C)C(=O)O MCULE-5578025031 [0,0,0,0,0,0|3,0,1]=4 57 B13R1.133 CC1=CC=C(C=C1)OC(C)C(=O)O MCULE-5755742192 [0,0,0,0,0,0|3,0,1]=4 58 B13R1.133 CC1=CC=C(C=C1)SC(=O)C(=O)O MCULE-2944763069 [0,0,0,0,0,0|2,0,0]=2 59 B13R1.133 CC1=CC=C(C=C1)SC(C)C(=O)O MCULE-2194590140 [0,0,0,0,0,0|3,0,1]=4 60 B13R1.133 CC1=CC=C(C=N1)CC(N)C(=O)O MCULE-7515109915 [0,0,0,0,0,0|3,0,1]=4 61 B13R1.133 CC1=CC=C(C=N1)CC(N)C(=O)O MCULE-7970126746 [0,0,0,0,0,0|3,0,1]=4 62 B13R1.133 CC1=CC=C(C=N1)C[C@H](N)C(=O)O MCULE-3552123991 [0,0,0,0,0,0|3,0,1]=4 63 B13R1.133 CC1=CC=C(C=N1)C[C@H](N)C(=O)O MCULE-8500104051 [0,0,0,0,0,0|3,0,1]=4 64 B13R1.133 CC1=CN=C(C=C1)CC(N)C(=O)O MCULE-9990775207 [0,0,0,0,0,0|3,0,1]=4 65 B13R1.133 CC1=CN=C(C=C1)NC(=O)C(=O)O MCULE-8145314179 [0,0,0,0,0,0|3,0,0]=3 66 B13R1.133 CC1=NC=C(C=C1)CC(C)C(=O)O MCULE-3690219579 [0,0,0,0,0,0|3,0,1]=4 67 B13R1.133 CN(C)C(=O)CC1=CC=C(C=C1)Br MCULE-7590925638 [0,0,0,0,0,0|4,0,0]=4 68 B13R1.133 CN(C)C(=O)CC1=CC=C(C=C1)Cl MCULE-5874618303 [0,0,0,0,0,0|4,0,0]=4 69 B13R1.133 CN(C)C(=O)CC1=CC=C(C=C1)N MCULE-1359761922 [0,0,0,0,0,0|4,0,0]=4 70 B13R1.133 CN(C)C(=O)CC1=CC=C(C=C1)O MCULE-2135665976 [0,0,0,0,0,0|3,0,0]=3 71 B13R1.133 CN(C)C(=O)OC1=CC=C(C=C1)O MCULE-4054358149 [0,0,0,0,0,0|4,0,0]=4 72 B13R1.133 CN(O)C(=O)NC1=CC=C(C=C1)Cl MCULE-6202461521 [0,0,0,0,0,0|4,0,0]=4 73 B13R1.133 C[C@@H](OC1=CC=C(C=C1)Br)C(=O)O MCULE-9582407611 [0,0,0,0,0,0|3,0,1]=4 74 B13R1.133 C[C@@H](OC1=CC=C(C=C1)O)C(=O)O MCULE-2306319707 [0,0,0,0,0,0|2,0,1]=3 75 B13R1.133 C[C@@H](OC1=CC=C(C=C1)O)C(=O)O MCULE-2747836834 [0,0,0,0,0,0|2,0,1]=3 76 B13R1.133 C[C@H](OC1=CC=C(C=C1)Br)C(=O)O MCULE-7345498401 [0,0,0,0,0,0|3,0,1]=4 77 B13R1.133 C[C@H](OC1=CC=C(C=C1)Cl)C(=O)O MCULE-5436371376 [0,0,0,0,0,0|3,0,1]=4 78 B13R1.133 C[C@H](OC1=CC=C(C=C1)I)C(=O)O MCULE-7333151537 [0,0,0,0,0,0|3,0,1]=4 79 B13R1.133 C[C@H](OC1=CC=C(C=C1)O)C(=O)O MCULE-3555894490 [0,0,0,0,0,0|2,0,1]=3 80 B13R1.133 NC(=O)C(=O)NC1=CC=C(C=C1)Cl MCULE-8032824043 [0,0,0,0,0,0|3,0,0]=3 81 B13R1.133 NC(=O)C(=O)NC1=CC=C(C=C1)F MCULE-5330389719 [0,0,0,0,0,0|3,0,0]=3 82 B13R1.133 NC(=O)C(Br)CC1=CC=C(C=C1)Cl MCULE-9735876861 [0,0,0,0,0,0|3,0,1]=4 83 B13R1.133 NC(=O)C(Br)CC1=CC=C(C=C1)F MCULE-6712170604 [0,0,0,0,0,0|3,0,1]=4 84 B13R1.133 NC(=O)C(N)CC1=CC=C(C=C1)Cl MCULE-3507738342 [0,0,0,0,0,0|3,0,1]=4 85 B13R1.133 NC(=O)C(N)CC1=CC=C(C=C1)Cl MCULE-3797575548 [0,0,0,0,0,0|3,0,1]=4 86 B13R1.133 NC(=O)C(N)CC1=CC=C(C=C1)I MCULE-5322396806 [0,0,0,0,0,0|3,0,1]=4 87 B13R1.133 NC(=O)C(N)CC1=CC=C(C=C1)O MCULE-4534251709 [0,0,0,0,0,0|2,0,1]=3 88 B13R1.133 NC(=O)C(N)CC1=CC=C(C=C1)O MCULE-6666960690 [0,0,0,0,0,0|2,0,1]=3 89 B13R1.133 NC(=O)C(N)CC1=CC=C(C=C1)O MCULE-7581214871 [0,0,0,0,0,0|2,0,1]=3 90 B13R1.133 NC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-2962528193 [0,0,0,0,0,0|2,0,1]=3 91 B13R1.133 NC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-4978506956 [0,0,0,0,0,0|2,0,1]=3 92 B13R1.133 NC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-6881448953 [0,0,0,0,0,0|2,0,1]=3 93 B13R1.133 NC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-8756948838 [0,0,0,0,0,0|2,0,1]=3 94 B13R1.133 NC(=O)[C@H](N)CC1=CC=C(C=C1)O MCULE-3717625016 [0,0,0,0,0,0|2,0,1]=3 95 B13R1.133 NC(=O)[C@H](N)CC1=CC=C(C=C1)O MCULE-5489720734 [0,0,0,0,0,0|2,0,1]=3 96 B13R1.133 NC(=O)[C@H](N)CC1=CC=C(C=C1)O MCULE-6882717101 [0,0,0,0,0,0|2,0,1]=3 97 B13R1.133 NC(CC1=CC=C(C=C1)Br)C(=O)O MCULE-1775451572 [0,0,0,0,0,0|2,0,1]=3 98 B13R1.133 NC(CC1=CC=C(C=C1)Br)C(=O)O MCULE-7470720579 [0,0,0,0,0,0|2,0,1]=3 99 B13R1.133 NC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-2078281838 [0,0,0,0,0,0|2,0,1]=3 100 B13R1.133 NC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-3147443800 [0,0,0,0,0,0|2,0,1]=3 101 B13R1.133 NC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-6446437625 [0,0,0,0,0,0|2,0,1]=3 102 B13R1.133 NC(CC1=CC=C(C=C1)F)C(=O)O MCULE-1002354431 [0,0,0,0,0,0|2,0,1]=3 103 B13R1.133 NC(CC1=CC=C(C=C1)F)C(=O)O MCULE-3057881279 [0,0,0,0,0,0|2,0,1]=3 104 B13R1.133 NC(CC1=CC=C(C=C1)F)C(=O)O MCULE-3274733318 [0,0,0,0,0,0|2,0,1]=3 105 B13R1.133 NC(CC1=CC=C(C=C1)F)C(=O)O MCULE-9271769862 [0,0,0,0,0,0|2,0,1]=3 106 B13R1.133 NC(CC1=CC=C(C=C1)I)C(=O)O MCULE-3082140157 [0,0,0,0,0,0|2,0,1]=3 107 B13R1.133 NC(CC1=CC=C(C=C1)I)C(=O)O MCULE-8666804898 [0,0,0,0,0,0|2,0,1]=3 108 B13R1.133 NC(CC1=CC=C(C=C1)O)C(=O)O MCULE-1694199256 [0,0,0,0,0,0|1,0,1]=2 109 B13R1.133 NC(CC1=CC=C(C=C1)O)C(=O)O MCULE-3703416768 [0,0,0,0,0,0|1,0,1]=2 110 B13R1.133 NC(CC1=CC=C(C=C1)O)C(=O)O MCULE-6898017610 [0,0,0,0,0,0|1,0,1]=2 111 B13R1.133 NC(CC1=CC=C(C=C1)[O-])C(=O)[O-] MCULE-4113012438 [0,0,0,0,0,0|1,0,3]=4 112 B13R1.133 NC(CC1=CC=C(C=C1)[O-])C(=O)[O-] MCULE-6004946837 [0,0,0,0,0,0|1,0,3]=4 113 B13R1.133 NC(CC1=CC=C(C=N1)Cl)C(=O)O MCULE-3104561565 [0,0,0,0,0,0|3,0,1]=4 114 B13R1.133 NC(CC1=CN=C(C=C1)Cl)C(=O)O MCULE-6144527889 [0,0,0,0,0,0|3,0,1]=4 115 B13R1.133 NC(CC1=NC=C(C=C1)Br)C(=O)O MCULE-1184762054 [0,0,0,0,0,0|3,0,1]=4 116 B13R1.133 NC(CC1=NC=C(C=C1)Br)C(=O)O MCULE-3401635049 [0,0,0,0,0,0|3,0,1]=4 117 B13R1.133 NC(CC1=NC=C(C=C1)Cl)C(=O)O MCULE-7003179779 [0,0,0,0,0,0|3,0,1]=4 118 B13R1.133 NC1=CC=C(C=C1)CC(=O)C(=O)O MCULE-1860901630 [0,0,0,0,0,0|1,0,0]=1 119 B13R1.133 NC1=CC=C(C=C1)CC(=O)C(=O)O MCULE-2990155431 [0,0,0,0,0,0|1,0,0]=1 120 B13R1.133 NC1=CC=C(C=C1)CC(N)C(=O)O MCULE-3239737488 [0,0,0,0,0,0|2,0,1]=3 121 B13R1.133 NC1=CC=C(C=C1)CC(N)C(=O)O MCULE-6150381462 [0,0,0,0,0,0|2,0,1]=3 122 B13R1.133 NC1=CC=C(C=C1)CC(N)C(=O)O MCULE-9416228233 [0,0,0,0,0,0|2,0,1]=3 123 B13R1.133 NC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-1451751780 [0,0,0,0,0,0|2,0,1]=3 124 B13R1.133 NC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-2816716756 [0,0,0,0,0,0|2,0,1]=3 125 B13R1.133 NC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-6139445410 [0,0,0,0,0,0|2,0,1]=3 126 B13R1.133 NC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-9266819464 [0,0,0,0,0,0|2,0,1]=3 127 B13R1.133 NC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-2156725008 [0,0,0,0,0,0|2,0,1]=3 128 B13R1.133 NC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-3637255624 [0,0,0,0,0,0|2,0,1]=3 129 B13R1.133 NC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-4975962563 [0,0,0,0,0,0|2,0,1]=3 130 B13R1.133 NC1=CC=C(C=C1)NC(=O)C(=O)O MCULE-8962075139 [0,0,0,0,0,0|2,0,0]=2 131 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-7143135740 [0,0,0,0,0,0|2,0,1]=3 132 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-8089296783 [0,0,0,0,0,0|2,0,1]=3 133 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-4387611400 [0,0,0,0,0,0|2,0,1]=3 134 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-7124632876 [0,0,0,0,0,0|2,0,1]=3 135 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-7237411145 [0,0,0,0,0,0|2,0,1]=3 136 B13R1.133 N[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-9545997189 [0,0,0,0,0,0|2,0,1]=3 137 B13R1.133 N[C@@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-1704209264 [0,0,0,0,0,0|2,0,1]=3 138 B13R1.133 N[C@@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-4577062521 [0,0,0,0,0,0|2,0,1]=3 139 B13R1.133 N[C@@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-8737892544 [0,0,0,0,0,0|2,0,1]=3 140 B13R1.133 N[C@@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-8976470347 [0,0,0,0,0,0|2,0,1]=3 141 B13R1.133 N[C@@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-2723914313 [0,0,0,0,0,0|2,0,1]=3 142 B13R1.133 N[C@@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-6302870801 [0,0,0,0,0,0|2,0,1]=3 143 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-2932088896 [0,0,0,0,0,0|1,0,1]=2 144 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-2973514450 [0,0,0,0,0,0|1,0,1]=2 145 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-6154244493 [0,0,0,0,0,0|1,0,1]=2 146 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-8059108702 [0,0,0,0,0,0|1,0,1]=2 147 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)[O-] MCULE-5588166039 [0,0,0,0,0,0|1,0,2]=3 148 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)[O-] MCULE-6851459722 [0,0,0,0,0,0|1,0,2]=3 149 B13R1.133 N[C@@H](CC1=CC=C(C=C1)[O-])C(=O)[O-] MCULE-1962102238 [0,0,0,0,0,0|1,0,3]=4 150 B13R1.133 N[C@@H](CC1=CC=C(C=C1)[O-])C(=O)[O-] MCULE-2311115551 [0,0,0,0,0,0|1,0,3]=4 151 B13R1.133 N[C@@H](CC1=CC=C(C=N1)Cl)C(=O)O MCULE-8852055943 [0,0,0,0,0,0|3,0,1]=4 152 B13R1.133 N[C@@H](CC1=CC=C(N=C1)Cl)C(=O)O MCULE-1340381614 [0,0,0,0,0,0|3,0,1]=4 153 B13R1.133 N[C@@H](CC1=CC=C(N=C1)Cl)C(=O)O MCULE-5029235962 [0,0,0,0,0,0|3,0,1]=4 154 B13R1.133 N[C@@H](CC1=CN=C(C=C1)Cl)C(=O)O MCULE-5440835507 [0,0,0,0,0,0|3,0,1]=4 155 B13R1.133 N[C@@H](CC1=CN=C(C=C1)Cl)C(=O)O MCULE-6580710907 [0,0,0,0,0,0|3,0,1]=4 156 B13R1.133 N[C@@H](CC1=NC=C(C=C1)Br)C(=O)O MCULE-5841875025 [0,0,0,0,0,0|3,0,1]=4 157 B13R1.133 N[C@@H](CC1=NC=C(C=C1)Br)C(=O)O MCULE-8825878130 [0,0,0,0,0,0|3,0,1]=4 158 B13R1.133 N[C@@H](CC1=NC=C(C=C1)Cl)C(=O)O MCULE-7695251719 [0,0,0,0,0,0|3,0,1]=4 159 B13R1.133 N[C@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-4875394682 [0,0,0,0,0,0|2,0,1]=3 160 B13R1.133 N[C@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-8335788231 [0,0,0,0,0,0|2,0,1]=3 161 B13R1.133 N[C@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-8515191610 [0,0,0,0,0,0|2,0,1]=3 162 B13R1.133 N[C@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-2834745731 [0,0,0,0,0,0|2,0,1]=3 163 B13R1.133 N[C@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-3982277557 [0,0,0,0,0,0|2,0,1]=3 164 B13R1.133 N[C@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-4128938211 [0,0,0,0,0,0|2,0,1]=3 165 B13R1.133 N[C@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-6437321299 [0,0,0,0,0,0|2,0,1]=3 166 B13R1.133 N[C@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-1442650276 [0,0,0,0,0,0|2,0,1]=3 167 B13R1.133 N[C@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-3700362961 [0,0,0,0,0,0|2,0,1]=3 168 B13R1.133 N[C@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-8139852905 [0,0,0,0,0,0|2,0,1]=3 169 B13R1.133 N[C@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-9312923607 [0,0,0,0,0,0|2,0,1]=3 170 B13R1.133 N[C@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-2177794046 [0,0,0,0,0,0|2,0,1]=3 171 B13R1.133 N[C@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-2766032223 [0,0,0,0,0,0|2,0,1]=3 172 B13R1.133 N[C@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-6003337645 [0,0,0,0,0,0|1,0,1]=2 173 B13R1.133 N[C@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-7719741497 [0,0,0,0,0,0|1,0,1]=2 174 B13R1.133 O=C(CC1=CC=C(C=C1)Cl)C(F)F MCULE-4128684312 [0,0,0,0,0,0|3,0,1]=4 175 B13R1.133 O=C(O)/C(=C/C1=CC=C(C=C1)I)/S MCULE-5876833956 [0,0,0,0,0,0|1,1,1]=3 176 B13R1.133 O=C(O)C(=CC1=CC=C(C=C1)Cl)O MCULE-9574800793 [0,0,0,0,0,0|1,0,2]=3 177 B13R1.133 O=C(O)C(=CC1=CC=C(C=C1)Cl)S MCULE-3713803990 [0,0,0,0,0,0|1,1,1]=3 178 B13R1.133 O=C(O)C(=CC1=CC=C(C=C1)F)O MCULE-2063307209 [0,0,0,0,0,0|1,0,2]=3 179 B13R1.133 O=C(O)C(=CC1=CC=C(C=C1)I)S MCULE-6729220491 [0,0,0,0,0,0|1,1,1]=3 180 B13R1.133 O=C(O)C(=O)CC1=CC=C(C=C1)Br MCULE-3734863861 [0,0,0,0,0,0|1,0,0]=1 181 B13R1.133 O=C(O)C(=O)CC1=CC=C(C=C1)Cl MCULE-5251292118 [0,0,0,0,0,0|1,0,0]=1 182 B13R1.133 O=C(O)C(=O)CC1=CC=C(C=C1)F MCULE-8817460511 [0,0,0,0,0,0|1,0,0]=1 183 B13R1.133 O=C(O)C(=O)CC1=CC=C(C=C1)O MCULE-7014208403 [0,0,0,0,0,0|0,0,0]=0 184 B13R1.133 O=C(O)C(=O)NC1=CC=C(C=C1)Br MCULE-5018868730 [0,0,0,0,0,0|2,0,0]=2 185 B13R1.133 O=C(O)C(=O)NC1=CC=C(C=C1)Cl MCULE-7630741687 [0,0,0,0,0,0|2,0,0]=2 186 B13R1.133 O=C(O)C(=O)NC1=CC=C(C=C1)F MCULE-5875994474 [0,0,0,0,0,0|2,0,0]=2 187 B13R1.133 O=C(O)C(=O)NC1=NC=C(C=C1)Cl MCULE-5268718400 [0,0,0,0,0,0|3,0,0]=3 188 B13R1.133 O=C(O)C(Br)CC1=CC=C(C=C1)Cl MCULE-5204071465 [0,0,0,0,0,0|2,0,1]=3 189 B13R1.133 O=C(O)C(Br)CC1=CC=C(C=C1)F MCULE-5681231647 [0,0,0,0,0,0|2,0,1]=3 190 B13R1.133 O=C(O)C(F)CC1=CC=C(C=C1)O MCULE-6083408945 [0,0,0,0,0,0|1,0,1]=2 191 B13R1.133 O=C(O)C(O)CC1=CC=C(C=C1)Br MCULE-7943248642 [0,0,0,0,0,0|1,0,2]=3 192 B13R1.133 O=C(O)C(O)CC1=CC=C(C=C1)Cl MCULE-5286691003 [0,0,0,0,0,0|1,0,2]=3 193 B13R1.133 O=C(O)C(O)CC1=CC=C(C=C1)F MCULE-6155847565 [0,0,0,0,0,0|1,0,2]=3 194 B13R1.133 O=C(O)C(O)CC1=CC=C(C=C1)O MCULE-3818086505 [0,0,0,0,0,0|0,0,2]=2 195 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)Br MCULE-5481131839 [0,0,0,0,0,0|1,0,2]=3 196 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)Cl MCULE-3794917513 [0,0,0,0,0,0|1,0,2]=3 197 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)Cl MCULE-8872282292 [0,0,0,0,0,0|1,0,2]=3 198 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)F MCULE-4209923445 [0,0,0,0,0,0|1,0,2]=3 199 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)I MCULE-3480936336 [0,0,0,0,0,0|1,0,2]=3 200 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)I MCULE-5777591096 [0,0,0,0,0,0|1,0,2]=3 201 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)O MCULE-6006549262 [0,0,0,0,0,0|0,0,2]=2 202 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(C=C1)O MCULE-6391958547 [0,0,0,0,0,0|0,0,2]=2 203 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)Br MCULE-2757025614 [0,0,0,0,0,0|1,0,2]=3 204 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)Br MCULE-5816449429 [0,0,0,0,0,0|1,0,2]=3 205 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)Cl MCULE-2366295919 [0,0,0,0,0,0|1,0,2]=3 206 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)Cl MCULE-3979202399 [0,0,0,0,0,0|1,0,2]=3 207 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)F MCULE-2135193623 [0,0,0,0,0,0|1,0,2]=3 208 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)F MCULE-4947433128 [0,0,0,0,0,0|1,0,2]=3 209 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)O MCULE-3449547842 [0,0,0,0,0,0|0,0,2]=2 210 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(C=C1)O MCULE-5440585564 [0,0,0,0,0,0|0,0,2]=2 211 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)C)C(=O)O MCULE-6439185943 [0,0,0,0,0,0|2,0,1]=3 212 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)N)C(=O)O MCULE-5291387050 [0,0,0,0,0,0|2,0,1]=3 213 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)N)C(=O)O MCULE-6099117172 [0,0,0,0,0,0|2,0,1]=3 214 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)N)C(=O)O MCULE-7165201455 [0,0,0,0,0,0|2,0,1]=3 215 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)O)C(=O)N MCULE-1861808000 [0,0,0,0,0,0|2,0,1]=3 216 B13R1.133 [C@H](N)(CC1=CC=C(C=C1)O)C(=O)N MCULE-5954878034 [0,0,0,0,0,0|2,0,1]=3 217 B13R1.133 [C@H](O)(CC1=CC=C(C=C1)Br)C(=O)O MCULE-1724377709 [0,0,0,0,0,0|1,0,2]=3 218 B13R1.133 [NH3+]C(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-2011771181 [0,0,0,0,0,0|2,0,1]=3 219 B12R1.21 C(=CC1=CC=C(C=C1)I)C(=O)N MCULE-4953492668 [1,0,0,0,0,0|2,0,1]=4 220 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)Br MCULE-4968966219 [1,0,0,0,0,0|2,0,1]=4 221 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)C MCULE-1850770058 [1,0,0,0,0,0|2,0,1]=4 222 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)Cl MCULE-8042406157 [1,0,0,0,0,0|2,0,1]=4 223 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)F MCULE-1896531163 [1,0,0,0,0,0|2,0,1]=4 224 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)O MCULE-3022611575 [1,0,0,0,0,0|1,0,1]=3 225 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)Br MCULE-9469464573 [1,0,0,0,0,0|2,0,1]=4 226 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)C MCULE-3065183970 [1,0,0,0,0,0|2,0,1]=4 227 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)Cl MCULE-4900585766 [1,0,0,0,0,0|2,0,1]=4 228 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)F MCULE-6872409442 [1,0,0,0,0,0|2,0,1]=4 229 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)O MCULE-9722577866 [1,0,0,0,0,0|1,0,1]=3 230 B12R1.21 CC(=O)CCC1=CC=C(C=C1)Br MCULE-5032630211 [1,0,0,0,0,0|2,0,1]=4 231 B12R1.21 CC(=O)CCC1=CC=C(C=C1)C MCULE-3886403881 [1,0,0,0,0,0|2,0,1]=4 232 B12R1.21 CC(=O)CCC1=CC=C(C=C1)Cl MCULE-7275025982 [1,0,0,0,0,0|2,0,1]=4 233 B12R1.21 CC(=O)CCC1=CC=C(C=C1)F MCULE-4146230731 [1,0,0,0,0,0|2,0,1]=4 234 B12R1.21 CC(=O)CCC1=CC=C(C=C1)I MCULE-4528069890 [1,0,0,0,0,0|2,0,1]=4 235 B12R1.21 CC(=O)CCC1=CC=C(C=C1)O MCULE-8771951405 [1,0,0,0,0,0|1,0,1]=3 236 B12R1.21 CC(=O)NCC1=CC=C(C=C1)Br MCULE-5123042587 [1,0,0,0,0,0|3,0,0]=4 237 B12R1.21 CC(=O)NCC1=CC=C(C=C1)C MCULE-9377579573 [1,0,0,0,0,0|3,0,0]=4 238 B12R1.21 CC(=O)NCC1=CC=C(C=C1)Cl MCULE-5148797746 [1,0,0,0,0,0|3,0,0]=4 239 B12R1.21 CC(=O)NCC1=CC=C(C=C1)F MCULE-8735224434 [1,0,0,0,0,0|3,0,0]=4 240 B12R1.21 CC(=O)NCC1=CC=C(C=C1)N MCULE-4826421840 [1,0,0,0,0,0|3,0,0]=4 241 B12R1.21 CC(=O)NCC1=CC=C(C=C1)O MCULE-3038555782 [1,0,0,0,0,0|2,0,0]=3 242 B12R1.21 CC(=O)OCC1=CC=C(C=C1)C MCULE-5313364173 [1,0,0,0,0,0|3,0,0]=4 243 B12R1.21 CC(=O)OCC1=CC=C(C=C1)Cl MCULE-3654865604 [1,0,0,0,0,0|3,0,0]=4 244 B12R1.21 CC(O)CCC1=CC=C(C=C1)O MCULE-1743643873 [1,0,0,0,0,0|1,0,2]=4 245 B12R1.21 CC1=CC=C(C=C1)/C=C/C(=O)Cl MCULE-2058495596 [1,0,0,0,0,0|2,0,1]=4 246 B12R1.21 CC1=CC=C(C=C1)/C=C/C(=O)O MCULE-4218057596 [1,0,0,0,0,0|1,0,1]=3 247 B12R1.21 CC1=CC=C(C=C1)C#CC(=O)O MCULE-1939935257 [1,0,0,0,0,0|1,0,2]=4 248 B12R1.21 CC1=CC=C(C=C1)C=CC(=O)Cl MCULE-5021343987 [1,0,0,0,0,0|2,0,1]=4 249 B12R1.21 CC1=CC=C(C=C1)C=CC(=O)N MCULE-5979163187 [1,0,0,0,0,0|2,0,1]=4 250 B12R1.21 CC1=CC=C(C=C1)C=CC(=O)O MCULE-7310353888 [1,0,0,0,0,0|1,0,1]=3 251 B12R1.21 CC1=CC=C(C=C1)CCC(=O)Cl MCULE-3838448821 [1,0,0,0,0,0|2,0,1]=4 252 B12R1.21 CC1=CC=C(C=C1)CCC(=O)N MCULE-1037276919 [1,0,0,0,0,0|2,0,1]=4 253 B12R1.21 CC1=CC=C(C=C1)CCC(=O)O MCULE-3130199239 [1,0,0,0,0,0|1,0,1]=3 254 B12R1.21 CC1=CC=C(C=C1)CNC(=O)N MCULE-2888234935 [1,0,0,0,0,0|3,0,0]=4 255 B12R1.21 CC1=CC=C(C=C1)NCC(=O)O MCULE-3209745558 [1,0,0,0,0,0|2,0,1]=4 256 B12R1.21 CC1=CC=C(C=C1)OCC(=O)O MCULE-6655773819 [1,0,0,0,0,0|2,0,1]=4 257 B12R1.21 CC1=CC=C(C=C1)SCC(=O)O MCULE-6165213613 [1,0,0,0,0,0|2,0,1]=4 258 B12R1.21 CC1=CC=C(C=N1)CCC(=O)O MCULE-2456319798 [1,0,0,0,0,0|2,0,1]=4 259 B12R1.21 CC1=CC=[N+](C=C1)CCC(=O)O MCULE-7103855112 [1,0,0,0,0,0|2,0,1]=4 260 B12R1.21 CC1=CC=[N+](C=C1)CCC(=O)O MCULE-8465932154 [1,0,0,0,0,0|2,0,1]=4 261 B12R1.21 CC1=CN=C(C=C1)CCC(=O)O MCULE-5456784327 [1,0,0,0,0,0|2,0,1]=4 262 B12R1.21 C[C@@H](O)CCC1=CC=C(C=C1)O MCULE-5901999576 [1,0,0,0,0,0|1,0,2]=4 263 B12R1.21 C[C@@H](O)CCC1=CC=C(C=C1)O MCULE-8613264387 [1,0,0,0,0,0|1,0,2]=4 264 B12R1.21 C[C@H](O)CCC1=CC=C(C=C1)O MCULE-4216892656 [1,0,0,0,0,0|1,0,2]=4 265 B12R1.21 C[C@H](O)CCC1=CC=C(C=C1)O MCULE-8670625635 [1,0,0,0,0,0|1,0,2]=4 266 B12R1.21 N=C(N)CCC1=CC=C(C=C1)O MCULE-4076608372 [1,0,0,0,0,0|2,0,1]=4 267 B12R1.21 N=C(N)CCC1=CC=C(C=C1)O MCULE-6645175325 [1,0,0,0,0,0|2,0,1]=4 268 B12R1.21 NC(=O)/C=C/C1=CC=C(C=C1)Br MCULE-9474644627 [1,0,0,0,0,0|2,0,1]=4 269 B12R1.21 NC(=O)/C=C/C1=CC=C(C=C1)Cl MCULE-4399110657 [1,0,0,0,0,0|2,0,1]=4 270 B12R1.21 NC(=O)/C=C/C1=CC=C(C=C1)O MCULE-7972851464 [1,0,0,0,0,0|1,0,1]=3 271 B12R1.21 NC(=O)C=CC1=CC=C(C=C1)Br MCULE-2059664507 [1,0,0,0,0,0|2,0,1]=4 272 B12R1.21 NC(=O)C=CC1=CC=C(C=C1)Cl MCULE-9226277544 [1,0,0,0,0,0|2,0,1]=4 273 B12R1.21 NC(=O)C=CC1=CC=C(C=C1)F MCULE-3516681833 [1,0,0,0,0,0|2,0,1]=4 274 B12R1.21 NC(=O)C=CC1=CC=C(C=C1)O MCULE-1974045025 [1,0,0,0,0,0|1,0,1]=3 275 B12R1.21 NC(=O)CCC1=CC=C(C=C1)Br MCULE-6247833294 [1,0,0,0,0,0|2,0,1]=4 276 B12R1.21 NC(=O)CCC1=CC=C(C=C1)F MCULE-9316686554 [1,0,0,0,0,0|2,0,1]=4 277 B12R1.21 NC(=O)CCC1=CC=C(C=C1)N MCULE-9065854031 [1,0,0,0,0,0|2,0,1]=4 278 B12R1.21 NC(=O)CCC1=CC=C(C=C1)O MCULE-6107630328 [1,0,0,0,0,0|1,0,1]=3 279 B12R1.21 NC(=O)COC1=CC=C(C=C1)O MCULE-8633247555 [1,0,0,0,0,0|2,0,1]=4 280 B12R1.21 NC(=O)NCC1=CC=C(C=C1)Cl MCULE-3234239362 [1,0,0,0,0,0|3,0,0]=4 281 B12R1.21 NC(=O)NCC1=CC=C(C=C1)F MCULE-9074250951 [1,0,0,0,0,0|3,0,0]=4 282 B12R1.21 NC(=O)NCC1=CC=C(C=C1)N MCULE-1936986239 [1,0,0,0,0,0|3,0,0]=4 283 B12R1.21 NC1=CC=C(C=C1)/C=C/C(=O)O MCULE-6477711177 [1,0,0,0,0,0|1,0,1]=3 284 B12R1.21 NC1=CC=C(C=C1)C=CC(=O)O MCULE-9065250783 [1,0,0,0,0,0|1,0,1]=3 285 B12R1.21 NC1=CC=C(C=C1)CCC(=O)O MCULE-5126543796 [1,0,0,0,0,0|1,0,1]=3 286 B12R1.21 NC1=CC=C(C=C1)CCC(=O)O MCULE-9559825152 [1,0,0,0,0,0|1,0,1]=3 287 B12R1.21 NC1=CC=C(C=C1)OCC(=O)O MCULE-5505108288 [1,0,0,0,0,0|2,0,1]=4 288 B12R1.21 NC1=CC=C(C=C1)SCC(=O)O MCULE-6773423539 [1,0,0,0,0,0|2,0,1]=4 289 B12R1.21 NC1=CC=C(C=N1)CCC(=O)O MCULE-7626186877 [1,0,0,0,0,0|2,0,1]=4 290 B12R1.21 NC1=CN=C(C=C1)CCC(=O)O MCULE-9677931320 [1,0,0,0,0,0|2,0,1]=4 291 B12R1.21 NC1=NC=C(C=C1)/C=C/C(=O)O MCULE-9571181864 [1,0,0,0,0,0|2,0,1]=4 292 B12R1.21 NC1=NC=C(C=C1)C=CC(=O)O MCULE-9262977474 [1,0,0,0,0,0|2,0,1]=4 293 B12R1.21 NC1=NC=C(C=C1)CCC(=O)O MCULE-4214871845 [1,0,0,0,0,0|2,0,1]=4 294 B12R1.21 O=C(Cl)/C=C/C1=CC=C(C=C1)Br MCULE-1656107943 [1,0,0,0,0,0|2,0,1]=4 295 B12R1.21 O=C(Cl)/C=C/C1=CC=C(C=C1)Cl MCULE-5462639794 [1,0,0,0,0,0|2,0,1]=4 296 B12R1.21 O=C(Cl)/C=C/C1=CC=C(C=C1)F MCULE-3036184092 [1,0,0,0,0,0|2,0,1]=4 297 B12R1.21 O=C(Cl)C=CC1=CC=C(C=C1)Br MCULE-6741932936 [1,0,0,0,0,0|2,0,1]=4 298 B12R1.21 O=C(Cl)C=CC1=CC=C(C=C1)Cl MCULE-4301034303 [1,0,0,0,0,0|2,0,1]=4 299 B12R1.21 O=C(Cl)C=CC1=CC=C(C=C1)F MCULE-4813703106 [1,0,0,0,0,0|2,0,1]=4 300 B12R1.21 O=C(Cl)CCC1=CC=C(C=C1)Br MCULE-4750259114 [1,0,0,0,0,0|2,0,1]=4 301 B12R1.21 O=C(Cl)CCC1=CC=C(C=C1)Cl MCULE-6095798494 [1,0,0,0,0,0|2,0,1]=4 302 B12R1.21 O=C(Cl)CCC1=CC=C(C=C1)F MCULE-6286582016 [1,0,0,0,0,0|2,0,1]=4 303 B12R1.21 O=C(Cl)CCC1=CC=C(C=C1)O MCULE-6255281310 [1,0,0,0,0,0|1,0,1]=3 304 B12R1.21 O=C(Cl)OCC1=CC=C(C=C1)Br MCULE-2179312369 [1,0,0,0,0,0|3,0,0]=4 305 B12R1.21 O=C(Cl)OCC1=CC=C(C=C1)Cl MCULE-4206803949 [1,0,0,0,0,0|3,0,0]=4 306 B12R1.21 O=C(Cl)OCC1=CC=C(C=C1)F MCULE-7280261927 [1,0,0,0,0,0|3,0,0]=4 307 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)Br MCULE-4289979015 [1,0,0,0,0,0|1,0,1]=3 308 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)Cl MCULE-4318861622 [1,0,0,0,0,0|1,0,1]=3 309 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)F MCULE-9538614113 [1,0,0,0,0,0|1,0,1]=3 310 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)I MCULE-3328397950 [1,0,0,0,0,0|1,0,1]=3 311 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)O MCULE-9551292063 [1,0,0,0,0,0|0,0,1]=2 312 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)S MCULE-2486115993 [1,0,0,0,0,0|0,1,1]=3 313 B12R1.21 O=C(O)/C=C/C1=CC=C(N=C1)Br MCULE-9625493002 [1,0,0,0,0,0|2,0,1]=4 314 B12R1.21 O=C(O)/C=C/C1=CN=C(C=C1)Cl MCULE-4772490742 [1,0,0,0,0,0|2,0,1]=4 315 B12R1.21 O=C(O)/C=C/C1=NC=C(C=C1)F MCULE-2551687293 [1,0,0,0,0,0|2,0,1]=4 316 B12R1.21 O=C(O)/C=C/C1=NC=C(C=C1)F MCULE-9601983386 [1,0,0,0,0,0|2,0,1]=4 317 B12R1.21 O=C(O)C#CC1=CC=C(C=C1)Br MCULE-6509182116 [1,0,0,0,0,0|1,0,2]=4 318 B12R1.21 O=C(O)C#CC1=CC=C(C=C1)Cl MCULE-8696710053 [1,0,0,0,0,0|1,0,2]=4 319 B12R1.21 O=C(O)C#CC1=CC=C(C=C1)F MCULE-5876764996 [1,0,0,0,0,0|1,0,2]=4 320 B12R1.21 O=C(O)C#CC1=CC=C(C=C1)O MCULE-2564850163 [1,0,0,0,0,0|0,0,2]=3 321 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)Br MCULE-6214703716 [1,0,0,0,0,0|1,0,1]=3 322 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)Cl MCULE-6051545485 [1,0,0,0,0,0|1,0,1]=3 323 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)F MCULE-8711973543 [1,0,0,0,0,0|1,0,1]=3 324 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)I MCULE-2006397145 [1,0,0,0,0,0|1,0,1]=3 325 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)O MCULE-2590309260 [1,0,0,0,0,0|0,0,1]=2 326 B12R1.21 O=C(O)C=CC1=CC=C(C=C1)S MCULE-4579832892 [1,0,0,0,0,0|0,1,1]=3 327 B12R1.21 O=C(O)C=CC1=CC=C(N=C1)Br MCULE-1067022604 [1,0,0,0,0,0|2,0,1]=4 328 B12R1.21 O=C(O)C=CC1=CN=C(C=C1)Cl MCULE-5983392112 [1,0,0,0,0,0|2,0,1]=4 329 B12R1.21 O=C(O)C=CC1=NC=C(C=C1)F MCULE-3616932768 [1,0,0,0,0,0|2,0,1]=4 330 B12R1.21 O=C(O)C=CC1=NC=C(C=C1)F MCULE-9950644550 [1,0,0,0,0,0|2,0,1]=4 331 B12R1.21 O=C(O)CCC1=CC=C(C=C1)Br MCULE-4543776346 [1,0,0,0,0,0|1,0,1]=3 332 B12R1.21 O=C(O)CCC1=CC=C(C=C1)Cl MCULE-1600813005 [1,0,0,0,0,0|1,0,1]=3 333 B12R1.21 O=C(O)CCC1=CC=C(C=C1)F MCULE-1294455319 [1,0,0,0,0,0|1,0,1]=3 334 B12R1.21 O=C(O)CCC1=CC=C(C=C1)I MCULE-9257606064 [1,0,0,0,0,0|1,0,1]=3 335 B12R1.21 O=C(O)CCC1=CC=C(C=C1)O MCULE-6058509896 [1,0,0,0,0,0|0,0,1]=2 336 B12R1.21 O=C(O)CCC1=CC=C(C=C1)S MCULE-3033443514 [1,0,0,0,0,0|0,1,1]=3 337 B12R1.21 O=C(O)CCC1=CC=C(N=C1)Br MCULE-8674708546 [1,0,0,0,0,0|2,0,1]=4 338 B12R1.21 O=C(O)CCC1=CC=C(N=C1)F MCULE-3454488694 [1,0,0,0,0,0|2,0,1]=4 339 B12R1.21 O=C(O)CCC1=CN=C(C=C1)Cl MCULE-5091357831 [1,0,0,0,0,0|2,0,1]=4 340 B12R1.21 O=C(O)CCC1=CNC(=O)C=C1 MCULE-2339654344 [1,0,0,0,0,0|1,0,2]=4 341 B12R1.21 O=C(O)CCC1=CNC(=O)C=C1 MCULE-4103457533 [1,0,0,0,0,0|1,0,2]=4 342 B12R1.21 O=C(O)CCC1=NC=C(C=C1)Br MCULE-7064440494 [1,0,0,0,0,0|2,0,1]=4 343 B12R1.21 O=C(O)CNC1=CC=C(C=C1)Br MCULE-1005193463 [1,0,0,0,0,0|2,0,1]=4 344 B12R1.21 O=C(O)CNC1=CC=C(C=C1)Cl MCULE-7511412994 [1,0,0,0,0,0|2,0,1]=4 345 B12R1.21 O=C(O)CNC1=CC=C(C=C1)Cl MCULE-9676921611 [1,0,0,0,0,0|2,0,1]=4 346 B12R1.21 O=C(O)CNC1=CC=C(C=C1)F MCULE-5532990900 [1,0,0,0,0,0|2,0,1]=4 347 B12R1.21 O=C(O)CNC1=CC=C(C=C1)I MCULE-5559141508 [1,0,0,0,0,0|2,0,1]=4 348 B12R1.21 O=C(O)CNC1=CC=C(C=C1)O MCULE-7475897538 [1,0,0,0,0,0|1,0,1]=3 349 B12R1.21 O=C(O)COC1=CC=C(C=C1)Br MCULE-1086285737 [1,0,0,0,0,0|2,0,1]=4 350 B12R1.21 O=C(O)COC1=CC=C(C=C1)Cl MCULE-9539789488 [1,0,0,0,0,0|2,0,1]=4 351 B12R1.21 O=C(O)COC1=CC=C(C=C1)F MCULE-9999059727 [1,0,0,0,0,0|2,0,1]=4 352 B12R1.21 O=C(O)COC1=CC=C(C=C1)I MCULE-2347603234 [1,0,0,0,0,0|2,0,1]=4 353 B12R1.21 O=C(O)COC1=CC=C(C=C1)O MCULE-1682652071 [1,0,0,0,0,0|1,0,1]=3 354 B12R1.21 O=C(O)CSC1=CC=C(C=C1)Br MCULE-9317070286 [1,0,0,0,0,0|2,0,1]=4 355 B12R1.21 O=C(O)CSC1=CC=C(C=C1)Cl MCULE-5442245504 [1,0,0,0,0,0|2,0,1]=4 356 B12R1.21 O=C(O)CSC1=CC=C(C=C1)F MCULE-8846349352 [1,0,0,0,0,0|2,0,1]=4 357 B12R1.21 O=C(O)CSC1=CC=C(C=C1)O MCULE-7002993892 [1,0,0,0,0,0|1,0,1]=3 358 B12R1.21 O=N(=O)/C=C/C1=CC=C(C=C1)O MCULE-5720468873 [1,0,0,0,0,0|1,0,2]=4 359 B12R1.21 O=[N+]([O-])C=CC1=CC=C(C=C1)O MCULE-2325784233 [1,0,0,0,0,0|1,0,2]=4 360 B12R1.21 [NH3+]C1=CC=C(C=C1)C=CC(=O)O MCULE-3210030968 [1,0,0,0,0,0|1,0,1]=3 361 B12R1.43 C/C(=C\C1=CC=CC=C1)/C(=O)O MCULE-2320385089 [1,0,0,0,0,0|1,0,1]=3 362 B12R1.43 C/C(=C\C1=CC=CC=N1)/C(=O)O MCULE-7937709933 [1,0,0,0,0,0|2,0,1]=4 363 B12R1.43 C=C(C)C(=O)NC1=CC=CC=C1 MCULE-2161848745 [1,0,0,0,0,0|3,0,0]=4 364 B12R1.43 C=C(C)C(=O)OC1=CC=CC=C1 MCULE-5388245105 [1,0,0,0,0,0|3,0,0]=4 365 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O MCULE-6200285839 [1,0,0,0,0,0|1,0,0]=2 366 B12R1.43 C=C(CC1=CC=CC=C1)N(=O)=O MCULE-8033429892 [1,0,0,0,0,0|2,0,1]=4 367 B12R1.43 CC(=CC1=CC=CC=C1)C(=O)Cl MCULE-2710676961 [1,0,0,0,0,0|2,0,1]=4 368 B12R1.43 CC(=CC1=CC=CC=C1)C(=O)O MCULE-9237421946 [1,0,0,0,0,0|1,0,1]=3 369 B12R1.43 CC(=CC1=CC=NC=C1)C(=O)O MCULE-4497311492 [1,0,0,0,0,0|2,0,1]=4 370 B12R1.43 CC(=CC1=CC=NC=C1)C(=O)O MCULE-9348219643 [1,0,0,0,0,0|2,0,1]=4 371 B12R1.43 CC(=CC1=CN=CC=C1)C(=O)O MCULE-3384877642 [1,0,0,0,0,0|2,0,1]=4 372 B12R1.43 CC(=CC1=CN=CC=C1)C(=O)O MCULE-7592730750 [1,0,0,0,0,0|2,0,1]=4 373 B12R1.43 CC(=CC1=NC=CC=C1)C(=O)O MCULE-1302740145 [1,0,0,0,0,0|2,0,1]=4 374 B12R1.43 CC(=CC1=NC=CC=C1)C(=O)O MCULE-2513369896 [1,0,0,0,0,0|2,0,1]=4 375 B12R1.43 CC(=O)C(=CC1=CC=CC=C1)C MCULE-3659200622 [1,0,0,0,0,0|2,0,1]=4 376 B12R1.43 CC(=O)C(=O)NC1=CC=CC=C1 MCULE-8022797415 [1,0,0,0,0,0|2,0,0]=3 377 B12R1.43 CC(=O)C(Br)CC1=CC=CC=C1 MCULE-1714878295 [1,0,0,0,0,0|2,0,1]=4 378 B12R1.43 CC(=O)C(C)CC1=CC=CC=C1 MCULE-9879731396 [1,0,0,0,0,0|2,0,1]=4 379 B12R1.43 CC(=O)C(N)CC1=CC=CC=C1 MCULE-4230256436 [1,0,0,0,0,0|2,0,1]=4 380 B12R1.43 CC(=O)C(N)CC1=CC=CC=C1 MCULE-7161249545 [1,0,0,0,0,0|2,0,1]=4 381 B12R1.43 CC(C)C(=O)CC1=CC=CC=C1 MCULE-9885166054 [1,0,0,0,0,0|2,0,1]=4 382 B12R1.43 CC(CC1=CC=CC=C1)C(=O)Cl MCULE-6045163933 [1,0,0,0,0,0|2,0,1]=4 383 B12R1.43 CC(CC1=CC=CC=C1)C(=O)N MCULE-5416273234 [1,0,0,0,0,0|2,0,1]=4 384 B12R1.43 CC(CC1=CC=CC=C1)C(=O)O MCULE-7326511541 [1,0,0,0,0,0|1,0,1]=3 385 B12R1.43 CC(CC1=CC=CN=C1)C(=O)O MCULE-2945865799 [1,0,0,0,0,0|2,0,1]=4 386 B12R1.43 CC(CC1=CC=CN=C1)C(=O)O MCULE-5331249082 [1,0,0,0,0,0|2,0,1]=4 387 B12R1.43 CC(CC1=CC=NC=C1)C(=O)O MCULE-6152899620 [1,0,0,0,0,0|2,0,1]=4 388 B12R1.43 CC(CC1=NC=CC=C1)C(=O)O MCULE-6566847057 [1,0,0,0,0,0|2,0,1]=4 389 B12R1.43 CC(Cl)C(=O)CC1=CC=CC=C1 MCULE-7044884857 [1,0,0,0,0,0|2,0,1]=4 390 B12R1.43 CC(N)C(=O)CC1=CC=CC=C1 MCULE-2364068353 [1,0,0,0,0,0|2,0,1]=4 391 B12R1.43 CC(N)C(=O)CC1=CC=CC=C1 MCULE-2655571103 [1,0,0,0,0,0|2,0,1]=4 392 B12R1.43 CC(NC1=CC=CC=C1)C(=O)O MCULE-7005885995 [1,0,0,0,0,0|2,0,1]=4 393 B12R1.43 CC(O)C(=O)NC1=CC=CC=C1 MCULE-7131684264 [1,0,0,0,0,0|2,0,1]=4 394 B12R1.43 CC(OC1=CC=CC=C1)C(=O)O MCULE-3922404950 [1,0,0,0,0,0|2,0,1]=4 395 B12R1.43 CC(SC1=CC=CC=C1)C(=O)O MCULE-9280194220 [1,0,0,0,0,0|2,0,1]=4 396 B12R1.43 CN(C)C(=O)CC1=CC=CC=C1 MCULE-7767291513 [1,0,0,0,0,0|3,0,0]=4 397 B12R1.43 CN(CC1=CC=CC=C1)C(=O)Cl MCULE-2535776595 [1,0,0,0,0,0|3,0,0]=4 398 B12R1.43 CN(O)C(=O)NC1=CC=CC=C1 MCULE-5203128902 [1,0,0,0,0,0|3,0,0]=4 399 B12R1.43 C[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-2382098458 [1,0,0,0,0,0|1,0,1]=3 400 B12R1.43 C[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-3028530630 [1,0,0,0,0,0|1,0,1]=3 401 B12R1.43 C[C@@H](OC1=CC=CC=C1)C(=O)O MCULE-2381911676 [1,0,0,0,0,0|2,0,1]=4 402 B12R1.43 C[C@@H](OC1=CC=CC=C1)C(=O)O MCULE-5540145744 [1,0,0,0,0,0|2,0,1]=4 403 B12R1.43 C[C@H](CC1=CC=CC=C1)C(=O)O MCULE-5116283906 [1,0,0,0,0,0|1,0,1]=3 404 B12R1.43 C[C@H](NC1=CC=CC=C1)C(=O)O MCULE-1832900891 [1,0,0,0,0,0|2,0,1]=4 405 B12R1.43 C[C@H](OC1=CC=CC=C1)C(=O)O MCULE-1535867362 [1,0,0,0,0,0|2,0,1]=4 406 B12R1.43 C[C@H](OC1=CC=CC=C1)C(=O)O MCULE-6976463834 [1,0,0,0,0,0|2,0,1]=4 407 B12R1.43 NC(=O)C(=O)NC1=CC=CC=C1 MCULE-8843324862 [1,0,0,0,0,0|2,0,0]=3 408 B12R1.43 NC(=O)C(=S)NC1=CC=CC=C1 MCULE-1302082658 [1,0,0,0,0,0|2,1,0]=4 409 B12R1.43 NC(=O)C(Br)CC1=CC=CC=C1 MCULE-8335898952 [1,0,0,0,0,0|2,0,1]=4 410 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 MCULE-2161822841 [1,0,0,0,0,0|2,0,1]=4 411 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 MCULE-2610261909 [1,0,0,0,0,0|2,0,1]=4 412 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 MCULE-9345667353 [1,0,0,0,0,0|2,0,1]=4 413 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 MCULE-9732246414 [1,0,0,0,0,0|2,0,1]=4 414 B12R1.43 NC(=O)C(O)CC1=CC=CC=C1 MCULE-2820917516 [1,0,0,0,0,0|1,0,2]=4 415 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-6548337580 [1,0,0,0,0,0|2,0,1]=4 416 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-7119612436 [1,0,0,0,0,0|2,0,1]=4 417 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-9635114334 [1,0,0,0,0,0|2,0,1]=4 418 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-3676093786 [1,0,0,0,0,0|2,0,1]=4 419 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-5027501057 [1,0,0,0,0,0|2,0,1]=4 420 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-5946837057 [1,0,0,0,0,0|2,0,1]=4 421 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-8948644005 [1,0,0,0,0,0|2,0,1]=4 422 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O MCULE-4509365715 [1,0,0,0,0,0|1,0,1]=3 423 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O MCULE-9481096822 [1,0,0,0,0,0|1,0,1]=3 424 B12R1.43 NC(CC1=CC=CN=C1)C(=O)O MCULE-3369503748 [1,0,0,0,0,0|2,0,1]=4 425 B12R1.43 NC(CC1=CC=CN=C1)C(=O)O MCULE-4500681212 [1,0,0,0,0,0|2,0,1]=4 426 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O MCULE-3037053990 [1,0,0,0,0,0|2,0,1]=4 427 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O MCULE-3740298834 [1,0,0,0,0,0|2,0,1]=4 428 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O MCULE-4165068673 [1,0,0,0,0,0|2,0,1]=4 429 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O MCULE-8377448441 [1,0,0,0,0,0|2,0,1]=4 430 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O MCULE-9526041825 [1,0,0,0,0,0|2,0,1]=4 431 B12R1.43 NC(CC1=CN=CC=C1)C(=O)O MCULE-2658135318 [1,0,0,0,0,0|2,0,1]=4 432 B12R1.43 NC(CC1=CN=CC=C1)C(=O)O MCULE-4065287784 [1,0,0,0,0,0|2,0,1]=4 433 B12R1.43 NC(CC1=CN=CC=C1)C(=O)O MCULE-4169399134 [1,0,0,0,0,0|2,0,1]=4 434 B12R1.43 NC(CC1=NC=CC=C1)C(=O)O MCULE-2466401514 [1,0,0,0,0,0|2,0,1]=4 435 B12R1.43 NC(CC1=NC=CC=C1)C(=O)O MCULE-7994000866 [1,0,0,0,0,0|2,0,1]=4 436 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-1311765992 [1,0,0,0,0,0|1,0,1]=3 437 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-4249753593 [1,0,0,0,0,0|1,0,1]=3 438 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-5960921520 [1,0,0,0,0,0|1,0,1]=3 439 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-9410526237 [1,0,0,0,0,0|1,0,1]=3 440 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-1318776684 [1,0,0,0,0,0|2,0,1]=4 441 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-2756511850 [1,0,0,0,0,0|2,0,1]=4 442 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-6450114631 [1,0,0,0,0,0|2,0,1]=4 443 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-6451205573 [1,0,0,0,0,0|2,0,1]=4 444 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-6819782094 [1,0,0,0,0,0|2,0,1]=4 445 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O MCULE-7779462392 [1,0,0,0,0,0|2,0,1]=4 446 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O MCULE-1319584746 [1,0,0,0,0,0|2,0,1]=4 447 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O MCULE-4038860269 [1,0,0,0,0,0|2,0,1]=4 448 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O MCULE-5445835001 [1,0,0,0,0,0|2,0,1]=4 449 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O MCULE-9469765262 [1,0,0,0,0,0|2,0,1]=4 450 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O MCULE-1225994987 [1,0,0,0,0,0|2,0,1]=4 451 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O MCULE-1559053573 [1,0,0,0,0,0|2,0,1]=4 452 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O MCULE-2320178150 [1,0,0,0,0,0|2,0,1]=4 453 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-2148272872 [1,0,0,0,0,0|1,0,1]=3 454 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-2197316791 [1,0,0,0,0,0|1,0,1]=3 455 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-2827782619 [1,0,0,0,0,0|1,0,1]=3 456 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-3011969403 [1,0,0,0,0,0|1,0,1]=3 457 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O MCULE-3394687698 [1,0,0,0,0,0|2,0,1]=4 458 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O MCULE-4997997022 [1,0,0,0,0,0|2,0,1]=4 459 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O MCULE-5673410743 [1,0,0,0,0,0|2,0,1]=4 460 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O MCULE-8503334355 [1,0,0,0,0,0|2,0,1]=4 461 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O MCULE-9702283993 [1,0,0,0,0,0|2,0,1]=4 462 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O MCULE-1530965630 [1,0,0,0,0,0|2,0,1]=4 463 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O MCULE-2261526216 [1,0,0,0,0,0|2,0,1]=4 464 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O MCULE-5458063668 [1,0,0,0,0,0|2,0,1]=4 465 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O MCULE-8584771604 [1,0,0,0,0,0|2,0,1]=4 466 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O MCULE-2767701043 [1,0,0,0,0,0|2,0,1]=4 467 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O MCULE-3184854322 [1,0,0,0,0,0|2,0,1]=4 468 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O MCULE-5316652497 [1,0,0,0,0,0|2,0,1]=4 469 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O MCULE-8407561976 [1,0,0,0,0,0|2,0,1]=4 470 B12R1.43 O=C(CC1=CC=CC=C1)C(F)F MCULE-6534668201 [1,0,0,0,0,0|2,0,1]=4 471 B12R1.43 O=C(Cl)C(Br)CC1=CC=CC=C1 MCULE-8151311396 [1,0,0,0,0,0|2,0,1]=4 472 B12R1.43 O=C(O)/C(=C/C1=CC=CC=C1)/Cl MCULE-5967816434 [1,0,0,0,0,0|1,0,1]=3 473 B12R1.43 O=C(O)/C(=C/C1=CC=CC=C1)/F MCULE-1278212404 [1,0,0,0,0,0|1,0,1]=3 474 B12R1.43 O=C(O)/C(=C/C1=CC=CC=C1)/O MCULE-9639825195 [1,0,0,0,0,0|0,0,2]=3 475 B12R1.43 O=C(O)/C(=C/C1=CC=CN=C1)/F MCULE-3005239361 [1,0,0,0,0,0|2,0,1]=4 476 B12R1.43 O=C(O)C(=CC1=CC=CC=C1)Cl MCULE-1012118487 [1,0,0,0,0,0|1,0,1]=3 477 B12R1.43 O=C(O)C(=CC1=CC=CC=C1)F MCULE-5587932542 [1,0,0,0,0,0|1,0,1]=3 478 B12R1.43 O=C(O)C(=CC1=CC=CC=C1)O MCULE-9904864252 [1,0,0,0,0,0|0,0,2]=3 479 B12R1.43 O=C(O)C(=CC1=CC=CC=C1)S MCULE-7966134349 [1,0,0,0,0,0|0,1,1]=3 480 B12R1.43 O=C(O)C(=CC1=CC=CN=C1)S MCULE-9764587748 [1,0,0,0,0,0|1,1,1]=4 481 B12R1.43 O=C(O)C(=CC1=CN=CC=C1)F MCULE-3500064918 [1,0,0,0,0,0|2,0,1]=4 482 B12R1.43 O=C(O)C(=CC1=CN=CC=C1)F MCULE-5834768457 [1,0,0,0,0,0|2,0,1]=4 483 B12R1.43 O=C(O)C(=O)CC1=CC=CC=C1 MCULE-9935480822 [1,0,0,0,0,0|0,0,0]=1 484 B12R1.43 O=C(O)C(=O)NC1=CC=CC=C1 MCULE-2107757064 [1,0,0,0,0,0|1,0,0]=2 485 B12R1.43 O=C(O)C(=O)NC1=CC=CC=N1 MCULE-4370089229 [1,0,0,0,0,0|2,0,0]=3 486 B12R1.43 O=C(O)C(=O)NC1=CC=CN=C1 MCULE-9086642065 [1,0,0,0,0,0|2,0,0]=3 487 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 MCULE-1864489061 [1,0,0,0,0,0|1,0,1]=3 488 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 MCULE-5141593227 [1,0,0,0,0,0|1,0,1]=3 489 B12R1.43 O=C(O)C(Br)C[N+]1=CC=CC=C1 MCULE-5162156323 [1,0,0,0,0,0|2,0,1]=4 490 B12R1.43 O=C(O)C(Br)C[N+]1=CC=CC=C1 MCULE-5251609604 [1,0,0,0,0,0|2,0,1]=4 491 B12R1.43 O=C(O)C(F)CC1=CC=CC=C1 MCULE-9166012619 [1,0,0,0,0,0|1,0,1]=3 492 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 MCULE-8315491131 [1,0,0,0,0,0|0,0,2]=3 493 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 MCULE-9508817950 [1,0,0,0,0,0|0,0,2]=3 494 B12R1.43 O=C(O)C(O)CC1=CC=CN=C1 MCULE-6280644145 [1,0,0,0,0,0|1,0,2]=4 495 B12R1.43 O=C(O)C(S)CC1=CC=CC=C1 MCULE-2786315780 [1,0,0,0,0,0|0,1,1]=3 496 B12R1.43 O=C(O)[C@@H](Br)CC1=CC=CC=C1 MCULE-4327885480 [1,0,0,0,0,0|1,0,1]=3 497 B12R1.43 O=C(O)[C@@H](Br)CC1=CC=CC=C1 MCULE-7060788630 [1,0,0,0,0,0|1,0,1]=3 498 B12R1.43 O=C(O)[C@@H](Cl)CC1=CC=CC=C1 MCULE-1955124001 [1,0,0,0,0,0|1,0,1]=3 499 B12R1.43 O=C(O)[C@@H](Cl)CC1=CC=CC=C1 MCULE-2054040205 [1,0,0,0,0,0|1,0,1]=3 500 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 MCULE-1839486703 [1,0,0,0,0,0|0,0,2]=3 501 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 MCULE-4919076158 [1,0,0,0,0,0|0,0,2]=3 502 B12R1.43 O=C(O)[C@H](Br)CC1=CC=CC=C1 MCULE-7765977229 [1,0,0,0,0,0|1,0,1]=3 503 B12R1.43 O=C(O)[C@H](Br)CC1=CC=CC=C1 MCULE-9087197160 [1,0,0,0,0,0|1,0,1]=3 504 B12R1.43 O=C(O)[C@H](Cl)CC1=CC=CC=C1 MCULE-1353432482 [1,0,0,0,0,0|1,0,1]=3 505 B12R1.43 O=C(O)[C@H](Cl)CC1=CC=CC=C1 MCULE-5962224015 [1,0,0,0,0,0|1,0,1]=3 506 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 MCULE-2910632779 [1,0,0,0,0,0|0,0,2]=3 507 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 MCULE-9829239357 [1,0,0,0,0,0|0,0,2]=3 508 B12R1.43 O=C(O)[C@H](S)CC1=CC=CC=C1 MCULE-6360971092 [1,0,0,0,0,0|0,1,1]=3 509 B12R1.43 O=C([O-])C(=O)CC1=CC=CC=C1 MCULE-2474116698 [1,0,0,0,0,0|0,0,1]=2 510 B12R1.43 O=C([O-])C(=O)NC1=CC=CC=C1 MCULE-8215793073 [1,0,0,0,0,0|1,0,1]=3 511 B12R1.43 [C@H](N)(CC1=CC=CC=C1)C(=O)N MCULE-5599449655 [1,0,0,0,0,0|2,0,1]=4 512 B12R1.49 C(N)(CO)CC1=CC=C(C=C1)O MCULE-4364318479 [1,0,0,0,0,0|1,0,2]=4 513 B12R1.49 C(N)(CO)CC1=CC=C(C=C1)O MCULE-7731641378 [1,0,0,0,0,0|1,0,2]=4 514 B12R1.49 C=CC(=O)CC1=CC=C(C=C1)F MCULE-3297786060 [1,0,0,0,0,0|2,0,0]=3 515 B12R1.49 C=CC(=O)NC1=CC=C(C=C1)Br MCULE-8946793239 [1,0,0,0,0,0|3,0,0]=4 516 B12R1.49 C=CC(=O)NC1=CC=C(C=C1)C MCULE-9162197485 [1,0,0,0,0,0|3,0,0]=4 517 B12R1.49 C=CC(=O)NC1=CC=C(C=C1)Cl MCULE-5825357915 [1,0,0,0,0,0|3,0,0]=4 518 B12R1.49 C=CC(=O)NC1=CC=C(C=C1)F MCULE-7579562496 [1,0,0,0,0,0|3,0,0]=4 519 B12R1.49 C=CC(=O)NC1=CC=C(C=C1)N MCULE-8885253856 [1,0,0,0,0,0|3,0,0]=4 520 B12R1.49 C=CC(=O)NC1=CC=C(C=C1)O MCULE-8629357253 [1,0,0,0,0,0|2,0,0]=3 521 B12R1.49 C=CC(=O)OC1=CC=C(C=C1)Cl MCULE-6295980156 [1,0,0,0,0,0|3,0,0]=4 522 B12R1.49 CC(=CC1=CC=C(C=C1)Cl)C=O MCULE-9367359504 [1,0,0,0,0,0|2,0,1]=4 523 B12R1.49 CC(C=O)CC1=CC=C(C=C1)Br MCULE-8562500083 [1,0,0,0,0,0|2,0,1]=4 524 B12R1.49 CC1=CC=C(C=C1)CC(=N)NO MCULE-5361882010 [1,0,0,0,0,0|3,0,0]=4 525 B12R1.49 CC1=CC=C(C=C1)CC(=O)CCl MCULE-6569309507 [1,0,0,0,0,0|2,0,1]=4 526 B12R1.49 CC1=CC=C(C=C1)CC(=O)NN MCULE-2424043936 [1,0,0,0,0,0|3,0,0]=4 527 B12R1.49 CC1=CC=C(C=C1)CC(=O)NO MCULE-7447503371 [1,0,0,0,0,0|2,0,0]=3 528 B12R1.49 CC1=CC=C(C=C1)CC(Cl)C=O MCULE-4762137367 [1,0,0,0,0,0|2,0,1]=4 529 B12R1.49 CC1=CC=C(C=C1)NC(=O)CO MCULE-5874337131 [1,0,0,0,0,0|2,0,1]=4 530 B12R1.49 CC1=CC=C(C=C1)NC(=O)NO MCULE-5476821276 [1,0,0,0,0,0|3,0,0]=4 531 B12R1.49 CCC(=O)CC1=CC=C(C=C1)Br MCULE-3929369066 [1,0,0,0,0,0|2,0,1]=4 532 B12R1.49 CCC(=O)CC1=CC=C(C=C1)C MCULE-7756922269 [1,0,0,0,0,0|2,0,1]=4 533 B12R1.49 CCC(=O)CC1=CC=C(C=C1)Cl MCULE-4847222042 [1,0,0,0,0,0|2,0,1]=4 534 B12R1.49 CCC(=O)CC1=CC=C(C=C1)F MCULE-4623836213 [1,0,0,0,0,0|2,0,1]=4 535 B12R1.49 CCC(=O)CC1=CC=C(C=C1)I MCULE-2693866417 [1,0,0,0,0,0|2,0,1]=4 536 B12R1.49 CCC(=O)NC1=CC=C(C=C1)O MCULE-8936318576 [1,0,0,0,0,0|2,0,1]=4 537 B12R1.49 CCC(=O)OC1=CC=C(C=C1)O MCULE-2082576566 [1,0,0,0,0,0|2,0,1]=4 538 B12R1.49 CNC(=O)CC1=CC=C(C=C1)Br MCULE-1786406586 [1,0,0,0,0,0|3,0,0]=4 539 B12R1.49 CNC(=O)CC1=CC=C(C=C1)C MCULE-4167454711 [1,0,0,0,0,0|3,0,0]=4 540 B12R1.49 CNC(=O)CC1=CC=C(C=C1)Cl MCULE-8204507726 [1,0,0,0,0,0|3,0,0]=4 541 B12R1.49 CNC(=O)CC1=CC=C(C=C1)F MCULE-2716061406 [1,0,0,0,0,0|3,0,0]=4 542 B12R1.49 CNC(=O)CC1=CC=C(C=C1)I MCULE-1540943077 [1,0,0,0,0,0|3,0,0]=4 543 B12R1.49 CNC(=O)CC1=CC=C(C=C1)N MCULE-2308908277 [1,0,0,0,0,0|3,0,0]=4 544 B12R1.49 CNC(=O)CC1=CC=C(C=C1)N MCULE-9211082934 [1,0,0,0,0,0|3,0,0]=4 545 B12R1.49 CNC(=O)CC1=CC=C(C=C1)O MCULE-5083661166 [1,0,0,0,0,0|2,0,0]=3 546 B12R1.49 CNC(=O)NC1=CC=C(C=C1)O MCULE-1161962128 [1,0,0,0,0,0|3,0,0]=4 547 B12R1.49 COC(=O)CC1=CC=C(C=C1)Br MCULE-5535065013 [1,0,0,0,0,0|3,0,0]=4 548 B12R1.49 COC(=O)CC1=CC=C(C=C1)C MCULE-6299488455 [1,0,0,0,0,0|3,0,0]=4 549 B12R1.49 COC(=O)CC1=CC=C(C=C1)Cl MCULE-5408418101 [1,0,0,0,0,0|3,0,0]=4 550 B12R1.49 COC(=O)CC1=CC=C(C=C1)F MCULE-7788706853 [1,0,0,0,0,0|3,0,0]=4 551 B12R1.49 COC(=O)CC1=CC=C(C=C1)I MCULE-5038107965 [1,0,0,0,0,0|3,0,0]=4 552 B12R1.49 COC(=O)CC1=CC=C(C=C1)N MCULE-1846683603 [1,0,0,0,0,0|3,0,0]=4 553 B12R1.49 COC(=O)CC1=CC=C(C=C1)N MCULE-6145784760 [1,0,0,0,0,0|3,0,0]=4 554 B12R1.49 COC(=O)CC1=CC=C(C=C1)O MCULE-7979598342 [1,0,0,0,0,0|2,0,0]=3 555 B12R1.49 COC(=O)NC1=CC=C(C=C1)O MCULE-5108765707 [1,0,0,0,0,0|3,0,0]=4 556 B12R1.49 N/C(=N/O)/CC1=CC=C(C=C1)Br MCULE-7252774052 [1,0,0,0,0,0|3,0,0]=4 557 B12R1.49 N/C(=N\O)/CC1=CC=C(C=C1)Cl MCULE-2900273415 [1,0,0,0,0,0|3,0,0]=4 558 B12R1.49 N=C(CC1=CC=C(C=C1)F)NO MCULE-4665701003 [1,0,0,0,0,0|3,0,0]=4 559 B12R1.49 N=C(CC1=CC=C(C=C1)O)NO MCULE-3868300350 [1,0,0,0,0,0|2,0,0]=3 560 B12R1.49 NC1=CC=C(C=C1)NC(=O)CO MCULE-4365158792 [1,0,0,0,0,0|2,0,1]=4 561 B12R1.49 NCC(=O)CC1=CC=C(C=C1)Br MCULE-1232542255 [1,0,0,0,0,0|2,0,1]=4 562 B12R1.49 NCC(=O)CC1=CC=C(C=C1)Br MCULE-4007027794 [1,0,0,0,0,0|2,0,1]=4 563 B12R1.49 NCC(=O)CC1=CC=C(C=C1)F MCULE-8738023732 [1,0,0,0,0,0|2,0,1]=4 564 B12R1.49 NCC(=O)CC1=CC=C(C=C1)F MCULE-9505150337 [1,0,0,0,0,0|2,0,1]=4 565 B12R1.49 NCC(=O)NC1=CC=C(C=C1)O MCULE-8891847001 [1,0,0,0,0,0|2,0,1]=4 566 B12R1.49 NCC(=O)NC1=CC=C(C=C1)O MCULE-9774692126 [1,0,0,0,0,0|2,0,1]=4 567 B12R1.49 NNC(=O)CC1=CC=C(C=C1)Br MCULE-8958650851 [1,0,0,0,0,0|3,0,0]=4 568 B12R1.49 NNC(=O)CC1=CC=C(C=C1)Cl MCULE-4835969574 [1,0,0,0,0,0|3,0,0]=4 569 B12R1.49 NNC(=O)CC1=CC=C(C=C1)F MCULE-4547430437 [1,0,0,0,0,0|3,0,0]=4 570 B12R1.49 NNC(=O)CC1=CC=C(C=C1)F MCULE-9040001796 [1,0,0,0,0,0|3,0,0]=4 571 B12R1.49 NNC(=O)CC1=CC=C(C=C1)O MCULE-1208354992 [1,0,0,0,0,0|2,0,0]=3 572 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)O MCULE-3432213644 [1,0,0,0,0,0|1,0,2]=4 573 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)O MCULE-4720290854 [1,0,0,0,0,0|1,0,2]=4 574 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)O MCULE-5805805181 [1,0,0,0,0,0|1,0,2]=4 575 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)O MCULE-7125179229 [1,0,0,0,0,0|1,0,2]=4 576 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)O MCULE-4240093020 [1,0,0,0,0,0|1,0,2]=4 577 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)O MCULE-5219837114 [1,0,0,0,0,0|1,0,2]=4 578 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)O MCULE-6710049160 [1,0,0,0,0,0|1,0,2]=4 579 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)O MCULE-7653376778 [1,0,0,0,0,0|1,0,2]=4 580 B12R1.49 O=C(CBr)CC1=CC=C(C=C1)Cl MCULE-9899315320 [1,0,0,0,0,0|2,0,1]=4 581 B12R1.49 O=C(CC1=CC=C(C=C1)Br)NO MCULE-9583512680 [1,0,0,0,0,0|2,0,0]=3 582 B12R1.49 O=C(CCl)CC1=CC=C(C=C1)Br MCULE-3241697735 [1,0,0,0,0,0|2,0,1]=4 583 B12R1.49 O=C(CCl)CC1=CC=C(C=C1)Cl MCULE-2312080370 [1,0,0,0,0,0|2,0,1]=4 584 B12R1.49 O=C(CCl)CC1=CC=C(C=C1)F MCULE-1911964961 [1,0,0,0,0,0|2,0,1]=4 585 B12R1.49 O=C(CCl)NC1=CC=C(C=C1)O MCULE-6504074687 [1,0,0,0,0,0|2,0,1]=4 586 B12R1.49 O=C(CO)NC1=CC=C(C=C1)Br MCULE-6840733483 [1,0,0,0,0,0|2,0,1]=4 587 B12R1.49 O=C(CO)NC1=CC=C(C=C1)Cl MCULE-9237329010 [1,0,0,0,0,0|2,0,1]=4 588 B12R1.49 O=C(CO)NC1=CC=C(C=C1)F MCULE-2958417773 [1,0,0,0,0,0|2,0,1]=4 589 B12R1.49 O=C(NO)NC1=CC=C(C=C1)Br MCULE-9274791822 [1,0,0,0,0,0|3,0,0]=4 590 B12R1.49 O=C(NO)NC1=CC=C(C=C1)Cl MCULE-9963758602 [1,0,0,0,0,0|3,0,0]=4 591 B12R1.49 O=C/C(=C/C1=CC=C(C=C1)F)/I MCULE-8973814528 [1,0,0,0,0,0|2,0,1]=4 592 B12R1.49 O=CC(Cl)CC1=CC=C(C=C1)Cl MCULE-7350394782 [1,0,0,0,0,0|2,0,1]=4 593 B14R1.3 C#CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-1757013063 [0,1,0,0,0,0|2,0,1]=4 594 B14R1.3 C#CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-5096512203 [0,1,0,0,0,0|2,0,1]=4 595 B14R1.3 C#CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-6388344702 [0,1,0,0,0,0|2,0,1]=4 596 B14R1.3 C#CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-6865167163 [0,1,0,0,0,0|2,0,1]=4 597 B14R1.3 C=C(C)C(=O)NC1=CC=C(C=C1)OC MCULE-1481469173 [0,1,0,0,0,0|3,0,0]=4 598 B14R1.3 C=CC1=CC=C(C=C1)CC(N)C(=O)O MCULE-3640424940 [0,1,0,0,0,0|2,0,1]=4 599 B14R1.3 C=CC1=CC=C(C=C1)CC(N)C(=O)O MCULE-4919162155 [0,1,0,0,0,0|2,0,1]=4 600 B14R1.3 C=CC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-1388766528 [0,1,0,0,0,0|2,0,1]=4 601 B14R1.3 C=CC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-5394373702 [0,1,0,0,0,0|2,0,1]=4 602 B14R1.3 C=CC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-8116782854 [0,1,0,0,0,0|2,0,1]=4 603 B14R1.3 C=CC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-8542266874 [0,1,0,0,0,0|2,0,1]=4 604 B14R1.3 C=CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-2125734382 [0,1,0,0,0,0|2,0,1]=4 605 B14R1.3 C=CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-7672762061 [0,1,0,0,0,0|2,0,1]=4 606 B14R1.3 CC(CC1=CC=C(C=C1)C#N)C(=O)O MCULE-7266176141 [0,1,0,0,0,0|2,0,1]=4 607 B14R1.3 CC(OC1=CC=C(C=C1)CO)C(=O)O MCULE-2572638120 [0,1,0,0,0,0|2,0,1]=4 608 B14R1.3 CCC1=CC=C(C=C1)CC(C)C(=O)O MCULE-9431759688 [0,1,0,0,0,0|2,0,1]=4 609 B14R1.3 CCC1=CC=C(C=C1)CC(N)C(=O)O MCULE-7690560565 [0,1,0,0,0,0|2,0,1]=4 610 B14R1.3 CCC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-1435129050 [0,1,0,0,0,0|2,0,1]=4 611 B14R1.3 CCC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-4566380869 [0,1,0,0,0,0|2,0,1]=4 612 B14R1.3 CCC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-5659780827 [0,1,0,0,0,0|2,0,1]=4 613 B14R1.3 CCC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-3694773827 [0,1,0,0,0,0|2,0,1]=4 614 B14R1.3 CCC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-8607327458 [0,1,0,0,0,0|2,0,1]=4 615 B14R1.3 CCC1=CC=C(C=C1)NC(=O)C(=O)O MCULE-7576837997 [0,1,0,0,0,0|2,0,0]=3 616 B14R1.3 COC1=CC=C(C=C1)C=C(C)C(=O)O MCULE-1057313976 [0,1,0,0,0,0|1,0,1]=3 617 B14R1.3 COC1=CC=C(C=C1)C=C(O)C(=O)O MCULE-9861861363 [0,1,0,0,0,0|0,0,2]=3 618 B14R1.3 COC1=CC=C(C=C1)C=C(S)C(=O)O MCULE-6298732355 [0,1,0,0,0,0|0,1,1]=3 619 B14R1.3 COC1=CC=C(C=C1)CC(=O)C(=O)C MCULE-5337456175 [0,1,0,0,0,0|1,0,0]=2 620 B14R1.3 COC1=CC=C(C=C1)CC(=O)C(=O)O MCULE-3122064559 [0,1,0,0,0,0|0,0,0]=1 621 B14R1.3 COC1=CC=C(C=C1)CC(=O)C(C)C MCULE-2533197044 [0,1,0,0,0,0|2,0,1]=4 622 B14R1.3 COC1=CC=C(C=C1)CC(=O)N(C)C MCULE-2097600589 [0,1,0,0,0,0|3,0,0]=4 623 B14R1.3 COC1=CC=C(C=C1)CC(C)C(=O)O MCULE-9567428925 [0,1,0,0,0,0|1,0,1]=3 624 B14R1.3 COC1=CC=C(C=C1)CC(N)C(=O)O MCULE-7401424887 [0,1,0,0,0,0|1,0,1]=3 625 B14R1.3 COC1=CC=C(C=C1)CC(N)C(=O)O MCULE-8554887653 [0,1,0,0,0,0|1,0,1]=3 626 B14R1.3 COC1=CC=C(C=C1)CC(O)C(=O)O MCULE-4892673092 [0,1,0,0,0,0|0,0,2]=3 627 B14R1.3 COC1=CC=C(C=C1)CN(C)C(=O)C MCULE-7502203489 [0,1,0,0,0,0|3,0,0]=4 628 B14R1.3 COC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-2276110349 [0,1,0,0,0,0|1,0,1]=3 629 B14R1.3 COC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-2601900678 [0,1,0,0,0,0|1,0,1]=3 630 B14R1.3 COC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-2987428820 [0,1,0,0,0,0|1,0,1]=3 631 B14R1.3 COC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-9469633282 [0,1,0,0,0,0|1,0,1]=3 632 B14R1.3 COC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-6625925075 [0,1,0,0,0,0|1,0,1]=3 633 B14R1.3 COC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-8125565254 [0,1,0,0,0,0|1,0,1]=3 634 B14R1.3 COC1=CC=C(C=C1)NC(=O)C(=O)N MCULE-3406476442 [0,1,0,0,0,0|2,0,0]=3 635 B14R1.3 COC1=CC=C(C=C1)NC(=O)C(=O)O MCULE-3831279107 [0,1,0,0,0,0|1,0,0]=2 636 B14R1.3 COC1=CC=C(C=C1)NC(=S)C(=O)N MCULE-3343964409 [0,1,0,0,0,0|2,1,0]=4 637 B14R1.3 COC1=CC=C(C=C1)NC(C)C(=O)O MCULE-7049509949 [0,1,0,0,0,0|2,0,1]=4 638 B14R1.3 COC1=CC=C(C=C1)OC(C)C(=O)O MCULE-7847969583 [0,1,0,0,0,0|2,0,1]=4 639 B14R1.3 COC1=CC=C(C=C1)SC(C)C(=O)O MCULE-3244503249 [0,1,0,0,0,0|2,0,1]=4 640 B14R1.3 COC1=CC=C(C=N1)NC(=O)C(=O)N MCULE-8072991096 [0,1,0,0,0,0|3,0,0]=4 641 B14R1.3 COC1=NC=C(C=C1)CC(C)C(=O)O MCULE-1408314610 [0,1,0,0,0,0|2,0,1]=4 642 B14R1.3 CSC1=CC=C(C=C1)CC(N)C(=O)O MCULE-6278962041 [0,1,0,0,0,0|1,1,1]=4 643 B14R1.3 CSC1=CC=C(C=C1)CC(N)C(=O)O MCULE-9887520668 [0,1,0,0,0,0|1,1,1]=4 644 B14R1.3 N#CC1=CC=C(C=C1)CC(=O)C(=O)O MCULE-9473978771 [0,1,0,0,0,0|1,0,0]=2 645 B14R1.3 N#CC1=CC=C(C=C1)CC(N)C(=O)O MCULE-2547457737 [0,1,0,0,0,0|2,0,1]=4 646 B14R1.3 N#CC1=CC=C(C=C1)CC(N)C(=O)O MCULE-3009591757 [0,1,0,0,0,0|2,0,1]=4 647 B14R1.3 N#CC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-2188384722 [0,1,0,0,0,0|2,0,1]=4 648 B14R1.3 N#CC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-5084246856 [0,1,0,0,0,0|2,0,1]=4 649 B14R1.3 N#CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-2956238382 [0,1,0,0,0,0|2,0,1]=4 650 B14R1.3 N#CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-3981584975 [0,1,0,0,0,0|2,0,1]=4 651 B14R1.3 N#CC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-8429770618 [0,1,0,0,0,0|2,0,1]=4 652 B14R1.3 NC(CC1=CC=C(C=C1)CO)C(=O)O MCULE-3608351255 [0,1,0,0,0,0|1,0,1]=3 653 B14R1.3 NC(CC1=CC=C(C=C1)CO)C(=O)O MCULE-6159646419 [0,1,0,0,0,0|1,0,1]=3 654 B14R1.3 NCC1=CC=C(C=C1)CC(N)C(=O)O MCULE-6360591560 [0,1,0,0,0,0|2,0,1]=4 655 B14R1.3 NCC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-5019687348 [0,1,0,0,0,0|2,0,1]=4 656 B14R1.3 NCC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-9173684952 [0,1,0,0,0,0|2,0,1]=4 657 B14R1.3 NCC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-3908937850 [0,1,0,0,0,0|2,0,1]=4 658 B14R1.3 NCC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-7207044550 [0,1,0,0,0,0|2,0,1]=4 659 B14R1.3 N[C@@H](CC1=CC=C(C=C1)CO)C(=O)O MCULE-7079640926 [0,1,0,0,0,0|1,0,1]=3 660 B14R1.3 N[C@@H](CC1=CC=C(C=C1)CO)C(=O)O MCULE-7607638377 [0,1,0,0,0,0|1,0,1]=3 661 B14R1.3 N[C@@H](CC1=CC=C(C=C1)CO)C(=O)O MCULE-9438903936 [0,1,0,0,0,0|1,0,1]=3 662 B14R1.3 N[C@@H](CC1=CC=C(C=C1)CO)C(=O)O MCULE-9488539878 [0,1,0,0,0,0|1,0,1]=3 663 B14R1.3 N[C@H](CC1=CC=C(C=C1)CO)C(=O)O MCULE-8826940922 [0,1,0,0,0,0|1,0,1]=3 664 B14R1.3 [C@H](N)(CC1=CC=C(C=C1)OC)C(=O)O MCULE-9599742463 [0,1,0,0,0,0|1,0,1]=3 665 B14R1.132 CC(C(=O)O)C(C)C1=CC=C(C=C1)F MCULE-5595206749 [0,1,0,0,0,0|2,0,1]=4 666 B14R1.132 CC(C(=O)O)C(N)C1=CC=C(C=C1)Br MCULE-8207953282 [0,1,0,0,0,0|2,0,1]=4 667 B14R1.132 CC(C(=O)O)C(N)C1=CC=C(C=C1)Br MCULE-9356450624 [0,1,0,0,0,0|2,0,1]=4 668 B14R1.132 CC(C(=O)O)C(N)C1=CC=C(C=C1)Cl MCULE-2249037524 [0,1,0,0,0,0|2,0,1]=4 669 B14R1.132 CC(C1=CC=C(C=C1)O)C(N)C(=O)O MCULE-6259455399 [0,1,0,0,0,0|1,0,1]=3 670 B14R1.132 CC(C1=CC=C(C=C1)O)C(N)C(=O)O MCULE-8474638573 [0,1,0,0,0,0|1,0,1]=3 671 B14R1.132 CC1=CC=C(C=C1)C(C)C(O)C(=O)O MCULE-3645039704 [0,1,0,0,0,0|1,0,2]=4 672 B14R1.132 CC1=CC=C(C=C1)C(N)C(O)C(=O)O MCULE-8086249372 [0,1,0,0,0,0|1,0,2]=4 673 B14R1.132 CC1=CC=C(C=C1)C(O)C(C)C(=O)O MCULE-3320701404 [0,1,0,0,0,0|2,0,1]=4 674 B14R1.132 CC1=CC=C(C=C1)[C@@H](N)[C@@H](O)C(=O)O MCULE-1489001694 [0,1,0,0,0,0|1,0,2]=4 675 B14R1.132 CC1=CC=C(C=C1)[C@H](N)[C@H](O)C(=O)O MCULE-4257660990 [0,1,0,0,0,0|1,0,2]=4 676 B14R1.132 C[C@@H](C1=CC=C(C=C1)O)[C@@H](N)C(=O)O MCULE-4164369820 [0,1,0,0,0,0|1,0,1]=3 677 B14R1.132 C[C@@H](C1=CC=C(C=C1)O)[C@@H](N)C(=O)O MCULE-9153572827 [0,1,0,0,0,0|1,0,1]=3 678 B14R1.132 C[C@@H](C1=CC=C(C=C1)O)[C@H](N)C(=O)O MCULE-1338232690 [0,1,0,0,0,0|1,0,1]=3 679 B14R1.132 C[C@@H](C1=CC=C(C=C1)O)[C@H](N)C(=O)O MCULE-2704583999 [0,1,0,0,0,0|1,0,1]=3 680 B14R1.132 C[C@H](C1=CC=C(C=C1)O)[C@@H](N)C(=O)O MCULE-3516148226 [0,1,0,0,0,0|1,0,1]=3 681 B14R1.132 C[C@H](C1=CC=C(C=C1)O)[C@@H](N)C(=O)O MCULE-5568245506 [0,1,0,0,0,0|1,0,1]=3 682 B14R1.132 C[C@H](C1=CC=C(C=C1)O)[C@H](N)C(=O)O MCULE-4556854678 [0,1,0,0,0,0|1,0,1]=3 683 B14R1.132 C[C@H](C1=CC=C(C=C1)O)[C@H](N)C(=O)O MCULE-7902457386 [0,1,0,0,0,0|1,0,1]=3 684 B14R1.132 NC(C1=CC=C(C=C1)F)C(O)C(=O)O MCULE-9502027591 [0,1,0,0,0,0|1,0,2]=4 685 B14R1.132 N[C@@H](C1=CC=C(C=C1)F)[C@H](O)C(=O)O MCULE-9946682486 [0,1,0,0,0,0|1,0,2]=4 686 B14R1.132 N[C@H](C(=O)O)[C@H](O)C1=CC=C(C=C1)O MCULE-7692262067 [0,1,0,0,0,0|1,0,1]=3 687 B14R1.132 N[C@H](C1=CC=C(C=C1)F)[C@@H](O)C(=O)O MCULE-4222545875 [0,1,0,0,0,0|1,0,2]=4 688 B14R1.132 O=C(O)C(=O)C(O)C1=CC=C(C=C1)O MCULE-1954387232 [0,1,0,0,0,0|0,0,0]=1 689 B14R1.132 O=C(O)C(Br)C(Br)C1=CC=C(C=C1)Cl MCULE-7064644960 [0,1,0,0,0,0|2,0,1]=4 690 B14R1.132 O=C(O)C(Br)C(Br)C1=CC=C(C=C1)F MCULE-6848465312 [0,1,0,0,0,0|2,0,1]=4 691 B14R1.132 O=C(O)C(O)C(O)C1=CC=C(C=C1)O MCULE-6635032478 [0,1,0,0,0,0|0,0,2]=3 692 B14R1.134 CC1=CC=C(C=C1)NC(=O)C(=O)NN MCULE-7169054843 [0,1,0,0,0,0|3,0,0]=4 693 B14R1.134 CNC(=O)C(=O)NC1=CC=C(C=C1)C MCULE-2871061732 [0,1,0,0,0,0|3,0,0]=4 694 B14R1.134 CNC(=O)C(=O)NC1=CC=C(C=C1)Cl MCULE-4349967623 [0,1,0,0,0,0|3,0,0]=4 695 B14R1.134 CNC(=O)C(=O)NC1=CC=C(C=C1)F MCULE-4099490222 [0,1,0,0,0,0|3,0,0]=4 696 B14R1.134 COC(=O)C(=O)NC1=CC=C(C=C1)C MCULE-5800820614 [0,1,0,0,0,0|2,0,0]=3 697 B14R1.134 COC(=O)C(=O)NC1=CC=C(C=C1)O MCULE-5589989811 [0,1,0,0,0,0|1,0,0]=2 698 B14R1.134 COC(=O)C(Br)CC1=CC=C(C=C1)Br MCULE-6722551698 [0,1,0,0,0,0|2,0,1]=4 699 B14R1.134 COC(=O)C(Br)CC1=CC=C(C=C1)C MCULE-4210711151 [0,1,0,0,0,0|2,0,1]=4 700 B14R1.134 COC(=O)C(Br)CC1=CC=C(C=C1)Cl MCULE-4689477249 [0,1,0,0,0,0|2,0,1]=4 701 B14R1.134 COC(=O)C(Br)CC1=CC=C(C=C1)F MCULE-6449732387 [0,1,0,0,0,0|2,0,1]=4 702 B14R1.134 COC(=O)C(C)CC1=CC=C(C=C1)Br MCULE-4830330081 [0,1,0,0,0,0|2,0,1]=4 703 B14R1.134 COC(=O)C(C)CC1=CC=C(C=C1)N MCULE-5118670543 [0,1,0,0,0,0|2,0,1]=4 704 B14R1.134 COC(=O)C(C)OC1=CC=C(C=C1)O MCULE-2057747341 [0,1,0,0,0,0|2,0,1]=4 705 B14R1.134 COC(=O)C(C)OC1=CC=C(C=C1)O MCULE-3003338705 [0,1,0,0,0,0|2,0,1]=4 706 B14R1.134 COC(=O)C(Cl)CC1=CC=C(C=C1)Cl MCULE-7887294909 [0,1,0,0,0,0|2,0,1]=4 707 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)Br MCULE-4453490191 [0,1,0,0,0,0|2,0,1]=4 708 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)Br MCULE-5316696256 [0,1,0,0,0,0|2,0,1]=4 709 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)Br MCULE-7648103670 [0,1,0,0,0,0|2,0,1]=4 710 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)Br MCULE-8441655828 [0,1,0,0,0,0|2,0,1]=4 711 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)Cl MCULE-6839240703 [0,1,0,0,0,0|2,0,1]=4 712 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)Cl MCULE-8104723034 [0,1,0,0,0,0|2,0,1]=4 713 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)F MCULE-1562203633 [0,1,0,0,0,0|2,0,1]=4 714 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)F MCULE-3191771687 [0,1,0,0,0,0|2,0,1]=4 715 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)I MCULE-2377081706 [0,1,0,0,0,0|2,0,1]=4 716 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)I MCULE-2964435216 [0,1,0,0,0,0|2,0,1]=4 717 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)I MCULE-4835326324 [0,1,0,0,0,0|2,0,1]=4 718 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)I MCULE-5309031724 [0,1,0,0,0,0|2,0,1]=4 719 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)N MCULE-6946906482 [0,1,0,0,0,0|2,0,1]=4 720 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)N MCULE-9427412001 [0,1,0,0,0,0|2,0,1]=4 721 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)O MCULE-3134871970 [0,1,0,0,0,0|1,0,1]=3 722 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)O MCULE-5868680507 [0,1,0,0,0,0|1,0,1]=3 723 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)O MCULE-6387792600 [0,1,0,0,0,0|1,0,1]=3 724 B14R1.134 COC(=O)C(O)CC1=CC=C(C=C1)Br MCULE-5530619123 [0,1,0,0,0,0|1,0,2]=4 725 B14R1.134 COC(=O)C(O)CC1=CC=C(C=C1)F MCULE-5413234804 [0,1,0,0,0,0|1,0,2]=4 726 B14R1.134 COC(=O)C(O)CC1=CC=C(C=C1)O MCULE-2030545561 [0,1,0,0,0,0|0,0,2]=3 727 B14R1.134 COC(=O)C(S)CC1=CC=C(C=C1)C MCULE-1777576195 [0,1,0,0,0,0|1,1,1]=4 728 B14R1.134 COC(=O)N(C)CC1=CC=C(C=C1)Br MCULE-1949892337 [0,1,0,0,0,0|3,0,0]=4 729 B14R1.134 COC(=O)N(C)CC1=CC=C(C=C1)I MCULE-7018860726 [0,1,0,0,0,0|3,0,0]=4 730 B14R1.134 COC(=O)N(C)CC1=CC=C(C=C1)N MCULE-6643535158 [0,1,0,0,0,0|3,0,0]=4 731 B14R1.134 COC(=O)[C@@H](C)OC1=CC=C(C=C1)O MCULE-3363629646 [0,1,0,0,0,0|2,0,1]=4 732 B14R1.134 COC(=O)[C@@H](C)OC1=CC=C(C=C1)O MCULE-7901123572 [0,1,0,0,0,0|2,0,1]=4 733 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)Br MCULE-6477916312 [0,1,0,0,0,0|2,0,1]=4 734 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)Br MCULE-7378001414 [0,1,0,0,0,0|2,0,1]=4 735 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)Br MCULE-8028581609 [0,1,0,0,0,0|2,0,1]=4 736 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)Br MCULE-8185896840 [0,1,0,0,0,0|2,0,1]=4 737 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)C MCULE-3508969395 [0,1,0,0,0,0|2,0,1]=4 738 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)Cl MCULE-4822053024 [0,1,0,0,0,0|2,0,1]=4 739 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)Cl MCULE-6642463013 [0,1,0,0,0,0|2,0,1]=4 740 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)Cl MCULE-8432858363 [0,1,0,0,0,0|2,0,1]=4 741 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)Cl MCULE-9157540742 [0,1,0,0,0,0|2,0,1]=4 742 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)F MCULE-3285651731 [0,1,0,0,0,0|2,0,1]=4 743 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)F MCULE-3517710524 [0,1,0,0,0,0|2,0,1]=4 744 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)F MCULE-5880009120 [0,1,0,0,0,0|2,0,1]=4 745 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)F MCULE-9683439667 [0,1,0,0,0,0|2,0,1]=4 746 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)I MCULE-4896055111 [0,1,0,0,0,0|2,0,1]=4 747 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)I MCULE-6654309833 [0,1,0,0,0,0|2,0,1]=4 748 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)I MCULE-9059949052 [0,1,0,0,0,0|2,0,1]=4 749 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)I MCULE-9569962973 [0,1,0,0,0,0|2,0,1]=4 750 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)N MCULE-5231688460 [0,1,0,0,0,0|2,0,1]=4 751 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-3639081318 [0,1,0,0,0,0|1,0,1]=3 752 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-4891329972 [0,1,0,0,0,0|1,0,1]=3 753 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-5488527585 [0,1,0,0,0,0|1,0,1]=3 754 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-6767520425 [0,1,0,0,0,0|1,0,1]=3 755 B14R1.134 COC(=O)[C@@H](N)CC1=CN=C(C=C1)O MCULE-7417631332 [0,1,0,0,0,0|2,0,1]=4 756 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)Br MCULE-3736546940 [0,1,0,0,0,0|2,0,1]=4 757 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)Br MCULE-4142566227 [0,1,0,0,0,0|2,0,1]=4 758 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)Br MCULE-8389307720 [0,1,0,0,0,0|2,0,1]=4 759 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)Br MCULE-9236511141 [0,1,0,0,0,0|2,0,1]=4 760 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)C MCULE-1534800369 [0,1,0,0,0,0|2,0,1]=4 761 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)Cl MCULE-8104662010 [0,1,0,0,0,0|2,0,1]=4 762 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)Cl MCULE-8509190814 [0,1,0,0,0,0|2,0,1]=4 763 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)Cl MCULE-8584379578 [0,1,0,0,0,0|2,0,1]=4 764 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)Cl MCULE-9988362367 [0,1,0,0,0,0|2,0,1]=4 765 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)F MCULE-2754376227 [0,1,0,0,0,0|2,0,1]=4 766 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)F MCULE-4353621391 [0,1,0,0,0,0|2,0,1]=4 767 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)F MCULE-4741818495 [0,1,0,0,0,0|2,0,1]=4 768 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)F MCULE-7907570619 [0,1,0,0,0,0|2,0,1]=4 769 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)N MCULE-2340604471 [0,1,0,0,0,0|2,0,1]=4 770 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)N MCULE-8798277614 [0,1,0,0,0,0|2,0,1]=4 771 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)N MCULE-8894936334 [0,1,0,0,0,0|2,0,1]=4 772 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)O MCULE-1093244420 [0,1,0,0,0,0|1,0,1]=3 773 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(C=C1)O MCULE-3459932306 [0,1,0,0,0,0|1,0,1]=3 774 B14R1.134 COC(=O)[C@H](N)CC1=CN=C(C=C1)O MCULE-6480591517 [0,1,0,0,0,0|2,0,1]=4 775 B14R1.134 COC(=O)[C@H](O)CC1=CC=C(C=C1)Br MCULE-3458354643 [0,1,0,0,0,0|1,0,2]=4 776 B14R1.134 COC(=O)[C@H](O)CC1=CC=C(C=C1)F MCULE-7469100858 [0,1,0,0,0,0|1,0,2]=4 777 B14R1.134 COC(=O)[C@H](O)CC1=CC=C(C=C1)F MCULE-9469164096 [0,1,0,0,0,0|1,0,2]=4 778 B14R1.134 CON(C)C(=O)CC1=CC=C(C=C1)Br MCULE-7124670493 [0,1,0,0,0,0|3,0,0]=4 779 B14R1.134 CON(C)C(=O)CC1=CC=C(C=C1)C MCULE-2865201309 [0,1,0,0,0,0|3,0,0]=4 780 B14R1.134 CON(C)C(=O)CC1=CC=C(C=C1)Cl MCULE-3103611145 [0,1,0,0,0,0|3,0,0]=4 781 B14R1.134 CON(C)C(=O)NC1=CC=C(C=C1)O MCULE-2418186842 [0,1,0,0,0,0|3,0,0]=4 782 B14R1.134 N/C(=N\O)/C(=O)NC1=CC=C(C=C1)Cl MCULE-7226383932 [0,1,0,0,0,0|3,0,0]=4 783 B14R1.134 NNC(=O)C(=O)NC1=CC=C(C=C1)Br MCULE-2224571915 [0,1,0,0,0,0|3,0,0]=4 784 B14R1.134 NNC(=O)C(=O)NC1=CC=C(C=C1)Cl MCULE-5687865765 [0,1,0,0,0,0|3,0,0]=4 785 B14R1.134 NNC(=O)C(=O)NC1=CC=C(C=C1)F MCULE-3511201509 [0,1,0,0,0,0|3,0,0]=4 786 B14R1.134 NNC(=O)C(=O)NC1=CC=C(C=C1)O MCULE-6624696705 [0,1,0,0,0,0|2,0,0]=3 787 B14R1.134 NNC(=O)C(N)CC1=CC=C(C=C1)O MCULE-5024166912 [0,1,0,0,0,0|2,0,1]=4 788 B14R1.134 NNC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-4956549262 [0,1,0,0,0,0|2,0,1]=4 789 B14R1.134 NNC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-6195685530 [0,1,0,0,0,0|2,0,1]=4 790 B14R1.134 [C@@H](C)(OC1=CC=C(C=C1)O)C(=O)OC MCULE-3474934829 [0,1,0,0,0,0|2,0,1]=4 791 B14R1.134 [C@@H](N)(CC1=CC=C(C=C1)N)C(=O)OC MCULE-7022848005 [0,1,0,0,0,0|2,0,1]=4 792 B14R1.134 [C@@H](N)(CC1=CC=C(C=C1)O)C(=O)OC MCULE-3211279606 [0,1,0,0,0,0|1,0,1]=3 793 B14R1.134 [C@@H](N)(CC1=CC=C(C=C1)O)C(=O)OC MCULE-9433306799 [0,1,0,0,0,0|1,0,1]=3 794 B14R1.536 CC1=CC=C(C=C1)/C=C(\C#N)/C(=O)O MCULE-5951506610 [0,1,0,0,0,0|2,0,1]=4 795 B14R1.536 CC1=CC=C(C=C1)C=C(C#N)C(=O)O MCULE-2643802453 [0,1,0,0,0,0|2,0,1]=4 796 B14R1.536 CC1=CC=C(C=C1)CC(C#N)C(=O)O MCULE-1894224996 [0,1,0,0,0,0|2,0,1]=4 797 B14R1.536 CC1=CC=C(C=C1)CC(CN)C(=O)O MCULE-1451782887 [0,1,0,0,0,0|2,0,1]=4 798 B14R1.536 CCC(CC1=CC=C(C=C1)Br)C(=O)O MCULE-6740784033 [0,1,0,0,0,0|2,0,1]=4 799 B14R1.536 CCC(CC1=CC=C(C=C1)C)C(=O)O MCULE-7457602483 [0,1,0,0,0,0|2,0,1]=4 800 B14R1.536 CCC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-7742496130 [0,1,0,0,0,0|2,0,1]=4 801 B14R1.536 CCC(CC1=CC=C(C=C1)F)C(=O)O MCULE-9892655610 [0,1,0,0,0,0|2,0,1]=4 802 B14R1.536 CCC(CC1=CC=C(C=C1)N)C(=O)O MCULE-7865652921 [0,1,0,0,0,0|2,0,1]=4 803 B14R1.536 CNC(CC1=CC=C(C=C1)C)C(=O)O MCULE-3868754382 [0,1,0,0,0,0|2,0,1]=4 804 B14R1.536 CNC(CC1=CC=C(C=C1)O)C(=O)O MCULE-4915385045 [0,1,0,0,0,0|1,0,1]=3 805 B14R1.536 CNC(CC1=CC=C(C=C1)O)C(=O)O MCULE-5989624134 [0,1,0,0,0,0|1,0,1]=3 806 B14R1.536 CN[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-6220584417 [0,1,0,0,0,0|2,0,1]=4 807 B14R1.536 CN[C@@H](CC1=CC=C(C=C1)O)C(=O)N MCULE-1114775968 [0,1,0,0,0,0|2,0,1]=4 808 B14R1.536 CN[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-1741566078 [0,1,0,0,0,0|1,0,1]=3 809 B14R1.536 CN[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-3490713321 [0,1,0,0,0,0|1,0,1]=3 810 B14R1.536 CN[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-6295936475 [0,1,0,0,0,0|1,0,1]=3 811 B14R1.536 CN[C@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-2534527150 [0,1,0,0,0,0|1,0,1]=3 812 B14R1.536 CN[C@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-4678653994 [0,1,0,0,0,0|1,0,1]=3 813 B14R1.536 CN[C@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-8279485946 [0,1,0,0,0,0|1,0,1]=3 814 B14R1.536 COC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-1129173640 [0,1,0,0,0,0|1,0,2]=4 815 B14R1.536 COC(CC1=CC=C(C=C1)N)C(=O)O MCULE-5033901014 [0,1,0,0,0,0|1,0,2]=4 816 B14R1.536 CO[C@@H](CC1=CC=C(C=C1)N)C(=O)O MCULE-3782971437 [0,1,0,0,0,0|1,0,2]=4 817 B14R1.536 CO[C@@H](CC1=CC=C(C=C1)N)C(=O)O MCULE-9950103334 [0,1,0,0,0,0|1,0,2]=4 818 B14R1.536 CO[C@H](CC1=CC=C(C=C1)N)C(=O)O MCULE-2158549290 [0,1,0,0,0,0|1,0,2]=4 819 B14R1.536 N#C/C(=C/C1=CC=C(C=C1)O)/C(=O)O MCULE-3139478551 [0,1,0,0,0,0|1,0,1]=3 820 B14R1.536 N#C/C(=C\C1=CC=C(C=C1)Cl)/C(=O)O MCULE-8837548078 [0,1,0,0,0,0|2,0,1]=4 821 B14R1.536 N#C/C(=C\C1=CC=C(C=C1)O)/C(=O)O MCULE-3400024844 [0,1,0,0,0,0|1,0,1]=3 822 B14R1.536 N#CC(=CC1=CC=C(C=C1)Br)C(=O)O MCULE-6455858924 [0,1,0,0,0,0|2,0,1]=4 823 B14R1.536 N#CC(=CC1=CC=C(C=C1)Cl)C(=O)O MCULE-9394085495 [0,1,0,0,0,0|2,0,1]=4 824 B14R1.536 N#CC(=CC1=CC=C(C=C1)F)C(=O)O MCULE-3656851489 [0,1,0,0,0,0|2,0,1]=4 825 B14R1.536 N#CC(=CC1=CC=C(C=C1)O)C(=O)N MCULE-3238799729 [0,1,0,0,0,0|2,0,1]=4 826 B14R1.536 N#CC(=CC1=CC=C(C=C1)O)C(=O)O MCULE-4116733826 [0,1,0,0,0,0|1,0,1]=3 827 B14R1.536 N#CC(CC1=CC=C(C=C1)Br)C(=O)O MCULE-1276923020 [0,1,0,0,0,0|2,0,1]=4 828 B14R1.536 N#CC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-6269830869 [0,1,0,0,0,0|2,0,1]=4 829 B14R1.536 N#CC(CC1=CC=C(C=C1)F)C(=O)O MCULE-3865939485 [0,1,0,0,0,0|2,0,1]=4 830 B14R1.536 N#CC(CC1=CC=C(C=C1)O)C(=O)O MCULE-9480095788 [0,1,0,0,0,0|1,0,1]=3 831 B14R1.536 NCC(CC1=CC=C(C=C1)Br)C(=O)O MCULE-4763732976 [0,1,0,0,0,0|2,0,1]=4 832 B14R1.536 NCC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-1221408402 [0,1,0,0,0,0|2,0,1]=4 833 B14R1.536 NCC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-3172537591 [0,1,0,0,0,0|2,0,1]=4 834 B14R1.536 NCC(CC1=CC=C(C=C1)F)C(=O)O MCULE-1762036914 [0,1,0,0,0,0|2,0,1]=4 835 B14R1.536 NCC(CC1=CC=C(C=C1)F)C(=O)O MCULE-4958634262 [0,1,0,0,0,0|2,0,1]=4 836 B14R1.536 NC[C@@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-5588247937 [0,1,0,0,0,0|2,0,1]=4 837 B14R1.686 C(N)(CC1=CC(=C(C=C1)O)I)C(=O)O MCULE-7084802066 [0,1,0,0,0,0|1,0,1]=3 838 B14R1.686 C/C(=C\C1=CC=C(C(=C1)F)Cl)/C(=O)O MCULE-7875272467 [0,1,0,0,0,0|2,0,1]=4 839 B14R1.686 CC(=CC1=CC=C(C(=C1)F)Cl)C(=O)O MCULE-7712589290 [0,1,0,0,0,0|2,0,1]=4 840 B14R1.686 CC(=CC1=CC=C(C(=C1)F)F)C(=O)O MCULE-1088827956 [0,1,0,0,0,0|2,0,1]=4 841 B14R1.686 CC(CC1=CC(=C(C=C1)Cl)Cl)C(=O)O MCULE-6725921355 [0,1,0,0,0,0|2,0,1]=4 842 B14R1.686 CC(CC1=CC(=C(C=C1)F)Br)C(=O)O MCULE-3047358340 [0,1,0,0,0,0|2,0,1]=4 843 B14R1.686 CC(CC1=CC(=C(C=C1)O)F)C(=O)O MCULE-6959946695 [0,1,0,0,0,0|1,0,1]=3 844 B14R1.686 CC(CC1=CC(=C(C=C1)O)O)C(=O)O MCULE-2053486794 [0,1,0,0,0,0|1,0,1]=3 845 B14R1.686 CC(CC1=CC=C(C(=C1)F)F)C(=O)O MCULE-4053843521 [0,1,0,0,0,0|2,0,1]=4 846 B14R1.686 CC1=C(C=C(C=C1)CC(C)C(=O)O)C MCULE-8631606062 [0,1,0,0,0,0|2,0,1]=4 847 B14R1.686 CC1=C(C=C(C=C1)CC(N)C(=O)O)C MCULE-1439517832 [0,1,0,0,0,0|2,0,1]=4 848 B14R1.686 CC1=C(C=C(C=C1)CC(N)C(=O)O)C MCULE-1710593369 [0,1,0,0,0,0|2,0,1]=4 849 B14R1.686 CC1=C(C=C(C=C1)CC(S)C(=O)O)C MCULE-4221203832 [0,1,0,0,0,0|1,1,1]=4 850 B14R1.686 CC1=C(C=C(C=C1)NC(=O)C(=O)N)Cl MCULE-5798030655 [0,1,0,0,0,0|3,0,0]=4 851 B14R1.686 CC1=C(C=C(C=C1)NC(=O)C(=O)O)C MCULE-5704310665 [0,1,0,0,0,0|2,0,0]=3 852 B14R1.686 CC1=C(C=CC(=C1)CC(C)C(=O)O)F MCULE-4616134999 [0,1,0,0,0,0|2,0,1]=4 853 B14R1.686 CC1=CC(=CC=C1Br)NC(=O)C(=O)N MCULE-8830082518 [0,1,0,0,0,0|3,0,0]=4 854 B14R1.686 CC1=CC(=CC=C1F)CC(N)C(=O)O MCULE-9969422282 [0,1,0,0,0,0|2,0,1]=4 855 B14R1.686 CC1=CC(=CC=C1O)CC(C)C(=O)O MCULE-4345156007 [0,1,0,0,0,0|1,0,1]=3 856 B14R1.686 CC1=CC(=CC=C1O)CC(N)C(=O)O MCULE-7114179615 [0,1,0,0,0,0|1,0,1]=3 857 B14R1.686 CC1=CC(=CC=C1O)C[C@H](N)C(=O)O MCULE-1725367272 [0,1,0,0,0,0|1,0,1]=3 858 B14R1.686 CC1=CC(=CC=C1O)C[C@H](N)C(=O)O MCULE-8823796667 [0,1,0,0,0,0|1,0,1]=3 859 B14R1.686 CC1=CC=C(C=C1C)C[C@H](N)C(=O)O MCULE-4068626034 [0,1,0,0,0,0|2,0,1]=4 860 B14R1.686 CC1=CC=C(C=C1Cl)NC(=O)C(=O)O MCULE-4910961429 [0,1,0,0,0,0|2,0,0]=3 861 B14R1.686 CC1=CC=C(C=C1F)CC(C)C(=O)O MCULE-3294121728 [0,1,0,0,0,0|2,0,1]=4 862 B14R1.686 CC1=CC=C(C=C1F)CC(N)C(=O)O MCULE-7233171438 [0,1,0,0,0,0|2,0,1]=4 863 B14R1.686 CC1=CC=C(C=C1N)CC(C)C(=O)O MCULE-8573761389 [0,1,0,0,0,0|2,0,1]=4 864 B14R1.686 NC(=O)C(=O)NC1=CC(=C(C=C1)Cl)Cl MCULE-2840134815 [0,1,0,0,0,0|3,0,0]=4 865 B14R1.686 NC(=O)C(=O)NC1=CC=C(C(=C1)Cl)F MCULE-1796666957 [0,1,0,0,0,0|3,0,0]=4 866 B14R1.686 NC(=O)C(N)CC1=CC=C(C(=C1)O)O MCULE-2648430513 [0,1,0,0,0,0|2,0,1]=4 867 B14R1.686 NC(=O)C(N)CC1=CC=C(C(=C1)O)O MCULE-4964600533 [0,1,0,0,0,0|2,0,1]=4 868 B14R1.686 NC(=O)[C@@H](N)CC1=CC(=C(C=C1)O)O MCULE-2150001812 [0,1,0,0,0,0|2,0,1]=4 869 B14R1.686 NC(=O)[C@@H](N)CC1=CC=C(C(=C1)O)O MCULE-1018551198 [0,1,0,0,0,0|2,0,1]=4 870 B14R1.686 NC(=O)[C@@H](N)CC1=CC=C(C(=C1)O)O MCULE-5047112016 [0,1,0,0,0,0|2,0,1]=4 871 B14R1.686 NC(=O)[C@@H](N)CC1=CC=C(C(=C1)O)O MCULE-5589713302 [0,1,0,0,0,0|2,0,1]=4 872 B14R1.686 NC(CC1=CC(=C(C=C1)Cl)Cl)C(=O)O MCULE-8087658877 [0,1,0,0,0,0|2,0,1]=4 873 B14R1.686 NC(CC1=CC(=C(C=C1)F)Cl)C(=O)O MCULE-7264527288 [0,1,0,0,0,0|2,0,1]=4 874 B14R1.686 NC(CC1=CC(=C(C=C1)F)F)C(=O)O MCULE-6760740668 [0,1,0,0,0,0|2,0,1]=4 875 B14R1.686 NC(CC1=CC(=C(C=C1)F)F)C(=O)O MCULE-6967691364 [0,1,0,0,0,0|2,0,1]=4 876 B14R1.686 NC(CC1=CC(=C(C=C1)O)Br)C(=O)O MCULE-3374977523 [0,1,0,0,0,0|1,0,1]=3 877 B14R1.686 NC(CC1=CC(=C(C=C1)O)Br)C(=O)O MCULE-6181724347 [0,1,0,0,0,0|1,0,1]=3 878 B14R1.686 NC(CC1=CC(=C(C=C1)O)Cl)C(=O)O MCULE-2697786754 [0,1,0,0,0,0|1,0,1]=3 879 B14R1.686 NC(CC1=CC(=C(C=C1)O)Cl)C(=O)O MCULE-5698335509 [0,1,0,0,0,0|1,0,1]=3 880 B14R1.686 NC(CC1=CC=C(C(=C1)F)Cl)C(=O)O MCULE-5096730112 [0,1,0,0,0,0|2,0,1]=4 881 B14R1.686 NC(CC1=CC=C(C(=C1)F)O)C(=O)O MCULE-6834620182 [0,1,0,0,0,0|1,0,1]=3 882 B14R1.686 NC(CC1=CC=C(C(=C1)F)O)C(=O)O MCULE-9537492620 [0,1,0,0,0,0|1,0,1]=3 883 B14R1.686 NC(CC1=CC=C(C(=C1)O)F)C(=O)O MCULE-1976200660 [0,1,0,0,0,0|2,0,1]=4 884 B14R1.686 NC(CC1=CC=C(C(=C1)O)F)C(=O)O MCULE-7333560025 [0,1,0,0,0,0|2,0,1]=4 885 B14R1.686 NC(CC1=CC=C(C(=C1)O)O)C(=O)O MCULE-6834245595 [0,1,0,0,0,0|1,0,1]=3 886 B14R1.686 NC(CC1=CC=C(C(=C1)O)O)C(=O)[O-] MCULE-9471283867 [0,1,0,0,0,0|1,0,2]=4 887 B14R1.686 NC1=C(C=CC(=C1)CC(N)C(=O)O)O MCULE-2557670465 [0,1,0,0,0,0|1,0,1]=3 888 B14R1.686 NC1=C(C=CC(=C1)CC(N)C(=O)O)O MCULE-5549889238 [0,1,0,0,0,0|1,0,1]=3 889 B14R1.686 NC1=C(C=CC(=C1)C[C@H](N)C(=O)O)O MCULE-3775294936 [0,1,0,0,0,0|1,0,1]=3 890 B14R1.686 NC1=C(C=CC(=C1)C[C@H](N)C(=O)O)O MCULE-6839040671 [0,1,0,0,0,0|1,0,1]=3 891 B14R1.686 NC1=CC(=CC=C1O)C[C@H](N)C(=O)O MCULE-9607907699 [0,1,0,0,0,0|1,0,1]=3 892 B14R1.686 NC1=CC=C(C=C1O)C[C@H](N)C(=O)O MCULE-9600560994 [0,1,0,0,0,0|2,0,1]=4 893 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)Cl)Cl)C(=O)O MCULE-1204635145 [0,1,0,0,0,0|2,0,1]=4 894 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)F)F)C(=O)O MCULE-9674100333 [0,1,0,0,0,0|2,0,1]=4 895 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)O)Cl)C(=O)O MCULE-1164805788 [0,1,0,0,0,0|1,0,1]=3 896 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)O)Cl)C(=O)O MCULE-6365431286 [0,1,0,0,0,0|1,0,1]=3 897 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)O)F)C(=O)O MCULE-2345671151 [0,1,0,0,0,0|1,0,1]=3 898 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)O)I)C(=O)O MCULE-4703706022 [0,1,0,0,0,0|1,0,1]=3 899 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)O)O)C(=O)O MCULE-7571765742 [0,1,0,0,0,0|1,0,1]=3 900 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)Br)F)C(=O)O MCULE-3066216517 [0,1,0,0,0,0|2,0,1]=4 901 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)Cl)Cl)C(=O)O MCULE-8168956702 [0,1,0,0,0,0|2,0,1]=4 902 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)F)F)C(=O)O MCULE-9200119733 [0,1,0,0,0,0|2,0,1]=4 903 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)F)O)C(=O)O MCULE-1794626616 [0,1,0,0,0,0|1,0,1]=3 904 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)F)O)C(=O)O MCULE-7896954993 [0,1,0,0,0,0|1,0,1]=3 905 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)F)O)C(=O)O MCULE-8926188460 [0,1,0,0,0,0|1,0,1]=3 906 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)I)O)C(=O)O MCULE-7914019816 [0,1,0,0,0,0|1,0,1]=3 907 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)O)F)C(=O)O MCULE-2715592533 [0,1,0,0,0,0|2,0,1]=4 908 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)O)F)C(=O)O MCULE-3218547043 [0,1,0,0,0,0|2,0,1]=4 909 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)O)F)C(=O)O MCULE-3340290734 [0,1,0,0,0,0|2,0,1]=4 910 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)O)F)C(=O)O MCULE-6453108778 [0,1,0,0,0,0|2,0,1]=4 911 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)O)O)C(=O)O MCULE-4743781842 [0,1,0,0,0,0|1,0,1]=3 912 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)O)O)C(=O)O MCULE-8112075430 [0,1,0,0,0,0|1,0,1]=3 913 B14R1.686 N[C@H](CC1=CC(=C(C=C1)Cl)Cl)C(=O)O MCULE-6868231956 [0,1,0,0,0,0|2,0,1]=4 914 B14R1.686 N[C@H](CC1=CC(=C(C=C1)O)Cl)C(=O)O MCULE-1399466309 [0,1,0,0,0,0|1,0,1]=3 915 B14R1.686 N[C@H](CC1=CC(=C(C=C1)O)Cl)C(=O)O MCULE-1686922215 [0,1,0,0,0,0|1,0,1]=3 916 B14R1.686 N[C@H](CC1=CC(=C(C=C1)O)F)C(=O)O MCULE-2789104977 [0,1,0,0,0,0|1,0,1]=3 917 B14R1.686 N[C@H](CC1=CC(=C(C=C1)O)O)C(=O)O MCULE-3946263529 [0,1,0,0,0,0|1,0,1]=3 918 B14R1.686 N[C@H](CC1=CC=C(C(=C1)Br)O)C(=O)O MCULE-3413267848 [0,1,0,0,0,0|1,0,1]=3 919 B14R1.686 N[C@H](CC1=CC=C(C(=C1)Br)O)C(=O)O MCULE-9740236562 [0,1,0,0,0,0|1,0,1]=3 920 B14R1.686 N[C@H](CC1=CC=C(C(=C1)Cl)Cl)C(=O)O MCULE-1947805662 [0,1,0,0,0,0|2,0,1]=4 921 B14R1.686 N[C@H](CC1=CC=C(C(=C1)F)F)C(=O)O MCULE-4871068130 [0,1,0,0,0,0|2,0,1]=4 922 B14R1.686 N[C@H](CC1=CC=C(C(=C1)F)F)C(=O)O MCULE-8950844474 [0,1,0,0,0,0|2,0,1]=4 923 B14R1.686 N[C@H](CC1=CC=C(C(=C1)F)O)C(=O)O MCULE-8414400766 [0,1,0,0,0,0|1,0,1]=3 924 B14R1.686 N[C@H](CC1=CC=C(C(=C1)I)O)C(=O)O MCULE-3992386719 [0,1,0,0,0,0|1,0,1]=3 925 B14R1.686 N[C@H](CC1=CC=C(C(=C1)I)O)C(=O)O MCULE-7020255208 [0,1,0,0,0,0|1,0,1]=3 926 B14R1.686 N[C@H](CC1=CC=C(C(=C1)O)O)C(=O)O MCULE-2909167188 [0,1,0,0,0,0|1,0,1]=3 927 B14R1.686 O=C(O)C(=O)CC1=CC=C(C(=C1)O)O MCULE-6532951024 [0,1,0,0,0,0|0,0,0]=1 928 B14R1.686 O=C(O)C(=O)NC1=CC(=C(C=C1)Cl)F MCULE-7177548321 [0,1,0,0,0,0|2,0,0]=3 929 B14R1.686 O=C(O)C(=O)NC1=CC(=C(C=C1)F)F MCULE-4410132166 [0,1,0,0,0,0|2,0,0]=3 930 B14R1.686 O=C(O)C(=O)NC1=CC=C(C(=C1)Cl)F MCULE-4898230122 [0,1,0,0,0,0|2,0,0]=3 931 B14R1.686 O=C(O)C(Br)CC1=CC=C(C(=C1)Cl)Cl MCULE-8870603954 [0,1,0,0,0,0|2,0,1]=4 932 B14R1.686 O=C(O)C(O)CC1=CC(=C(C=C1)O)O MCULE-1331401569 [0,1,0,0,0,0|0,0,2]=3 933 B14R1.686 O=C(O)[C@H](O)CC1=CC(=C(C=C1)O)O MCULE-4395140487 [0,1,0,0,0,0|0,0,2]=3 934 B14R1.686 O=C(O)[C@H](O)CC1=CC(=C(C=C1)O)O MCULE-9485459217 [0,1,0,0,0,0|0,0,2]=3 935 B14R1.686 O=C([O-])C(O)CC1=CC(=C(C=C1)O)O MCULE-9830082207 [0,1,0,0,0,0|0,0,3]=4 936 B14R1.686 O=C([O-])[C@H](O)CC1=CC(=C(C=C1)O)O MCULE-1155965360 [0,1,0,0,0,0|0,0,3]=4 937 B14R1.686 O=C([O-])[C@H](O)CC1=CC(=C(C=C1)O)O MCULE-9062505748 [0,1,0,0,0,0|0,0,3]=4 938 B14R1.686 [C@H](N)(CC1=CC(=C(C=C1)O)Br)C(=O)O MCULE-3725297150 [0,1,0,0,0,0|1,0,1]=3 939 B14R1.686 [C@H](N)(CC1=CC(=C(C=C1)O)N)C(=O)O MCULE-4265042292 [0,1,0,0,0,0|1,0,1]=3 940 B14R1.686 [C@H](N)(CC1=CC=C(C(=C1)Br)O)C(=O)O MCULE-8641777132 [0,1,0,0,0,0|1,0,1]=3 941 B14R1.6049 CC(CC1=C(C=C(C=C1)Cl)Cl)C(=O)O MCULE-4560531869 [0,1,0,0,0,0|2,0,1]=4 942 B14R1.6049 CC(CC1=C(C=C(C=C1)F)F)C(=O)O MCULE-3991090994 [0,1,0,0,0,0|2,0,1]=4 943 B14R1.6049 CC1=C(C=CC(=C1)Br)CC(N)C(=O)O MCULE-6034051738 [0,1,0,0,0,0|2,0,1]=4 944 B14R1.6049 CC1=C(C=CC(=C1)Cl)NC(=O)C(=O)N MCULE-3990190252 [0,1,0,0,0,0|3,0,0]=4 945 B14R1.6049 CC1=C(C=CC(=C1)F)CC(N)C(=O)O MCULE-9023496359 [0,1,0,0,0,0|2,0,1]=4 946 B14R1.6049 CC1=C(C=CC(=C1)F)C[C@@H](N)C(=O)O MCULE-6447750504 [0,1,0,0,0,0|2,0,1]=4 947 B14R1.6049 CC1=C(C=CC(=C1)F)C[C@H](N)C(=O)O MCULE-9093360606 [0,1,0,0,0,0|2,0,1]=4 948 B14R1.6049 CC1=CC(=C(C=C1)CC(C)C(=O)O)C MCULE-4362364605 [0,1,0,0,0,0|2,0,1]=4 949 B14R1.6049 CC1=CC(=C(C=C1)CC(N)C(=O)O)Br MCULE-8346800201 [0,1,0,0,0,0|2,0,1]=4 950 B14R1.6049 CC1=CC(=C(C=C1)CC(N)C(=O)O)Cl MCULE-4640242910 [0,1,0,0,0,0|2,0,1]=4 951 B14R1.6049 CC1=CC(=C(C=C1)C[C@@H](N)C(=O)O)F MCULE-5807965189 [0,1,0,0,0,0|2,0,1]=4 952 B14R1.6049 CC1=CC(=C(C=C1)C[C@H](N)C(=O)O)C MCULE-6159563785 [0,1,0,0,0,0|2,0,1]=4 953 B14R1.6049 CC1=CC(=C(C=C1)C[C@H](N)C(=O)O)F MCULE-7582261370 [0,1,0,0,0,0|2,0,1]=4 954 B14R1.6049 CC1=CC(=C(C=C1)NC(=O)C(=O)O)C MCULE-4097045182 [0,1,0,0,0,0|2,0,0]=3 955 B14R1.6049 CC1=CC(=CC=C1CC(C)C(=O)O)F MCULE-9118496054 [0,1,0,0,0,0|2,0,1]=4 956 B14R1.6049 CC1=CC(=CC=C1C[C@@H](N)C(=O)O)Cl MCULE-1002585890 [0,1,0,0,0,0|2,0,1]=4 957 B14R1.6049 CC1=CC(=CC=C1C[C@H](N)C(=O)O)Cl MCULE-1772548941 [0,1,0,0,0,0|2,0,1]=4 958 B14R1.6049 CC1=CC(=CC=C1C[C@H](N)C(=O)O)Cl MCULE-5868047166 [0,1,0,0,0,0|2,0,1]=4 959 B14R1.6049 CC1=CC(=CC=C1NC(=O)C(=O)N)Br MCULE-8226207391 [0,1,0,0,0,0|3,0,0]=4 960 B14R1.6049 CC1=CC=C(C(=C1)C)CC(N)C(=O)O MCULE-8036731257 [0,1,0,0,0,0|2,0,1]=4 961 B14R1.6049 CC1=CC=C(C(=C1)C)C[C@@H](N)C(=O)O MCULE-2678912652 [0,1,0,0,0,0|2,0,1]=4 962 B14R1.6049 CC1=CC=C(C(=C1)C)C[C@@H](N)C(=O)O MCULE-4617067389 [0,1,0,0,0,0|2,0,1]=4 963 B14R1.6049 CC1=CC=C(C(=C1)C)C[C@H](N)C(=O)O MCULE-2182724258 [0,1,0,0,0,0|2,0,1]=4 964 B14R1.6049 CC1=CC=C(C(=C1)C)C[C@H](N)C(=O)O MCULE-2493165040 [0,1,0,0,0,0|2,0,1]=4 965 B14R1.6049 CC1=CC=C(C(=C1)C)C[C@H](N)C(=O)O MCULE-8954624870 [0,1,0,0,0,0|2,0,1]=4 966 B14R1.6049 CC1=CC=C(C(=C1)F)CC(C)C(=O)O MCULE-9506504429 [0,1,0,0,0,0|2,0,1]=4 967 B14R1.6049 CC1=CC=C(C(=C1)F)CC(N)C(=O)O MCULE-4036470152 [0,1,0,0,0,0|2,0,1]=4 968 B14R1.6049 NC(=O)C(=O)NC1=C(C=C(C=C1)Cl)Cl MCULE-8896612092 [0,1,0,0,0,0|3,0,0]=4 969 B14R1.6049 NC(=O)C(=O)NC1=CC=C(C=C1F)F MCULE-1536254608 [0,1,0,0,0,0|3,0,0]=4 970 B14R1.6049 NC(CC1=C(C=C(C=C1)Br)Cl)C(=O)O MCULE-8668407366 [0,1,0,0,0,0|2,0,1]=4 971 B14R1.6049 NC(CC1=C(C=C(C=C1)Br)F)C(=O)O MCULE-4672380991 [0,1,0,0,0,0|2,0,1]=4 972 B14R1.6049 NC(CC1=C(C=C(C=C1)Cl)Cl)C(=O)O MCULE-5114979925 [0,1,0,0,0,0|2,0,1]=4 973 B14R1.6049 NC(CC1=C(C=C(C=C1)Cl)Cl)C(=O)O MCULE-6327442292 [0,1,0,0,0,0|2,0,1]=4 974 B14R1.6049 NC(CC1=C(C=C(C=C1)F)F)C(=O)O MCULE-6072609804 [0,1,0,0,0,0|2,0,1]=4 975 B14R1.6049 NC(CC1=C(C=C(C=C1)F)F)C(=O)O MCULE-6881817955 [0,1,0,0,0,0|2,0,1]=4 976 B14R1.6049 NC(CC1=C(C=C(C=C1)O)Cl)C(=O)O MCULE-2921958983 [0,1,0,0,0,0|1,0,1]=3 977 B14R1.6049 NC(CC1=C(C=C(C=C1)O)F)C(=O)O MCULE-3109401325 [0,1,0,0,0,0|1,0,1]=3 978 B14R1.6049 NC(CC1=C(C=C(C=C1)O)O)C(=O)O MCULE-7962902478 [0,1,0,0,0,0|1,0,1]=3 979 B14R1.6049 NC(CC1=CC=C(C=C1Cl)F)C(=O)O MCULE-8537044576 [0,1,0,0,0,0|2,0,1]=4 980 B14R1.6049 NC(CC1=CC=C(C=C1Cl)O)C(=O)O MCULE-2256739100 [0,1,0,0,0,0|1,0,1]=3 981 B14R1.6049 NC(CC1=CC=C(C=C1F)Cl)C(=O)O MCULE-1150187820 [0,1,0,0,0,0|2,0,1]=4 982 B14R1.6049 NC(CC1=CC=C(C=C1F)O)C(=O)O MCULE-4021052103 [0,1,0,0,0,0|1,0,1]=3 983 B14R1.6049 NC1=CC(=CC=C1C[C@H](N)C(=O)O)F MCULE-1958188301 [0,1,0,0,0,0|2,0,1]=4 984 B14R1.6049 NC1=CC(=CC=C1C[C@H](N)C(=O)O)F MCULE-5650081399 [0,1,0,0,0,0|2,0,1]=4 985 B14R1.6049 N[C@@H](CC1=C(C=C(C=C1)Br)F)C(=O)O MCULE-9898110769 [0,1,0,0,0,0|2,0,1]=4 986 B14R1.6049 N[C@@H](CC1=C(C=C(C=C1)Cl)Cl)C(=O)O MCULE-3098807866 [0,1,0,0,0,0|2,0,1]=4 987 B14R1.6049 N[C@@H](CC1=C(C=C(C=C1)F)Cl)C(=O)O MCULE-4083921627 [0,1,0,0,0,0|2,0,1]=4 988 B14R1.6049 N[C@@H](CC1=C(C=C(C=C1)O)F)C(=O)O MCULE-5550182466 [0,1,0,0,0,0|1,0,1]=3 989 B14R1.6049 N[C@@H](CC1=C(C=C(C=C1)O)F)C(=O)O MCULE-6359920112 [0,1,0,0,0,0|1,0,1]=3 990 B14R1.6049 N[C@@H](CC1=C(C=C(C=C1)O)I)C(=O)O MCULE-7882200481 [0,1,0,0,0,0|1,0,1]=3 991 B14R1.6049 N[C@@H](CC1=CC=C(C=C1Cl)Br)C(=O)O MCULE-5338377818 [0,1,0,0,0,0|2,0,1]=4 992 B14R1.6049 N[C@@H](CC1=CC=C(C=C1Cl)Cl)C(=O)O MCULE-2417736401 [0,1,0,0,0,0|2,0,1]=4 993 B14R1.6049 N[C@@H](CC1=CC=C(C=C1Cl)O)C(=O)O MCULE-3109796033 [0,1,0,0,0,0|1,0,1]=3 994 B14R1.6049 N[C@@H](CC1=CC=C(C=C1Cl)O)C(=O)O MCULE-6959551384 [0,1,0,0,0,0|1,0,1]=3 995 B14R1.6049 N[C@@H](CC1=CC=C(C=C1Cl)O)C(=O)O MCULE-8555611273 [0,1,0,0,0,0|1,0,1]=3 996 B14R1.6049 N[C@@H](CC1=CC=C(C=C1Cl)O)C(=O)O MCULE-8736759724 [0,1,0,0,0,0|1,0,1]=3 997 B14R1.6049 N[C@@H](CC1=CC=C(C=C1F)Cl)C(=O)O MCULE-9128897230 [0,1,0,0,0,0|2,0,1]=4 998 B14R1.6049 N[C@@H](CC1=CC=C(C=C1F)F)C(=O)O MCULE-1930794331 [0,1,0,0,0,0|2,0,1]=4 999 B14R1.6049 N[C@@H](CC1=CC=C(C=C1F)F)C(=O)O MCULE-3003882189 [0,1,0,0,0,0|2,0,1]=4 1000 B14R1.6049 N[C@@H](CC1=CC=C(C=C1F)F)C(=O)O MCULE-8956153283 [0,1,0,0,0,0|2,0,1]=4 1001 B14R1.6049 N[C@@H](CC1=CC=C(C=C1F)O)C(=O)O MCULE-5441549629 [0,1,0,0,0,0|1,0,1]=3 1002 B14R1.6049 N[C@@H](CC1=CC=C(C=C1F)O)C(=O)O MCULE-6957202412 [0,1,0,0,0,0|1,0,1]=3 1003 B14R1.6049 N[C@@H](CC1=CC=C(C=C1O)F)C(=O)O MCULE-8244759081 [0,1,0,0,0,0|2,0,1]=4 1004 B14R1.6049 N[C@@H](CC1=CC=C(C=C1O)O)C(=O)O MCULE-7696755502 [0,1,0,0,0,0|1,0,1]=3 1005 B14R1.6049 N[C@H](CC1=C(C=C(C=C1)Cl)Cl)C(=O)O MCULE-2223544843 [0,1,0,0,0,0|2,0,1]=4 1006 B14R1.6049 N[C@H](CC1=C(C=C(C=C1)Cl)Cl)C(=O)O MCULE-9659627302 [0,1,0,0,0,0|2,0,1]=4 1007 B14R1.6049 N[C@H](CC1=C(C=C(C=C1)Cl)F)C(=O)O MCULE-4914693738 [0,1,0,0,0,0|2,0,1]=4 1008 B14R1.6049 N[C@H](CC1=C(C=C(C=C1)F)Cl)C(=O)O MCULE-3374036323 [0,1,0,0,0,0|2,0,1]=4 1009 B14R1.6049 N[C@H](CC1=C(C=C(C=C1)F)F)C(=O)O MCULE-9956438755 [0,1,0,0,0,0|2,0,1]=4 1010 B14R1.6049 N[C@H](CC1=C(C=C(C=C1)O)F)C(=O)O MCULE-2515957835 [0,1,0,0,0,0|1,0,1]=3 1011 B14R1.6049 N[C@H](CC1=C(C=C(C=C1)O)F)C(=O)O MCULE-3080221011 [0,1,0,0,0,0|1,0,1]=3 1012 B14R1.6049 N[C@H](CC1=C(C=C(C=C1)O)I)C(=O)O MCULE-9035255629 [0,1,0,0,0,0|1,0,1]=3 1013 B14R1.6049 N[C@H](CC1=CC=C(C=C1Cl)Br)C(=O)O MCULE-3154387192 [0,1,0,0,0,0|2,0,1]=4 1014 B14R1.6049 N[C@H](CC1=CC=C(C=C1Cl)Br)C(=O)O MCULE-5498008986 [0,1,0,0,0,0|2,0,1]=4 1015 B14R1.6049 N[C@H](CC1=CC=C(C=C1F)F)C(=O)O MCULE-3400145832 [0,1,0,0,0,0|2,0,1]=4 1016 B14R1.6049 N[C@H](CC1=CC=C(C=C1F)F)C(=O)O MCULE-6022690956 [0,1,0,0,0,0|2,0,1]=4 1017 B14R1.6049 N[C@H](CC1=CC=C(C=C1F)F)C(=O)O MCULE-7464010527 [0,1,0,0,0,0|2,0,1]=4 1018 B14R1.6049 O=C(O)C(=O)CC1=C(C=C(C=C1)F)F MCULE-9470090897 [0,1,0,0,0,0|1,0,0]=2 1019 B14R1.6049 O=C(O)C(=O)NC1=CC=C(C=C1Cl)Cl MCULE-8352985906 [0,1,0,0,0,0|2,0,0]=3 1020 B14R1.6049 O=C(O)C(=O)NC1=CC=C(C=C1F)F MCULE-2501289787 [0,1,0,0,0,0|2,0,0]=3 1021 B14R1.6049 O=C(O)C(Br)CC1=C(C=C(C=C1)Cl)Cl MCULE-9975513527 [0,1,0,0,0,0|2,0,1]=4 1022 B14R1.6049 O=C(O)C(O)CC1=CC=C(C=C1Cl)Cl MCULE-3687692582 [0,1,0,0,0,0|1,0,2]=4 1023 B14R1.7626 CC(C)(CC1=CC=C(C=C1)Br)C(=O)O MCULE-7412446178 [0,1,0,0,0,0|2,0,1]=4 1024 B14R1.7626 CC(C)(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-9552026568 [0,1,0,0,0,0|2,0,1]=4 1025 B14R1.7626 CC(C)(CC1=CC=C(C=C1)F)C(=O)O MCULE-6047776217 [0,1,0,0,0,0|2,0,1]=4 1026 B14R1.7626 CC(C)(CC1=CC=C(C=C1)O)C(=O)O MCULE-9335199083 [0,1,0,0,0,0|1,0,1]=3 1027 B14R1.7626 CC(N)(CC1=CC=C(C=C1)Br)C(=O)O MCULE-7076296146 [0,1,0,0,0,0|2,0,1]=4 1028 B14R1.7626 CC(N)(CC1=CC=C(C=C1)Br)C(=O)O MCULE-7302845887 [0,1,0,0,0,0|2,0,1]=4 1029 B14R1.7626 CC(N)(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-2953142942 [0,1,0,0,0,0|2,0,1]=4 1030 B14R1.7626 CC(N)(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-5172974897 [0,1,0,0,0,0|2,0,1]=4 1031 B14R1.7626 CC(N)(CC1=CC=C(C=C1)F)C(=O)O MCULE-2384275519 [0,1,0,0,0,0|2,0,1]=4 1032 B14R1.7626 CC(N)(CC1=CC=C(C=C1)F)C(=O)O MCULE-3083862489 [0,1,0,0,0,0|2,0,1]=4 1033 B14R1.7626 CC(N)(CC1=CC=C(C=C1)O)C(=O)O MCULE-1700935161 [0,1,0,0,0,0|1,0,1]=3 1034 B14R1.7626 CC(N)(CC1=CC=C(C=C1)O)C(=O)O MCULE-9990457253 [0,1,0,0,0,0|1,0,1]=3 1035 B14R1.7626 CC(O)(CC1=CC=C(C=C1)F)C(=O)O MCULE-2850291067 [0,1,0,0,0,0|1,0,2]=4 1036 B14R1.7626 CC1=CC=C(C=C1)CC(C)(C)C(=O)O MCULE-1069788086 [0,1,0,0,0,0|2,0,1]=4 1037 B14R1.7626 C[C@@](N)(CC1=CC=C(C=C1)Br)C(=O)O MCULE-5521094663 [0,1,0,0,0,0|2,0,1]=4 1038 B14R1.7626 C[C@@](N)(CC1=CC=C(C=C1)Br)C(=O)O MCULE-9054126131 [0,1,0,0,0,0|2,0,1]=4 1039 B14R1.7626 C[C@@](N)(CC1=CC=C(C=C1)F)C(=O)O MCULE-6352802974 [0,1,0,0,0,0|2,0,1]=4 1040 B14R1.7626 C[C@@](N)(CC1=CC=C(C=C1)F)C(=O)O MCULE-9883397867 [0,1,0,0,0,0|2,0,1]=4 1041 B14R1.7626 C[C@@](N)(CC1=CC=C(C=C1)O)C(=O)O MCULE-2159877207 [0,1,0,0,0,0|1,0,1]=3 1042 B14R1.7626 C[C@@](N)(CC1=CC=C(C=C1)O)C(=O)O MCULE-8334397996 [0,1,0,0,0,0|1,0,1]=3 1043 B14R1.7626 C[C@](N)(CC1=CC=C(C=C1)Br)C(=O)O MCULE-2994810034 [0,1,0,0,0,0|2,0,1]=4 1044 B14R1.7626 C[C@](N)(CC1=CC=C(C=C1)F)C(=O)O MCULE-8733293904 [0,1,0,0,0,0|2,0,1]=4 1045 B14R1.7626 C[C@](N)(CC1=CC=C(C=C1)F)C(=O)O MCULE-9306116320 [0,1,0,0,0,0|2,0,1]=4 1046 B14R1.7626 C[C@](N)(CC1=CC=C(C=C1)I)C(=O)O MCULE-7973579575 [0,1,0,0,0,0|2,0,1]=4 1047 B14R1.7626 C[C@](N)(CC1=CC=C(C=C1)O)C(=O)O MCULE-4720986345 [0,1,0,0,0,0|1,0,1]=3 1048 B14R1.7626 C[C@](N)(CC1=CC=C(C=C1)O)C(=O)O MCULE-5340647798 [0,1,0,0,0,0|1,0,1]=3 1049 B14R1.7626 O=C(O)C(F)(F)CC1=CC=C(C=C1)Br MCULE-1726007905 [0,1,0,0,0,0|2,0,1]=4 1050 B14R2.4402 CC1=CC=C(C=C1)C2CC2C(=O)O MCULE-5478837666 [0,0,0,1,0,0|2,0,1]=4 1051 B14R2.4402 CC1=CC=C(C=C1)C2OC2C(=O)O MCULE-3930695248 [0,0,0,1,0,0|1,0,2]=4 1052 B14R2.4402 CC1=CC=C(C=C1)[C@@H]2C[C@H]2C(=O)O MCULE-9103873740 [0,0,0,1,0,0|2,0,1]=4 1053 B14R2.4402 CC1=CC=C(C=C1)[C@H]2C[C@@H]2C(=O)O MCULE-3312418051 [0,0,0,1,0,0|2,0,1]=4 1054 B14R2.4402 NC1=CC=C(C=C1)[C@@H]2C[C@H]2C(=O)O MCULE-8773254908 [0,0,0,1,0,0|2,0,1]=4 1055 B14R2.4402 O=C(O)C1CC1C2=CC=C(C=C2)Br MCULE-6449774338 [0,0,0,1,0,0|2,0,1]=4 1056 B14R2.4402 O=C(O)C1CC1C2=CC=C(C=C2)Cl MCULE-2373959507 [0,0,0,1,0,0|2,0,1]=4 1057 B14R2.4402 O=C(O)C1CC1C2=CC=C(C=C2)F MCULE-6485779532 [0,0,0,1,0,0|2,0,1]=4 1058 B14R2.4402 O=C(O)C1CC1C2=CC=C(C=C2)O MCULE-1775280332 [0,0,0,1,0,0|1,0,1]=3 1059 B14R2.4402 O=C(O)C1OC1C2=CC=C(C=C2)Br MCULE-4225001597 [0,0,0,1,0,0|1,0,2]=4 1060 B14R2.4402 O=C(O)C1OC1C2=CC=C(C=C2)Cl MCULE-6686127170 [0,0,0,1,0,0|1,0,2]=4 1061 B14R2.4402 O=C(O)C1OC1C2=CC=C(C=C2)F MCULE-3922099734 [0,0,0,1,0,0|1,0,2]=4 1062 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(C=C2)Br MCULE-2286228969 [0,0,0,1,0,0|2,0,1]=4 1063 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(C=C2)Br MCULE-9099675007 [0,0,0,1,0,0|2,0,1]=4 1064 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(C=C2)Cl MCULE-1997210651 [0,0,0,1,0,0|2,0,1]=4 1065 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(C=C2)Cl MCULE-5798927297 [0,0,0,1,0,0|2,0,1]=4 1066 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(C=C2)Cl MCULE-9207601985 [0,0,0,1,0,0|2,0,1]=4 1067 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(C=C2)F MCULE-4968377749 [0,0,0,1,0,0|2,0,1]=4 1068 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(C=C2)F MCULE-7739400514 [0,0,0,1,0,0|2,0,1]=4 1069 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(C=C2)F MCULE-9334740390 [0,0,0,1,0,0|2,0,1]=4 1070 B14R2.4402 O=C(O)[C@H]1C[C@@H]1C2=CC=C(C=C2)Br MCULE-4829789877 [0,0,0,1,0,0|2,0,1]=4 1071 B14R2.4402 O=C(O)[C@H]1C[C@@H]1C2=CC=C(C=C2)Cl MCULE-2848575365 [0,0,0,1,0,0|2,0,1]=4 1072 B14R2.4402 O=C(O)[C@H]1C[C@@H]1C2=CC=C(C=C2)Cl MCULE-7325969282 [0,0,0,1,0,0|2,0,1]=4 1073 B14R2.4402 O=C(O)[C@H]1C[C@@H]1C2=CC=C(C=C2)F MCULE-3588874389 [0,0,0,1,0,0|2,0,1]=4 1074 B14R2.4402 O=C(O)[C@H]1C[C@@H]1C2=CC=C(C=C2)F MCULE-8376029588 [0,0,0,1,0,0|2,0,1]=4 1075 B14R2.4402 O=C(O)[C@H]1C[C@@H]1C2=CC=C(C=C2)O MCULE-3254632134 [0,0,0,1,0,0|1,0,1]=3 1076 B14R2.4402 O=C(O)[C@H]1C[C@@H]1C2=CC=C(C=C2)O MCULE-4081465116 [0,0,0,1,0,0|1,0,1]=3 1077 B14R2.4402 [C@@H]1(C[C@@H]1C2=CC=C(C=C2)Br)C(=O)O MCULE-5770487637 [0,0,0,1,0,0|2,0,1]=4 1078 B14R2.4402 [C@H]1(C[C@H]1C2=CC=C(C=C2)O)C(=O)O MCULE-6807862077 [0,0,0,1,0,0|1,0,1]=3 1079 B14R2.4529 CC(=O)C1=CC2=CC(=CC=C2O1)O MCULE-2825976581 [0,0,0,1,0,0|3,0,0]=4 1080 B14R2.4529 CC1=CC2=C(C=C1)C=C(S2)C(=O)O MCULE-7535946880 [0,0,0,1,0,0|1,1,1]=4 1081 B14R2.4529 CC1=CC2=C(C=C1)CC(S2)C(=O)O MCULE-4983434982 [0,0,0,1,0,0|1,1,1]=4 1082 B14R2.4529 CC1=CC2=C(C=C1)N=C(O2)C(=O)O MCULE-4676953664 [0,0,0,1,0,0|2,0,1]=4 1083 B14R2.4529 CC1=CC2=C(C=C1)OC(=C2)C(=O)O MCULE-3994650436 [0,0,0,1,0,0|3,0,0]=4 1084 B14R2.4529 CC1=CC2=C(C=C1)OC(=N2)C(=O)O MCULE-4366281790 [0,0,0,1,0,0|3,0,0]=4 1085 B14R2.4529 CC1=CC2=C(C=C1)SC(=C2)C(=O)O MCULE-4898853807 [0,0,0,1,0,0|3,0,0]=4 1086 B14R2.4529 CC1=CC=C2C=C(NC2=C1)C(=O)O MCULE-8264158205 [0,0,0,1,0,0|2,0,1]=4 1087 B14R2.4529 CC1=CC=C2C=C(OC2=C1)C(=O)O MCULE-2214176331 [0,0,0,1,0,0|1,0,2]=4 1088 B14R2.4529 CC1=CC=C2CC(OC2=C1)C(=O)O MCULE-8483507196 [0,0,0,1,0,0|1,0,2]=4 1089 B14R2.4529 CC1=CC=C2N=C(SC2=C1)C(=O)O MCULE-5880593237 [0,0,0,1,0,0|2,1,0]=4 1090 B14R2.4529 CC1=CC=C2NC(=CC2=C1)C(=O)O MCULE-5011941873 [0,0,0,1,0,0|3,0,0]=4 1091 B14R2.4529 CC1=CC=C2NC(=NC2=C1)C(=O)O MCULE-1968751814 [0,0,0,1,0,0|3,0,0]=4 1092 B14R2.4529 NC(=O)C1=NC2=C(O1)C=CC(=C2)O MCULE-6461288080 [0,0,0,1,0,0|3,0,0]=4 1093 B14R2.4529 NC1=CC2=C(C=C1)C=C(N2)C(=O)O MCULE-4660368633 [0,0,0,1,0,0|2,0,1]=4 1094 B14R2.4529 NC1=CC2=C(C=C1)NC(=C2)C(=O)O MCULE-5175411843 [0,0,0,1,0,0|3,0,0]=4 1095 B14R2.4529 NC1=CC2=C(C=C1)OC(=C2)C(=O)O MCULE-8615601257 [0,0,0,1,0,0|3,0,0]=4 1096 B14R2.4529 NC1=CC2=C(C=C1)SC(=C2)C(=O)O MCULE-5906324784 [0,0,0,1,0,0|3,0,0]=4 1097 B14R2.4529 NC1=CC=C2C=C(SC2=C1)C(=O)O MCULE-7279247306 [0,0,0,1,0,0|1,1,1]=4 1098 B14R2.4529 NC1=CC=C2CC(NC2=C1)C(=O)O MCULE-2176604106 [0,0,0,1,0,0|2,0,1]=4 1099 B14R2.4529 NC1=CC=C2NC(=NC2=C1)C(=O)O MCULE-4621552067 [0,0,0,1,0,0|3,0,0]=4 1100 B14R2.4529 NC1=CC=C2NC(=NC2=C1)C(=O)O MCULE-5432106577 [0,0,0,1,0,0|3,0,0]=4 1101 B14R2.4529 NC1=CC=C2OC(=NC2=C1)C(=O)O MCULE-1324277435 [0,0,0,1,0,0|3,0,0]=4 1102 B14R2.4529 NC1=CC=C2SC(=CC2=C1)C(=O)O MCULE-4554933261 [0,0,0,1,0,0|3,0,0]=4 1103 B14R2.4529 O=C(Cl)C1=CC2=CC(=CC=C2N1)O MCULE-8117052888 [0,0,0,1,0,0|3,0,0]=4 1104 B14R2.4529 O=C(O)C1=CC2=C(N1)C=C(C=C2)Br MCULE-5960395717 [0,0,0,1,0,0|2,0,1]=4 1105 B14R2.4529 O=C(O)C1=CC2=C(N1)C=C(N=C2)O MCULE-3167669292 [0,0,0,1,0,0|2,0,1]=4 1106 B14R2.4529 O=C(O)C1=CC2=C(N1)C=CC(=C2)Br MCULE-4458100829 [0,0,0,1,0,0|3,0,0]=4 1107 B14R2.4529 O=C(O)C1=CC2=C(N1)C=CC(=C2)F MCULE-7105968907 [0,0,0,1,0,0|3,0,0]=4 1108 B14R2.4529 O=C(O)C1=CC2=C(N1)C=CC(=C2)I MCULE-8041395933 [0,0,0,1,0,0|3,0,0]=4 1109 B14R2.4529 O=C(O)C1=CC2=C(N1)C=CC(=C2)O MCULE-1314297483 [0,0,0,1,0,0|2,0,0]=3 1110 B14R2.4529 O=C(O)C1=CC2=C(N1)N=CC(=C2)O MCULE-3368229207 [0,0,0,1,0,0|3,0,0]=4 1111 B14R2.4529 O=C(O)C1=CC2=C(O1)C=C(C=C2)F MCULE-7769706993 [0,0,0,1,0,0|1,0,2]=4 1112 B14R2.4529 O=C(O)C1=CC2=C(O1)C=CC(=C2)Cl MCULE-1017602062 [0,0,0,1,0,0|3,0,0]=4 1113 B14R2.4529 O=C(O)C1=CC2=C(O1)C=CC(=C2)F MCULE-5681557933 [0,0,0,1,0,0|3,0,0]=4 1114 B14R2.4529 O=C(O)C1=CC2=C(O1)C=CC(=C2)O MCULE-5739150653 [0,0,0,1,0,0|2,0,0]=3 1115 B14R2.4529 O=C(O)C1=CC2=C(S1)C=C(C=C2)Cl MCULE-2203734746 [0,0,0,1,0,0|1,1,1]=4 1116 B14R2.4529 O=C(O)C1=CC2=C(S1)C=C(C=C2)F MCULE-8307850854 [0,0,0,1,0,0|1,1,1]=4 1117 B14R2.4529 O=C(O)C1=CC2=C(S1)C=CC(=C2)Br MCULE-7613197718 [0,0,0,1,0,0|3,0,0]=4 1118 B14R2.4529 O=C(O)C1=CC2=C(S1)C=CC(=C2)F MCULE-4240455492 [0,0,0,1,0,0|3,0,0]=4 1119 B14R2.4529 O=C(O)C1=CC2=CC(=CC=C2N1)Cl MCULE-5711501424 [0,0,0,1,0,0|3,0,0]=4 1120 B14R2.4529 O=C(O)C1=CC2=CC(=CC=C2O1)Br MCULE-1188726875 [0,0,0,1,0,0|3,0,0]=4 1121 B14R2.4529 O=C(O)C1=CC2=CC(=CC=C2S1)Cl MCULE-5360966795 [0,0,0,1,0,0|3,0,0]=4 1122 B14R2.4529 O=C(O)C1=CC2=CC=C(C=C2N1)Cl MCULE-1413303202 [0,0,0,1,0,0|2,0,1]=4 1123 B14R2.4529 O=C(O)C1=CC2=CC=C(C=C2N1)F MCULE-8668027408 [0,0,0,1,0,0|2,0,1]=4 1124 B14R2.4529 O=C(O)C1=CC2=CC=C(C=C2N1)I MCULE-8124519811 [0,0,0,1,0,0|2,0,1]=4 1125 B14R2.4529 O=C(O)C1=CC2=CC=C(C=C2N1)O MCULE-9576998043 [0,0,0,1,0,0|1,0,1]=3 1126 B14R2.4529 O=C(O)C1=CC2=CC=C(C=C2O1)Br MCULE-3900545166 [0,0,0,1,0,0|1,0,2]=4 1127 B14R2.4529 O=C(O)C1=CC2=CC=C(C=C2O1)Cl MCULE-8857573241 [0,0,0,1,0,0|1,0,2]=4 1128 B14R2.4529 O=C(O)C1=CC2=CC=C(C=C2O1)O MCULE-4780813249 [0,0,0,1,0,0|0,0,2]=3 1129 B14R2.4529 O=C(O)C1=CC2=CC=C(C=C2S1)Br MCULE-7504572223 [0,0,0,1,0,0|1,1,1]=4 1130 B14R2.4529 O=C(O)C1=CC2=CC=C(C=C2S1)O MCULE-1840743685 [0,0,0,1,0,0|0,1,1]=3 1131 B14R2.4529 O=C(O)C1=CN2C=C(C=CC2=C1)O MCULE-8307618182 [0,0,0,1,0,0|2,0,1]=4 1132 B14R2.4529 O=C(O)C1=CN2C=C(C=CC2=N1)O MCULE-3421401240 [0,0,0,1,0,0|3,0,0]=4 1133 B14R2.4529 O=C(O)C1=CN2C=CC(=CC2=N1)O MCULE-2462874582 [0,0,0,1,0,0|2,0,1]=4 1134 B14R2.4529 O=C(O)C1=NC2=C(N1)C=CC(=C2)O MCULE-9804990045 [0,0,0,1,0,0|2,0,0]=3 1135 B14R2.4529 O=C(O)C1=NC2=C(O1)C=C(C=C2)Cl MCULE-7433897806 [0,0,0,1,0,0|2,0,1]=4 1136 B14R2.4529 O=C(O)C1=NC2=C(O1)C=CC(=C2)Br MCULE-4166732224 [0,0,0,1,0,0|3,0,0]=4 1137 B14R2.4529 O=C(O)C1=NC2=C(S1)C=CC(=C2)F MCULE-5543011554 [0,0,0,1,0,0|3,0,0]=4 1138 B14R2.4529 O=C(O)C1=NC2=CC(=CC=C2N1)Br MCULE-4948910851 [0,0,0,1,0,0|3,0,0]=4 1139 B14R2.4529 O=C(O)C1=NC2=CC(=CC=C2N1)Cl MCULE-5548041790 [0,0,0,1,0,0|3,0,0]=4 1140 B14R2.4529 O=C(O)C1=NC2=CC(=CC=C2N1)F MCULE-7055289990 [0,0,0,1,0,0|3,0,0]=4 1141 B14R2.4529 O=C(O)C1=NC2=CC(=CC=C2O1)Cl MCULE-4078463078 [0,0,0,1,0,0|3,0,0]=4 1142 B14R2.4529 O=C(O)C1=NC2=CC(=CC=C2O1)F MCULE-8500673606 [0,0,0,1,0,0|3,0,0]=4 1143 B14R2.4529 O=C(O)C1=NC2=CC(=CC=C2S1)Br MCULE-7185581120 [0,0,0,1,0,0|3,0,0]=4 1144 B14R2.4529 O=C(O)C1=NC2=CC(=CC=C2S1)Cl MCULE-4455930512 [0,0,0,1,0,0|3,0,0]=4 1145 B14R2.4529 O=C(O)C1=NC2=CC(=CC=C2S1)O MCULE-3640170518 [0,0,0,1,0,0|2,0,0]=3 1146 B14R2.4529 O=C(O)C1=NC2=CC=C(C=C2O1)Br MCULE-3446606505 [0,0,0,1,0,0|2,0,1]=4 1147 B14R2.4529 O=C(O)C1=NC2=CC=C(C=C2O1)F MCULE-9431955193 [0,0,0,1,0,0|2,0,1]=4 1148 B14R2.4529 O=C(O)C1=NC2=CC=C(C=C2S1)Br MCULE-5819852795 [0,0,0,1,0,0|2,1,0]=4 1149 B14R2.4529 O=C(O)C1=NC2=CC=C(C=C2S1)Cl MCULE-3024237621 [0,0,0,1,0,0|2,1,0]=4 1150 B14R2.4529 O=C(O)C1=NC2=CC=C(C=C2S1)F MCULE-2155626348 [0,0,0,1,0,0|2,1,0]=4 1151 B14R2.4529 O=C(O)C1=NC2=CC=C(C=C2S1)O MCULE-9973646561 [0,0,0,1,0,0|1,1,0]=3 1152 B14R2.4529 O=C(O)C1CC2=C(S1)C=C(C=C2)Cl MCULE-2795593466 [0,0,0,1,0,0|1,1,1]=4 1153 B14R2.4529 O=C(O)C1CC2=CC(=CC=C2O1)O MCULE-3013096351 [0,0,0,1,0,0|2,0,1]=4 1154 B14R2.4529 O=C(O)C1CC2=CC=C(C=C2C1)Br MCULE-2843651169 [0,0,0,1,0,0|2,0,1]=4 1155 B14R2.4529 O=C(O)C1CC2=CC=C(C=C2C1)F MCULE-3982875810 [0,0,0,1,0,0|2,0,1]=4 1156 B14R2.4529 O=C(O)C1CC2=CC=C(C=C2O1)F MCULE-4764190520 [0,0,0,1,0,0|1,0,2]=4 1157 B14R2.4529 O=C(O)C1CC2=CC=C(C=C2O1)O MCULE-9098976055 [0,0,0,1,0,0|0,0,2]=3 1158 B14R2.4529 O=C(O)C1CC2=CC=C(C=C2S1)F MCULE-5815762143 [0,0,0,1,0,0|1,1,1]=4 1159 B14R2.8239 CC1=CC2=CC=C(C=C2OC1=O)F MCULE-2381169209 [0,0,0,1,0,0|2,0,1]=4 1160 B14R2.8239 CC1=CC2=CC=C(C=C2OC1=O)O MCULE-5805524308 [0,0,0,1,0,0|1,0,1]=3 1161 B14R2.8239 CN1CC2=CC=C(C=C2OC1=O)Br MCULE-3211537982 [0,0,0,1,0,0|3,0,0]=4 1162 B14R2.8239 NC1=CC2=C(C=C(C=C2)O)OC1=O MCULE-7410567603 [0,0,0,1,0,0|1,0,1]=3 1163 B14R2.8239 NC1=CC2=C(C=C1)NC(=O)C(=O)N2 MCULE-5968404351 [0,0,0,1,0,0|3,0,0]=4 1164 B14R2.8239 NC1=CC2=C(C=CC(=C2)O)OC1=O MCULE-2190342217 [0,0,0,1,0,0|3,0,0]=4 1165 B14R2.8239 O=C1NC2=C(C=C(C=C2)Cl)NC1=O MCULE-4346050890 [0,0,0,1,0,0|3,0,0]=4 1166 B14R2.8239 O=C1NC2=C(C=C(C=C2)I)NC1=O MCULE-4583932860 [0,0,0,1,0,0|3,0,0]=4 1167 B14R2.8239 O=C1NC2=C(C=C(C=C2)O)NC1=O MCULE-8420115160 [0,0,0,1,0,0|2,0,0]=3 1168 B14R2.8239 O=C1NC2=C(C=C(C=C2)O)OC1=O MCULE-6314479325 [0,0,0,1,0,0|1,0,0]=2 1169 B14R2.8239 O=C1NC2=CC=C(C=C2C=C1O)Br MCULE-4554416713 [0,0,0,1,0,0|3,0,0]=4 1170 B14R2.8239 O=C1NC2=CC=C(C=C2OC1O)O MCULE-7005374282 [0,0,0,1,0,0|1,0,2]=4 1171 B14R2.8239 OC1=CC=C2C=C(C(=CC2=C1)O)Br MCULE-8379372381 [0,0,0,1,0,0|2,0,1]=4 1172 B12R1.20 C=C(C(=O)O)C1=CC=C(C=C1)Cl MCULE-9979377927 [0,0,0,0,1,0|2,0,0]=3 1173 B12R1.20 C=C(C)C(=O)C1=CC=C(C=C1)Br MCULE-9111640354 [0,0,0,0,1,0|3,0,0]=4 1174 B12R1.20 C=C(C)C(=O)C1=CC=C(C=C1)C MCULE-9692628502 [0,0,0,0,1,0|3,0,0]=4 1175 B12R1.20 C=C(C)C(=O)C1=CC=C(C=C1)Cl MCULE-7058377873 [0,0,0,0,1,0|3,0,0]=4 1176 B12R1.20 C=C(C)C(=O)C1=CC=C(C=C1)F MCULE-4141232987 [0,0,0,0,1,0|3,0,0]=4 1177 B12R1.20 C=C(C)C(=O)C1=CC=C(C=C1)O MCULE-5963404733 [0,0,0,0,1,0|2,0,0]=3 1178 B12R1.20 CC(=O)C(=O)C1=CC=C(C=C1)Br MCULE-5593899680 [0,0,0,0,1,0|2,0,0]=3 1179 B12R1.20 CC(=O)C(=O)C1=CC=C(C=C1)Cl MCULE-7569082761 [0,0,0,0,1,0|2,0,0]=3 1180 B12R1.20 CC(=O)C(=O)C1=CC=C(C=C1)F MCULE-4580328537 [0,0,0,0,1,0|2,0,0]=3 1181 B12R1.20 CC(=O)C(Br)C1=CC=C(C=C1)O MCULE-2034293234 [0,0,0,0,1,0|2,0,1]=4 1182 B12R1.20 CC(=O)N(C)C1=CC=C(C=C1)O MCULE-7471791665 [0,0,0,0,1,0|3,0,0]=4 1183 B12R1.20 CC(Br)C(=O)C1=CC=C(C=C1)O MCULE-6984411020 [0,0,0,0,1,0|2,0,1]=4 1184 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)Br MCULE-3856011157 [0,0,0,0,1,0|2,0,1]=4 1185 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)Cl MCULE-2769553332 [0,0,0,0,1,0|2,0,1]=4 1186 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)F MCULE-2156675573 [0,0,0,0,1,0|2,0,1]=4 1187 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)I MCULE-7770256839 [0,0,0,0,1,0|2,0,1]=4 1188 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)N MCULE-3310260159 [0,0,0,0,1,0|2,0,1]=4 1189 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)N MCULE-4466911405 [0,0,0,0,1,0|2,0,1]=4 1190 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)O MCULE-6886271028 [0,0,0,0,1,0|1,0,1]=3 1191 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)O MCULE-9438249577 [0,0,0,0,1,0|1,0,1]=3 1192 B12R1.20 CC(C)C(=O)C1=CC=C(C=C1)O MCULE-2351105700 [0,0,0,0,1,0|2,0,1]=4 1193 B12R1.20 CC1=CC=C(C=C1)C(=O)C(=O)O MCULE-3817789770 [0,0,0,0,1,0|1,0,0]=2 1194 B12R1.20 CC1=CC=C(C=C1)C(=O)C(C)O MCULE-9930176236 [0,0,0,0,1,0|2,0,1]=4 1195 B12R1.20 CC1=CC=C(C=C1)C(=O)C(O)O MCULE-7668157294 [0,0,0,0,1,0|1,0,2]=4 1196 B12R1.20 CC1=CC=C(C=C1)C(C)C(=O)O MCULE-3998271570 [0,0,0,0,1,0|2,0,1]=4 1197 B12R1.20 CC1=CC=C(C=C1)C(F)C(=O)O MCULE-2629016483 [0,0,0,0,1,0|2,0,1]=4 1198 B12R1.20 CC1=CC=C(C=C1)C(N)C(=O)O MCULE-1587277093 [0,0,0,0,1,0|2,0,1]=4 1199 B12R1.20 CC1=CC=C(C=C1)C(N)C(=O)O MCULE-3506021190 [0,0,0,0,1,0|2,0,1]=4 1200 B12R1.20 CC1=CC=C(C=C1)C(O)C(=O)O MCULE-4822757366 [0,0,0,0,1,0|1,0,2]=4 1201 B12R1.20 CC1=CC=C(C=C1)[C@@H](C)C(=O)O MCULE-8067162948 [0,0,0,0,1,0|2,0,1]=4 1202 B12R1.20 CC1=CC=C(C=C1)[C@@H](N)C(=O)O MCULE-4506752241 [0,0,0,0,1,0|2,0,1]=4 1203 B12R1.20 CC1=CC=C(C=C1)[C@@H](O)C(=O)O MCULE-3737866831 [0,0,0,0,1,0|1,0,2]=4 1204 B12R1.20 CC1=CC=C(C=C1)[C@@H](O)C(=O)O MCULE-7880826722 [0,0,0,0,1,0|1,0,2]=4 1205 B12R1.20 CC1=CC=C(C=C1)[C@H](C)C(=O)O MCULE-9094858000 [0,0,0,0,1,0|2,0,1]=4 1206 B12R1.20 CC1=CC=C(C=C1)[C@H](N)C(=O)O MCULE-3376830033 [0,0,0,0,1,0|2,0,1]=4 1207 B12R1.20 CC1=CC=C(C=C1)[C@H](N)C(=O)O MCULE-5116557466 [0,0,0,0,1,0|2,0,1]=4 1208 B12R1.20 CC1=CC=C(C=C1)[C@H](N)C(=O)O MCULE-6528465386 [0,0,0,0,1,0|2,0,1]=4 1209 B12R1.20 CC1=CC=C(C=C1)[C@H](N)C(=O)O MCULE-7928906966 [0,0,0,0,1,0|2,0,1]=4 1210 B12R1.20 CN(C(=O)N)C1=CC=C(C=C1)O MCULE-3938204998 [0,0,0,0,1,0|3,0,0]=4 1211 B12R1.20 CN(C)C(=O)C1=CC=C(C=C1)O MCULE-2332853069 [0,0,0,0,1,0|3,0,0]=4 1212 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-5166574874 [0,0,0,0,1,0|2,0,1]=4 1213 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-7554347918 [0,0,0,0,1,0|2,0,1]=4 1214 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(C=C1)F MCULE-1429593854 [0,0,0,0,1,0|2,0,1]=4 1215 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(C=C1)F MCULE-7919985541 [0,0,0,0,1,0|2,0,1]=4 1216 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(C=C1)O MCULE-4207098314 [0,0,0,0,1,0|1,0,1]=3 1217 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(C=C1)O MCULE-5888945014 [0,0,0,0,1,0|1,0,1]=3 1218 B12R1.20 C[C@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-5245847689 [0,0,0,0,1,0|2,0,1]=4 1219 B12R1.20 C[C@H](C(=O)O)C1=CC=C(C=C1)O MCULE-3937861865 [0,0,0,0,1,0|1,0,1]=3 1220 B12R1.20 NC(=O)C(=O)C1=CC=C(C=C1)Br MCULE-3279517761 [0,0,0,0,1,0|2,0,0]=3 1221 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)O MCULE-1782414943 [0,0,0,0,1,0|2,0,1]=4 1222 B12R1.20 NC(=O)[C@H](N)C1=CC=C(C=C1)O MCULE-1162353979 [0,0,0,0,1,0|2,0,1]=4 1223 B12R1.20 NC(=S)C(=O)C1=CC=C(C=C1)Br MCULE-4734381928 [0,0,0,0,1,0|2,1,0]=4 1224 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Br MCULE-4068820589 [0,0,0,0,1,0|2,0,1]=4 1225 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Br MCULE-4284243502 [0,0,0,0,1,0|2,0,1]=4 1226 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Cl MCULE-3056854629 [0,0,0,0,1,0|2,0,1]=4 1227 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Cl MCULE-4019160873 [0,0,0,0,1,0|2,0,1]=4 1228 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Cl MCULE-9766592325 [0,0,0,0,1,0|2,0,1]=4 1229 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)F MCULE-5503473156 [0,0,0,0,1,0|2,0,1]=4 1230 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)F MCULE-6541399593 [0,0,0,0,1,0|2,0,1]=4 1231 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)F MCULE-8780261595 [0,0,0,0,1,0|2,0,1]=4 1232 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)I MCULE-7335173971 [0,0,0,0,1,0|2,0,1]=4 1233 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)O MCULE-3401679688 [0,0,0,0,1,0|1,0,1]=3 1234 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)O MCULE-5835109660 [0,0,0,0,1,0|1,0,1]=3 1235 B12R1.20 NC1=CC=C(C=C1)C(N)C(=O)O MCULE-2950897906 [0,0,0,0,1,0|2,0,1]=4 1236 B12R1.20 NC1=CC=C(C=C1)C(N)C(=O)O MCULE-3993003300 [0,0,0,0,1,0|2,0,1]=4 1237 B12R1.20 NC1=CC=C(C=C1)C(O)C(=O)O MCULE-3485303182 [0,0,0,0,1,0|1,0,2]=4 1238 B12R1.20 NC1=CC=C(C=C1)[C@@H](N)C(=O)O MCULE-5248016997 [0,0,0,0,1,0|2,0,1]=4 1239 B12R1.20 NC1=CC=C(C=C1)[C@@H](N)C(=O)O MCULE-5710978804 [0,0,0,0,1,0|2,0,1]=4 1240 B12R1.20 NC1=CC=C(C=C1)[C@@H](N)C(=O)O MCULE-7216555315 [0,0,0,0,1,0|2,0,1]=4 1241 B12R1.20 NC1=CC=C(C=C1)[C@@H](N)C(=O)O MCULE-9432239375 [0,0,0,0,1,0|2,0,1]=4 1242 B12R1.20 NC1=CC=C(C=C1)[C@@H](O)C(=O)O MCULE-8807693274 [0,0,0,0,1,0|1,0,2]=4 1243 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-1841593478 [0,0,0,0,1,0|2,0,1]=4 1244 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-3449066230 [0,0,0,0,1,0|2,0,1]=4 1245 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-5518874265 [0,0,0,0,1,0|2,0,1]=4 1246 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-7725592732 [0,0,0,0,1,0|2,0,1]=4 1247 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)Cl MCULE-3811128026 [0,0,0,0,1,0|2,0,1]=4 1248 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)Cl MCULE-4244546160 [0,0,0,0,1,0|2,0,1]=4 1249 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)Cl MCULE-6404239502 [0,0,0,0,1,0|2,0,1]=4 1250 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)Cl MCULE-6945755808 [0,0,0,0,1,0|2,0,1]=4 1251 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)F MCULE-1941413906 [0,0,0,0,1,0|2,0,1]=4 1252 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)F MCULE-6586219982 [0,0,0,0,1,0|2,0,1]=4 1253 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)F MCULE-7464615223 [0,0,0,0,1,0|2,0,1]=4 1254 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)F MCULE-7795254631 [0,0,0,0,1,0|2,0,1]=4 1255 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)I MCULE-2074138900 [0,0,0,0,1,0|2,0,1]=4 1256 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)O MCULE-3842441492 [0,0,0,0,1,0|1,0,1]=3 1257 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)O MCULE-7930915902 [0,0,0,0,1,0|1,0,1]=3 1258 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-2463683867 [0,0,0,0,1,0|2,0,1]=4 1259 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-4008918455 [0,0,0,0,1,0|2,0,1]=4 1260 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-4037080447 [0,0,0,0,1,0|2,0,1]=4 1261 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)Br MCULE-6684337430 [0,0,0,0,1,0|2,0,1]=4 1262 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)Cl MCULE-2822483467 [0,0,0,0,1,0|2,0,1]=4 1263 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)Cl MCULE-5986270862 [0,0,0,0,1,0|2,0,1]=4 1264 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)F MCULE-1999690769 [0,0,0,0,1,0|2,0,1]=4 1265 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)F MCULE-2503602546 [0,0,0,0,1,0|2,0,1]=4 1266 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)F MCULE-4023441343 [0,0,0,0,1,0|2,0,1]=4 1267 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)F MCULE-4787106343 [0,0,0,0,1,0|2,0,1]=4 1268 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)O MCULE-3619505381 [0,0,0,0,1,0|1,0,1]=3 1269 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)O MCULE-5839165135 [0,0,0,0,1,0|1,0,1]=3 1270 B12R1.20 O=C(C1=CC=C(C=C1)Br)C(O)O MCULE-7234242245 [0,0,0,0,1,0|1,0,2]=4 1271 B12R1.20 O=C(C1=CC=C(C=C1)F)C(O)O MCULE-7259362235 [0,0,0,0,1,0|1,0,2]=4 1272 B12R1.20 O=C(C1=CC=C(C=C1)O)C(O)O MCULE-7006431700 [0,0,0,0,1,0|0,0,2]=3 1273 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)Br MCULE-9463589270 [0,0,0,0,1,0|1,0,0]=2 1274 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)Cl MCULE-1231250867 [0,0,0,0,1,0|1,0,0]=2 1275 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)F MCULE-3191036747 [0,0,0,0,1,0|1,0,0]=2 1276 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)O MCULE-6708689901 [0,0,0,0,1,0|0,0,0]=1 1277 B12R1.20 O=C(O)C(Br)C1=CC=C(C=C1)Cl MCULE-8324791611 [0,0,0,0,1,0|2,0,1]=4 1278 B12R1.20 O=C(O)C(Br)C1=CC=C(C=C1)F MCULE-1001343874 [0,0,0,0,1,0|2,0,1]=4 1279 B12R1.20 O=C(O)C(Cl)C1=CC=C(C=C1)Cl MCULE-1960477145 [0,0,0,0,1,0|2,0,1]=4 1280 B12R1.20 O=C(O)C(F)C1=CC=C(C=C1)Br MCULE-8921014439 [0,0,0,0,1,0|2,0,1]=4 1281 B12R1.20 O=C(O)C(F)C1=CC=C(C=C1)Cl MCULE-7083049660 [0,0,0,0,1,0|2,0,1]=4 1282 B12R1.20 O=C(O)C(F)C1=CC=C(C=C1)F MCULE-5455404268 [0,0,0,0,1,0|2,0,1]=4 1283 B12R1.20 O=C(O)C(O)C1=CC=C(C=C1)Br MCULE-6560372222 [0,0,0,0,1,0|1,0,2]=4 1284 B12R1.20 O=C(O)C(O)C1=CC=C(C=C1)Cl MCULE-1787123081 [0,0,0,0,1,0|1,0,2]=4 1285 B12R1.20 O=C(O)C(O)C1=CC=C(C=C1)Cl MCULE-8938500812 [0,0,0,0,1,0|1,0,2]=4 1286 B12R1.20 O=C(O)C(O)C1=CC=C(C=C1)F MCULE-8562671113 [0,0,0,0,1,0|1,0,2]=4 1287 B12R1.20 O=C(O)C(O)C1=CC=C(C=C1)O MCULE-4331565630 [0,0,0,0,1,0|0,0,2]=3 1288 B12R1.20 O=C(O)[C@@H](O)C1=CC=C(C=C1)Br MCULE-3898515959 [0,0,0,0,1,0|1,0,2]=4 1289 B12R1.20 O=C(O)[C@@H](O)C1=CC=C(C=C1)Br MCULE-8468373165 [0,0,0,0,1,0|1,0,2]=4 1290 B12R1.20 O=C(O)[C@@H](O)C1=CC=C(C=C1)Cl MCULE-2017991060 [0,0,0,0,1,0|1,0,2]=4 1291 B12R1.20 O=C(O)[C@@H](O)C1=CC=C(C=C1)Cl MCULE-8113669937 [0,0,0,0,1,0|1,0,2]=4 1292 B12R1.20 O=C(O)[C@@H](O)C1=CC=C(C=C1)F MCULE-7253640949 [0,0,0,0,1,0|1,0,2]=4 1293 B12R1.20 O=C(O)[C@@H](O)C1=CC=C(C=C1)F MCULE-7875959296 [0,0,0,0,1,0|1,0,2]=4 1294 B12R1.20 O=C(O)[C@@H](O)C1=CC=C(C=C1)O MCULE-3531357053 [0,0,0,0,1,0|0,0,2]=3 1295 B12R1.20 O=C(O)[C@@H](O)C1=CC=C(C=C1)O MCULE-9803313467 [0,0,0,0,1,0|0,0,2]=3 1296 B12R1.20 O=C(O)[C@H](O)C1=CC=C(C=C1)Br MCULE-5848880566 [0,0,0,0,1,0|1,0,2]=4 1297 B12R1.20 O=C(O)[C@H](O)C1=CC=C(C=C1)Br MCULE-6800801358 [0,0,0,0,1,0|1,0,2]=4 1298 B12R1.20 O=C(O)[C@H](O)C1=CC=C(C=C1)Cl MCULE-2645498390 [0,0,0,0,1,0|1,0,2]=4 1299 B12R1.20 O=C(O)[C@H](O)C1=CC=C(C=C1)Cl MCULE-2778556406 [0,0,0,0,1,0|1,0,2]=4 1300 B12R1.20 O=C(O)[C@H](O)C1=CC=C(C=C1)F MCULE-3500055666 [0,0,0,0,1,0|1,0,2]=4 1301 B12R1.20 O=C(O)[C@H](O)C1=CC=C(C=C1)F MCULE-9723473790 [0,0,0,0,1,0|1,0,2]=4 1302 B12R1.20 O=C(O)[C@H](O)C1=CC=C(C=C1)O MCULE-2873155115 [0,0,0,0,1,0|0,0,2]=3 1303 B12R1.20 O=C(O)[C@H](O)C1=CC=C(C=C1)O MCULE-6216776706 [0,0,0,0,1,0|0,0,2]=3 1304 B12R1.20 O=C([O-])C(=O)C1=CC=C(C=C1)O MCULE-1772728289 [0,0,0,0,1,0|0,0,1]=2 1305 B12R1.20 O=C([O-])C(O)C1=CC=C(C=C1)O MCULE-7699468372 [0,0,0,0,1,0|0,0,3]=4 1306 B12R1.20 [C@@H](C)(C(=O)O)C1=CC=C(C=C1)F MCULE-6240848266 [0,0,0,0,1,0|2,0,1]=4 1307 B12R1.20 [C@H](C)(C(=O)O)C1=CC=C(C=C1)C MCULE-7422640666 [0,0,0,0,1,0|2,0,1]=4 1308 B12R1.104 O=C(O)C(=O)CC1=CC(=CS1)Br MCULE-6736689318 [0,0,0,0,1,0|2,0,0]=3 1309 B14R1.679 CC(CCC1=CC=C(C=C1)F)C(=O)O MCULE-7601347469 [0,0,0,0,0,1|2,0,1]=4 1310 B14R1.679 CC(CSC1=CC=C(C=C1)Cl)C(=O)O MCULE-3112521304 [0,0,0,0,0,1|2,0,1]=4 1311 B14R1.679 CC(CSC1=CC=C(C=C1)F)C(=O)O MCULE-2133274606 [0,0,0,0,0,1|2,0,1]=4 1312 B14R1.679 CC(NCC1=CC=C(C=C1)Br)C(=O)O MCULE-2384168801 [0,0,0,0,0,1|2,0,1]=4 1313 B14R1.679 CC(NCC1=CC=C(C=C1)Br)C(=O)O MCULE-8448967366 [0,0,0,0,0,1|2,0,1]=4 1314 B14R1.679 CC(NCC1=CC=C(C=C1)Cl)C(=O)O MCULE-7840473961 [0,0,0,0,0,1|2,0,1]=4 1315 B14R1.679 CC(NCC1=CC=C(C=C1)Cl)C(=O)O MCULE-8055402228 [0,0,0,0,0,1|2,0,1]=4 1316 B14R1.679 CC(NCC1=CC=C(C=C1)F)C(=O)O MCULE-4397654115 [0,0,0,0,0,1|2,0,1]=4 1317 B14R1.679 CC(OCC1=CC=C(C=C1)F)C(=O)O MCULE-9307795119 [0,0,0,0,0,1|2,0,1]=4 1318 B14R1.679 CC(SCC1=CC=C(C=C1)Cl)C(=O)O MCULE-5546707192 [0,0,0,0,0,1|2,0,1]=4 1319 B14R1.679 CC(SCC1=CC=C(C=C1)F)C(=O)O MCULE-2671725709 [0,0,0,0,0,1|2,0,1]=4 1320 B14R1.679 CC1=CC=C(C=C1)CCC(N)C(=O)O MCULE-7593182446 [0,0,0,0,0,1|2,0,1]=4 1321 B14R1.679 CC1=CC=C(C=C1)CC[C@@H](N)C(=O)O MCULE-7553433191 [0,0,0,0,0,1|2,0,1]=4 1322 B14R1.679 CC1=CC=C(C=C1)CC[C@H](N)C(=O)O MCULE-2577430347 [0,0,0,0,0,1|2,0,1]=4 1323 B14R1.679 CC1=CC=C(C=C1)CC[C@H](N)C(=O)O MCULE-9957009794 [0,0,0,0,0,1|2,0,1]=4 1324 B14R1.679 CC1=CC=C(C=C1)CNC(C)C(=O)O MCULE-5506818457 [0,0,0,0,0,1|2,0,1]=4 1325 B14R1.679 CC1=CC=C(C=C1)CNC(C)C(=O)O MCULE-6661778351 [0,0,0,0,0,1|2,0,1]=4 1326 B14R1.679 CC1=CC=C(C=C1)COC(C)C(=O)O MCULE-8717484967 [0,0,0,0,0,1|2,0,1]=4 1327 B14R1.679 CC1=CC=C(C=C1)CSC(C)C(=O)O MCULE-8260964496 [0,0,0,0,0,1|2,0,1]=4 1328 B14R1.679 C[C@H](NCC1=CC=C(C=C1)Cl)C(=O)O MCULE-7323499288 [0,0,0,0,0,1|2,0,1]=4 1329 B14R1.679 NC(CCC1=CC=C(C=C1)Br)C(=O)O MCULE-5822068495 [0,0,0,0,0,1|2,0,1]=4 1330 B14R1.679 NC(CCC1=CC=C(C=C1)Cl)C(=O)O MCULE-3171400958 [0,0,0,0,0,1|2,0,1]=4 1331 B14R1.679 NC(CCC1=CC=C(C=C1)F)C(=O)O MCULE-2338285469 [0,0,0,0,0,1|2,0,1]=4 1332 B14R1.679 NC(CCC1=CC=C(C=C1)O)C(=O)O MCULE-6451884872 [0,0,0,0,0,1|1,0,1]=3 1333 B14R1.679 NC(CCC1=CC=C(C=C1)O)C(=O)O MCULE-9678967324 [0,0,0,0,0,1|1,0,1]=3 1334 B14R1.679 NC1=CC=C(C=C1)SCC(N)C(=O)O MCULE-2391910456 [0,0,0,0,0,1|2,0,1]=4 1335 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)Br)C(=O)O MCULE-9265991531 [0,0,0,0,0,1|2,0,1]=4 1336 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)Br)C(=O)O MCULE-9859600565 [0,0,0,0,0,1|2,0,1]=4 1337 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)Cl)C(=O)O MCULE-6279196888 [0,0,0,0,0,1|2,0,1]=4 1338 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)Cl)C(=O)O MCULE-9257393922 [0,0,0,0,0,1|2,0,1]=4 1339 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)F)C(=O)O MCULE-7504967309 [0,0,0,0,0,1|2,0,1]=4 1340 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)F)C(=O)O MCULE-7706306422 [0,0,0,0,0,1|2,0,1]=4 1341 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)O)C(=O)O MCULE-2626477375 [0,0,0,0,0,1|1,0,1]=3 1342 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)O)C(=O)O MCULE-3675336952 [0,0,0,0,0,1|1,0,1]=3 1343 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)O)C(=O)O MCULE-5741036033 [0,0,0,0,0,1|1,0,1]=3 1344 B14R1.679 N[C@@H](CCC1=CC=C(C=C1)O)C(=O)O MCULE-8049928811 [0,0,0,0,0,1|1,0,1]=3 1345 B14R1.679 N[C@H](CCC1=CC=C(C=C1)F)C(=O)O MCULE-2837159214 [0,0,0,0,0,1|2,0,1]=4 1346 B14R1.679 N[C@H](CCC1=CC=C(C=C1)F)C(=O)O MCULE-3930641365 [0,0,0,0,0,1|2,0,1]=4 1347 B14R1.679 N[C@H](CCC1=CC=C(C=C1)O)C(=O)O MCULE-1730710037 [0,0,0,0,0,1|1,0,1]=3 1348 B14R1.679 N[C@H](CCC1=CC=C(C=C1)O)C(=O)O MCULE-3217987468 [0,0,0,0,0,1|1,0,1]=3 1349 B14R1.679 N[C@H](CCC1=CC=C(C=C1)O)C(=O)O MCULE-5615474996 [0,0,0,0,0,1|1,0,1]=3 1350 B14R1.679 N[C@H](CCC1=CC=C(C=C1)O)C(=O)O MCULE-6439403951 [0,0,0,0,0,1|1,0,1]=3 1351 B14R1.679 O=C(O)C(=O)C=CC1=CC=C(C=C1)Br MCULE-3334163583 [0,0,0,0,0,1|1,0,1]=3 1352 B14R1.679 O=C(O)C(=O)C=CC1=CC=C(C=C1)Cl MCULE-6050164295 [0,0,0,0,0,1|1,0,1]=3 1353 B14R1.679 O=C(O)C(=O)NCC1=CC=C(C=C1)F MCULE-1132731064 [0,0,0,0,0,1|1,0,0]=2 1354 B14R1.698 CC(=O)C=C(C)NC1=CC=C(C=C1)O MCULE-4806097711 [0,0,0,0,0,1|3,0,0]=4 1355 B14R1.698 CC(=O)CC(=O)NC1=CC=C(C=C1)Br MCULE-4024081227 [0,0,0,0,0,1|3,0,0]=4 1356 B14R1.698 CC(=O)CC(=O)NC1=CC=C(C=C1)C MCULE-7843454957 [0,0,0,0,0,1|3,0,0]=4 1357 B14R1.698 CC(=O)CC(=O)NC1=CC=C(C=C1)Cl MCULE-9063575616 [0,0,0,0,0,1|3,0,0]=4 1358 B14R1.698 CC(=O)CC(=O)NC1=CC=C(C=C1)F MCULE-5013705602 [0,0,0,0,0,1|3,0,0]=4 1359 B14R1.698 CC(=O)CC(=O)NC1=CC=C(C=C1)I MCULE-8571991325 [0,0,0,0,0,1|3,0,0]=4 1360 B14R1.698 CC(=O)NC(C)CC1=CC=C(C=C1)O MCULE-2890211848 [0,0,0,0,0,1|2,0,1]=4 1361 B14R1.698 CC(CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-9529138287 [0,0,0,0,0,1|2,0,1]=4 1362 B14R1.698 CC1=CC=C(C=C1)CC(=O)CC(=O)Cl MCULE-1815927553 [0,0,0,0,0,1|2,0,0]=3 1363 B14R1.698 CC1=CC=C(C=C1)CC(=O)CC(=O)O MCULE-8624469597 [0,0,0,0,0,1|1,0,0]=2 1364 B14R1.698 CC1=CC=C(C=C1)CC(N)CC(=O)O MCULE-6353710442 [0,0,0,0,0,1|2,0,1]=4 1365 B14R1.698 CC1=CC=C(C=C1)CC(N)CC(=O)O MCULE-9504398730 [0,0,0,0,0,1|2,0,1]=4 1366 B14R1.698 CC1=CC=C(C=C1)CN(C)CC(=O)O MCULE-4250763131 [0,0,0,0,0,1|3,0,0]=4 1367 B14R1.698 CC1=CC=C(C=C1)CN(C)CC(=O)O MCULE-8499867866 [0,0,0,0,0,1|3,0,0]=4 1368 B14R1.698 CC1=CC=C(C=C1)C[C@@H](N)CC(=O)O MCULE-1265682222 [0,0,0,0,0,1|2,0,1]=4 1369 B14R1.698 CC1=CC=C(C=C1)C[C@@H](N)CC(=O)O MCULE-2802558766 [0,0,0,0,0,1|2,0,1]=4 1370 B14R1.698 CC1=CC=C(C=C1)C[C@@H](N)CC(=O)O MCULE-6445530808 [0,0,0,0,0,1|2,0,1]=4 1371 B14R1.698 CC1=CC=C(C=C1)C[C@@H](N)CC(=O)O MCULE-6976449659 [0,0,0,0,0,1|2,0,1]=4 1372 B14R1.698 CC1=CC=C(C=C1)C[C@H](N)CC(=O)O MCULE-3158215549 [0,0,0,0,0,1|2,0,1]=4 1373 B14R1.698 CC1=CC=C(C=C1)C[C@H](N)CC(=O)O MCULE-3271897565 [0,0,0,0,0,1|2,0,1]=4 1374 B14R1.698 CC1=CC=C(C=C1)C[C@H](N)CC(=O)O MCULE-3358498761 [0,0,0,0,0,1|2,0,1]=4 1375 B14R1.698 CC1=CC=C(C=C1)C[C@H](N)CC(=O)O MCULE-5208172708 [0,0,0,0,0,1|2,0,1]=4 1376 B14R1.698 CC1=CC=C(C=C1)NC(=O)CC(=O)O MCULE-3853963836 [0,0,0,0,0,1|2,0,0]=3 1377 B14R1.698 CN(CC(=O)O)CC1=CC=C(C=C1)Br MCULE-3604092040 [0,0,0,0,0,1|3,0,0]=4 1378 B14R1.698 CN(CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-9469432220 [0,0,0,0,0,1|3,0,0]=4 1379 B14R1.698 CN(CC(=O)O)CC1=CC=C(C=C1)F MCULE-1797270627 [0,0,0,0,0,1|3,0,0]=4 1380 B14R1.698 CN(CC(=O)O)CC1=CC=C(C=C1)F MCULE-8562834841 [0,0,0,0,0,1|3,0,0]=4 1381 B14R1.698 N=C(N)NC(=O)CC1=CC=C(C=C1)Cl MCULE-2251267969 [0,0,0,0,0,1|3,0,0]=4 1382 B14R1.698 NC(=O)NC(=O)NC1=CC=C(C=C1)Cl MCULE-3358051366 [0,0,0,0,0,1|3,0,0]=4 1383 B14R1.698 NC(=O)NC(=O)NC1=CC=C(C=C1)I MCULE-7530018917 [0,0,0,0,0,1|3,0,0]=4 1384 B14R1.698 NC(CC(=O)O)CC1=CC=C(C=C1)Br MCULE-1974214582 [0,0,0,0,0,1|2,0,1]=4 1385 B14R1.698 NC(CC(=O)O)CC1=CC=C(C=C1)Br MCULE-9984331080 [0,0,0,0,0,1|2,0,1]=4 1386 B14R1.698 NC(CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-1228143086 [0,0,0,0,0,1|2,0,1]=4 1387 B14R1.698 NC(CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-3935388999 [0,0,0,0,0,1|2,0,1]=4 1388 B14R1.698 NC(CC(=O)O)CC1=CC=C(C=C1)F MCULE-3423605097 [0,0,0,0,0,1|2,0,1]=4 1389 B14R1.698 NC(CC(=O)O)CC1=CC=C(C=C1)F MCULE-5859176812 [0,0,0,0,0,1|2,0,1]=4 1390 B14R1.698 NC(CC(=O)O)CC1=CC=C(C=C1)I MCULE-3591042703 [0,0,0,0,0,1|2,0,1]=4 1391 B14R1.698 NC(CC(=O)O)CC1=CC=C(C=C1)I MCULE-5049438759 [0,0,0,0,0,1|2,0,1]=4 1392 B14R1.698 NC(CC(=O)O)CC1=CC=C(C=C1)O MCULE-4129702473 [0,0,0,0,0,1|1,0,1]=3 1393 B14R1.698 NC(CC(=O)O)CC1=CC=C(C=C1)O MCULE-7647363388 [0,0,0,0,0,1|1,0,1]=3 1394 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)Br MCULE-4945653014 [0,0,0,0,0,1|2,0,1]=4 1395 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)Br MCULE-5453470367 [0,0,0,0,0,1|2,0,1]=4 1396 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)Br MCULE-7920013203 [0,0,0,0,0,1|2,0,1]=4 1397 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)Br MCULE-9322823350 [0,0,0,0,0,1|2,0,1]=4 1398 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-1983299574 [0,0,0,0,0,1|2,0,1]=4 1399 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-3332084066 [0,0,0,0,0,1|2,0,1]=4 1400 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-5183250192 [0,0,0,0,0,1|2,0,1]=4 1401 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-8706330527 [0,0,0,0,0,1|2,0,1]=4 1402 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)F MCULE-2957364999 [0,0,0,0,0,1|2,0,1]=4 1403 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)F MCULE-3763118774 [0,0,0,0,0,1|2,0,1]=4 1404 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)F MCULE-3973372859 [0,0,0,0,0,1|2,0,1]=4 1405 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)F MCULE-6337039742 [0,0,0,0,0,1|2,0,1]=4 1406 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)I MCULE-1176602478 [0,0,0,0,0,1|2,0,1]=4 1407 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)I MCULE-3352593168 [0,0,0,0,0,1|2,0,1]=4 1408 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)I MCULE-7598774388 [0,0,0,0,0,1|2,0,1]=4 1409 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(C=C1)I MCULE-9899950488 [0,0,0,0,0,1|2,0,1]=4 1410 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)Br MCULE-2748291502 [0,0,0,0,0,1|2,0,1]=4 1411 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)Br MCULE-4447023550 [0,0,0,0,0,1|2,0,1]=4 1412 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)Br MCULE-5867611218 [0,0,0,0,0,1|2,0,1]=4 1413 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)Br MCULE-9536655725 [0,0,0,0,0,1|2,0,1]=4 1414 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-2582093229 [0,0,0,0,0,1|2,0,1]=4 1415 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-3433994818 [0,0,0,0,0,1|2,0,1]=4 1416 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-7136667972 [0,0,0,0,0,1|2,0,1]=4 1417 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)Cl MCULE-8484541043 [0,0,0,0,0,1|2,0,1]=4 1418 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)F MCULE-1175787305 [0,0,0,0,0,1|2,0,1]=4 1419 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)F MCULE-3064488499 [0,0,0,0,0,1|2,0,1]=4 1420 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)F MCULE-4826661458 [0,0,0,0,0,1|2,0,1]=4 1421 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)F MCULE-5537812689 [0,0,0,0,0,1|2,0,1]=4 1422 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)I MCULE-2263852417 [0,0,0,0,0,1|2,0,1]=4 1423 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)I MCULE-3574988594 [0,0,0,0,0,1|2,0,1]=4 1424 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)I MCULE-4802649525 [0,0,0,0,0,1|2,0,1]=4 1425 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)I MCULE-6577170232 [0,0,0,0,0,1|2,0,1]=4 1426 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)O MCULE-6164100507 [0,0,0,0,0,1|1,0,1]=3 1427 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)O MCULE-7138328950 [0,0,0,0,0,1|1,0,1]=3 1428 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)O MCULE-7211522132 [0,0,0,0,0,1|1,0,1]=3 1429 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(C=C1)O MCULE-8499920438 [0,0,0,0,0,1|1,0,1]=3 1430 B14R1.698 O=C(Cl)CC(=O)CC1=CC=C(C=C1)Cl MCULE-8640743692 [0,0,0,0,0,1|2,0,0]=3 1431 B14R1.698 O=C(Cl)CC(=O)CC1=CC=C(C=C1)F MCULE-7923051834 [0,0,0,0,0,1|2,0,0]=3 1432 B14R1.698 O=C(O)CC(=O)CC1=CC=C(C=C1)Cl MCULE-9912857653 [0,0,0,0,0,1|1,0,0]=2 1433 B14R1.698 O=C(O)CC(=O)CC1=CC=C(C=C1)F MCULE-9649309247 [0,0,0,0,0,1|1,0,0]=2 1434 B14R1.698 O=C(O)CC(=O)NC1=CC=C(C=C1)Br MCULE-6792198523 [0,0,0,0,0,1|2,0,0]=3 1435 B14R1.698 O=C(O)CC(=O)NC1=CC=C(C=C1)Cl MCULE-2661843013 [0,0,0,0,0,1|2,0,0]=3 1436 B14R1.698 O=C(O)CC(=O)NC1=CC=C(C=C1)F MCULE-2071362837 [0,0,0,0,0,1|2,0,0]=3 1437 B14R1.698 O=C(O)CC(=O)NC1=CC=C(C=C1)O MCULE-3903375021 [0,0,0,0,0,1|1,0,0]=2 1438 B14R1.698 O=C(O)CC(=O)OC1=CC=C(C=C1)Cl MCULE-6701789757 [0,0,0,0,0,1|2,0,0]=3 1439 B14R1.698 O=C(O)CC(=O)OC1=CC=C(C=C1)F MCULE-6337240419 [0,0,0,0,0,1|2,0,0]=3 1440 B14R1.698 O=C(O)CS(=O)CC1=CC=C(C=C1)Br MCULE-1528193590 [0,0,0,0,0,1|2,0,0]=3 1441 B11R1.1 C=CCCC1=CC=C(C=C1)O MCULE-9683414474 [2,0,0,0,0,0|1,0,1]=4 1442 B11R1.1 CC1=CC=C(C=C1)/C=C/C=O MCULE-9437312205 [2,0,0,0,0,0|1,0,1]=4 1443 B11R1.1 CC1=CC=C(C=C1)C=CC=O MCULE-1811976125 [2,0,0,0,0,0|1,0,1]=4 1444 B11R1.1 CC1=CC=C(C=C1)CCC=O MCULE-5011003207 [2,0,0,0,0,0|1,0,1]=4 1445 B11R1.1 CC1=CC=C(C=C1)CNC=O MCULE-5057658878 [2,0,0,0,0,0|2,0,0]=4 1446 B11R1.1 O=C/C=C/C1=CC=C(C=C1)Br MCULE-3938754463 [2,0,0,0,0,0|1,0,1]=4 1447 B11R1.1 O=C/C=C/C1=CC=C(C=C1)Cl MCULE-6118487478 [2,0,0,0,0,0|1,0,1]=4 1448 B11R1.1 O=C/C=C/C1=CC=C(C=C1)F MCULE-3157524927 [2,0,0,0,0,0|1,0,1]=4 1449 B11R1.1 O=C/C=C/C1=CC=C(C=C1)O MCULE-1154888936 [2,0,0,0,0,0|0,0,1]=3 1450 B11R1.1 O=CC=CC1=CC=C(C=C1)Br MCULE-1314515743 [2,0,0,0,0,0|1,0,1]=4 1451 B11R1.1 O=CC=CC1=CC=C(C=C1)Cl MCULE-5649727633 [2,0,0,0,0,0|1,0,1]=4 1452 B11R1.1 O=CC=CC1=CC=C(C=C1)F MCULE-2286039273 [2,0,0,0,0,0|1,0,1]=4 1453 B11R1.1 O=CC=CC1=CC=C(C=C1)O MCULE-9429867074 [2,0,0,0,0,0|0,0,1]=3 1454 B11R1.1 O=CCCC1=CC=C(C=C1)Br MCULE-9739267093 [2,0,0,0,0,0|1,0,1]=4 1455 B11R1.1 O=CCCC1=CC=C(C=C1)Cl MCULE-7319845020 [2,0,0,0,0,0|1,0,1]=4 1456 B11R1.1 O=CCCC1=CC=C(C=C1)F MCULE-2589381526 [2,0,0,0,0,0|1,0,1]=4 1457 B11R1.1 O=CCCC1=CC=C(C=C1)O MCULE-4314800576 [2,0,0,0,0,0|0,0,1]=3 1458 B11R1.1 O=CNCC1=CC=C(C=C1)Cl MCULE-8442988317 [2,0,0,0,0,0|2,0,0]=4 1459 B11R1.1 OC/C=C/C1=CC=C(C=C1)O MCULE-3386674818 [2,0,0,0,0,0|0,0,2]=4 1460 B11R1.1 OCC=CC1=CC=C(C=C1)O MCULE-4548331432 [2,0,0,0,0,0|0,0,2]=4 1461 B11R1.1 OCCCC1=CC=C(C=C1)O MCULE-4368750678 [2,0,0,0,0,0|0,0,2]=4 1462 B11R1.91 C(=CC1=CC=CC=C1)C(=O)[O-] MCULE-4187228018 [2,0,0,0,0,0|0,0,2]=4 1463 B11R1.91 CC(=CCC1=CC=CC=C1)C MCULE-6894689571 [2,0,0,0,0,0|2,0,0]=4 1464 B11R1.91 CC(=O)/C=C/C1=CC=CC=C1 MCULE-4879858540 [2,0,0,0,0,0|1,0,1]=4 1465 B11R1.91 CC(=O)C=CC1=CC=CC=C1 MCULE-5202944660 [2,0,0,0,0,0|1,0,1]=4 1466 B11R1.91 CC(=O)CCC1=CC=CC=C1 MCULE-1136231603 [2,0,0,0,0,0|1,0,1]=4 1467 B11R1.91 CC(=O)NCC1=CC=CC=C1 MCULE-2051924381 [2,0,0,0,0,0|2,0,0]=4 1468 B11R1.91 CC(=O)OCC1=CC=CC=C1 MCULE-7952998506 [2,0,0,0,0,0|2,0,0]=4 1469 B11R1.91 NC(=O)/C=C/C1=CC=CC=C1 MCULE-1428301205 [2,0,0,0,0,0|1,0,1]=4 1470 B11R1.91 NC(=O)C=CC1=CC=CC=C1 MCULE-9669016303 [2,0,0,0,0,0|1,0,1]=4 1471 B11R1.91 NC(=O)CCC1=CC=CC=C1 MCULE-3588566414 [2,0,0,0,0,0|1,0,1]=4 1472 B11R1.91 NC(=O)NCC1=CC=CC=C1 MCULE-8856820054 [2,0,0,0,0,0|2,0,0]=4 1473 B11R1.91 NC(=O)OCC1=CC=CC=C1 MCULE-8357463584 [2,0,0,0,0,0|2,0,0]=4 1474 B11R1.91 O=C(Cl)/C=C/C1=CC=CC=C1 MCULE-4421630248 [2,0,0,0,0,0|1,0,1]=4 1475 B11R1.91 O=C(Cl)C=CC1=CC=CC=C1 MCULE-8583623904 [2,0,0,0,0,0|1,0,1]=4 1476 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 MCULE-2895233000 [2,0,0,0,0,0|1,0,1]=4 1477 B11R1.91 O=C(Cl)OCC1=CC=CC=C1 MCULE-3541425724 [2,0,0,0,0,0|2,0,0]=4 1478 B11R1.91 O=C(O)/C=C/C1=CC=CC=C1 MCULE-1077406303 [2,0,0,0,0,0|0,0,1]=3 1479 B11R1.91 O=C(O)/C=C/C1=CC=NC=C1 MCULE-7372485168 [2,0,0,0,0,0|1,0,1]=4 1480 B11R1.91 O=C(O)/C=C/C1=CN=CC=C1 MCULE-7325423443 [2,0,0,0,0,0|1,0,1]=4 1481 B11R1.91 O=C(O)/C=C/C1=NC=CC=C1 MCULE-3136346884 [2,0,0,0,0,0|1,0,1]=4 1482 B11R1.91 O=C(O)C#CC1=CC=CC=C1 MCULE-1724525388 [2,0,0,0,0,0|0,0,2]=4 1483 B11R1.91 O=C(O)C=CC1=CC=CC=C1 MCULE-4051659199 [2,0,0,0,0,0|0,0,1]=3 1484 B11R1.91 O=C(O)C=CC1=CC=NC=C1 MCULE-1159332612 [2,0,0,0,0,0|1,0,1]=4 1485 B11R1.91 O=C(O)C=CC1=CN=CC=C1 MCULE-8996562963 [2,0,0,0,0,0|1,0,1]=4 1486 B11R1.91 O=C(O)C=CC1=NC=CC=C1 MCULE-8328935452 [2,0,0,0,0,0|1,0,1]=4 1487 B11R1.91 O=C(O)C=C[N+]1=CC=CC=C1 MCULE-1063030896 [2,0,0,0,0,0|1,0,1]=4 1488 B11R1.91 O=C(O)C=C[N+]1=CC=CC=C1 MCULE-9365726596 [2,0,0,0,0,0|1,0,1]=4 1489 B11R1.91 O=C(O)CCC1=CC=CC=C1 MCULE-1670073750 [2,0,0,0,0,0|0,0,1]=3 1490 B11R1.91 O=C(O)CCC1=CC=CC=N1 MCULE-7798422459 [2,0,0,0,0,0|1,0,1]=4 1491 B11R1.91 O=C(O)CCC1=CC=NC=C1 MCULE-4931237552 [2,0,0,0,0,0|1,0,1]=4 1492 B11R1.91 O=C(O)CCC1=CN=CC=C1 MCULE-9809125467 [2,0,0,0,0,0|1,0,1]=4 1493 B11R1.91 O=C(O)CCC1=NC=CC=C1 MCULE-3850875705 [2,0,0,0,0,0|1,0,1]=4 1494 B11R1.91 O=C(O)CCC1=NC=CC=C1 MCULE-7947562908 [2,0,0,0,0,0|1,0,1]=4 1495 B11R1.91 O=C(O)CNC1=CC=CC=C1 MCULE-4813130378 [2,0,0,0,0,0|1,0,1]=4 1496 B11R1.91 O=C(O)COC1=CC=CC=C1 MCULE-5625991303 [2,0,0,0,0,0|1,0,1]=4 1497 B11R1.91 O=C(O)CSC1=CC=CC=C1 MCULE-4616509502 [2,0,0,0,0,0|1,0,1]=4 1498 B11R1.91 O=C([O-])/C=C/C1=CC=CC=C1 MCULE-3275895563 [2,0,0,0,0,0|0,0,2]=4 1499 B11R1.91 O=C([O-])/C=C/C1=CC=CC=C1 MCULE-6688127943 [2,0,0,0,0,0|0,0,2]=4 1500 B11R1.91 O=C([O-])C=CC1=CC=CC=C1 MCULE-7412134653 [2,0,0,0,0,0|0,0,2]=4 1501 B11R1.91 O=C([O-])CCC1=CC=CC=C1 MCULE-5708877330 [2,0,0,0,0,0|0,0,2]=4 1502 B11R1.40 C#CC(=O)CC1=CC=CC=C1 MCULE-9176537538 [2,0,0,0,0,0|1,0,1]=4 1503 B11R1.40 C/C(=C\C1=CC=CC=C1)/C=O MCULE-9250326305 [2,0,0,0,0,0|1,0,1]=4 1504 B11R1.40 C=CC(=O)CC1=CC=CC=C1 MCULE-3038124815 [2,0,0,0,0,0|1,0,0]=3 1505 B11R1.40 C=CC(=O)NC1=CC=CC=C1 MCULE-5279983680 [2,0,0,0,0,0|2,0,0]=4 1506 B11R1.40 C=CC(=O)OC1=CC=CC=C1 MCULE-5846906255 [2,0,0,0,0,0|2,0,0]=4 1507 B11R1.40 CC(=CC1=CC=CC=C1)C=O MCULE-9630585717 [2,0,0,0,0,0|1,0,1]=4 1508 B11R1.40 CC(=NO)CC1=CC=CC=C1 MCULE-9546256998 [2,0,0,0,0,0|2,0,0]=4 1509 B11R1.40 CC(C=O)CC1=CC=CC=C1 MCULE-6923755839 [2,0,0,0,0,0|1,0,1]=4 1510 B11R1.40 CCC(=O)CC1=CC=CC=C1 MCULE-7523781698 [2,0,0,0,0,0|1,0,1]=4 1511 B11R1.40 CN(C=O)CC1=CC=CC=C1 MCULE-8028362436 [2,0,0,0,0,0|2,0,0]=4 1512 B11R1.40 CNC(=O)CC1=CC=CC=C1 MCULE-9422828103 [2,0,0,0,0,0|2,0,0]=4 1513 B11R1.40 COC(=O)CC1=CC=CC=C1 MCULE-9593207528 [2,0,0,0,0,0|2,0,0]=4 1514 B11R1.40 N#CC(=O)CC1=CC=CC=C1 MCULE-3162650348 [2,0,0,0,0,0|1,0,1]=4 1515 B11R1.40 N/C(=N\O)/CC1=CC=CC=C1 MCULE-3768837989 [2,0,0,0,0,0|2,0,0]=4 1516 B11R1.40 N=CC(=O)NC1=CC=CC=C1 MCULE-2313453326 [2,0,0,0,0,0|2,0,0]=4 1517 B11R1.40 NCC(=O)CC1=CC=CC=C1 MCULE-5143022561 [2,0,0,0,0,0|1,0,1]=4 1518 B11R1.40 NCC(=O)CC1=CC=CC=C1 MCULE-6768593960 [2,0,0,0,0,0|1,0,1]=4 1519 B11R1.40 NNC(=O)CC1=CC=CC=C1 MCULE-9773059659 [2,0,0,0,0,0|2,0,0]=4 1520 B11R1.40 O=C(CBr)CC1=CC=CC=C1 MCULE-8980190969 [2,0,0,0,0,0|1,0,1]=4 1521 B11R1.40 O=C(CC1=CC=CC=C1)NO MCULE-5154879216 [2,0,0,0,0,0|1,0,0]=3 1522 B11R1.40 O=C(CCl)CC1=CC=CC=C1 MCULE-7727010923 [2,0,0,0,0,0|1,0,1]=4 1523 B11R1.40 O=C(CF)CC1=CC=CC=C1 MCULE-5647330834 [2,0,0,0,0,0|1,0,1]=4 1524 B11R1.40 O=C(CO)CC1=CC=CC=C1 MCULE-7128053671 [2,0,0,0,0,0|0,0,1]=3 1525 B11R1.40 O=C(CO)NC1=CC=CC=C1 MCULE-8375219984 [2,0,0,0,0,0|1,0,1]=4 1526 B11R1.40 O=C(NO)NC1=CC=CC=C1 MCULE-2718314619 [2,0,0,0,0,0|2,0,0]=4 1527 B11R1.40 O=C(NO)OC1=CC=CC=C1 MCULE-5871557850 [2,0,0,0,0,0|2,0,0]=4 1528 B11R1.40 O=C/C(=C/C1=CC=CC=C1)/Br MCULE-9636373158 [2,0,0,0,0,0|1,0,1]=4 1529 B11R1.40 O=CC(=CC1=CC=CC=C1)Br MCULE-8336580164 [2,0,0,0,0,0|1,0,1]=4 1530 B11R1.40 O=CC(=CC1=CC=CC=C1)Cl MCULE-3349710906 [2,0,0,0,0,0|1,0,1]=4 1531 B11R1.40 O=CC(Br)CC1=CC=CC=C1 MCULE-5469912045 [2,0,0,0,0,0|1,0,1]=4 1532 B11R1.40 ON=C(Cl)CC1=CC=CC=C1 MCULE-3829443463 [2,0,0,0,0,0|2,0,0]=4 1533 B11R1.20 C=C(Br)CC1=CC=C(C=C1)Br MCULE-4221908700 [2,0,0,0,0,0|2,0,0]=4 1534 B11R1.20 C=C(Br)CC1=CC=C(C=C1)C MCULE-5718685660 [2,0,0,0,0,0|2,0,0]=4 1535 B11R1.20 C=C(Br)CC1=CC=C(C=C1)Cl MCULE-1702761203 [2,0,0,0,0,0|2,0,0]=4 1536 B11R1.20 C=C(Br)CC1=CC=C(C=C1)F MCULE-6620631680 [2,0,0,0,0,0|2,0,0]=4 1537 B11R1.20 C=C(Br)CC1=CC=C(C=C1)O MCULE-4261429252 [2,0,0,0,0,0|1,0,0]=3 1538 B11R1.20 C=C(C)CC1=CC=C(C=C1)Br MCULE-2049078645 [2,0,0,0,0,0|2,0,0]=4 1539 B11R1.20 C=C(C)CC1=CC=C(C=C1)C MCULE-2463949790 [2,0,0,0,0,0|2,0,0]=4 1540 B11R1.20 C=C(C)CC1=CC=C(C=C1)Cl MCULE-3583070094 [2,0,0,0,0,0|2,0,0]=4 1541 B11R1.20 C=C(C)CC1=CC=C(C=C1)F MCULE-5971467670 [2,0,0,0,0,0|2,0,0]=4 1542 B11R1.20 C=C(C)CC1=CC=C(C=C1)O MCULE-5728769328 [2,0,0,0,0,0|1,0,0]=3 1543 B11R1.20 C=C(Cl)CC1=CC=C(C=C1)Br MCULE-6088244763 [2,0,0,0,0,0|2,0,0]=4 1544 B11R1.20 C=C(Cl)CC1=CC=C(C=C1)C MCULE-9883417953 [2,0,0,0,0,0|2,0,0]=4 1545 B11R1.20 C=C(Cl)CC1=CC=C(C=C1)Cl MCULE-8056987339 [2,0,0,0,0,0|2,0,0]=4 1546 B11R1.20 C=C(Cl)CC1=CC=C(C=C1)F MCULE-8804526980 [2,0,0,0,0,0|2,0,0]=4 1547 B11R1.20 CC(=O)CC1=CC=C(C=C1)Br MCULE-2796276312 [2,0,0,0,0,0|1,0,1]=4 1548 B11R1.20 CC(=O)CC1=CC=C(C=C1)C MCULE-9432147559 [2,0,0,0,0,0|1,0,1]=4 1549 B11R1.20 CC(=O)CC1=CC=C(C=C1)Cl MCULE-3336422329 [2,0,0,0,0,0|1,0,1]=4 1550 B11R1.20 CC(=O)CC1=CC=C(C=C1)F MCULE-7867529938 [2,0,0,0,0,0|1,0,1]=4 1551 B11R1.20 CC(=O)CC1=CC=C(C=C1)I MCULE-4302219477 [2,0,0,0,0,0|1,0,1]=4 1552 B11R1.20 CC(=O)CC1=CC=C(C=C1)N MCULE-8992401567 [2,0,0,0,0,0|1,0,1]=4 1553 B11R1.20 CC(=O)CC1=CC=C(C=C1)O MCULE-1295731157 [2,0,0,0,0,0|0,0,1]=3 1554 B11R1.20 CC(=O)NC1=CC=C(C=C1)O MCULE-3844920617 [2,0,0,0,0,0|1,0,1]=4 1555 B11R1.20 CC(=O)NC1=CC=C(C=C1)O MCULE-7875258536 [2,0,0,0,0,0|1,0,1]=4 1556 B11R1.20 CC(=O)OC1=CC=C(C=C1)O MCULE-1061752766 [2,0,0,0,0,0|1,0,1]=4 1557 B11R1.20 CC1=CC=C(C=C1)CC(=O)Cl MCULE-8548926281 [2,0,0,0,0,0|2,0,0]=4 1558 B11R1.20 CC1=CC=C(C=C1)CC(=O)O MCULE-7836754263 [2,0,0,0,0,0|1,0,0]=3 1559 B11R1.20 CC1=CN=C(C=C1)CC(=O)O MCULE-4500305633 [2,0,0,0,0,0|2,0,0]=4 1560 B11R1.20 CC1=CN=C(C=C1)CC(=O)O MCULE-6746029360 [2,0,0,0,0,0|2,0,0]=4 1561 B11R1.20 CC1=NC=C(C=C1)CC(=O)O MCULE-1929752400 [2,0,0,0,0,0|2,0,0]=4 1562 B11R1.20 NC(=O)CC1=CC=C(C=C1)Br MCULE-6494224473 [2,0,0,0,0,0|2,0,0]=4 1563 B11R1.20 NC(=O)CC1=CC=C(C=C1)Cl MCULE-5575880469 [2,0,0,0,0,0|2,0,0]=4 1564 B11R1.20 NC(=O)CC1=CC=C(C=C1)F MCULE-5260225130 [2,0,0,0,0,0|2,0,0]=4 1565 B11R1.20 NC(=O)CC1=CC=C(C=C1)I MCULE-5828221034 [2,0,0,0,0,0|2,0,0]=4 1566 B11R1.20 NC(=O)CC1=CC=C(C=C1)N MCULE-3368755597 [2,0,0,0,0,0|2,0,0]=4 1567 B11R1.20 NC(=O)CC1=CC=C(C=C1)O MCULE-9884834100 [2,0,0,0,0,0|1,0,0]=3 1568 B11R1.20 NC(=O)NC1=CC=C(C=C1)O MCULE-3275391733 [2,0,0,0,0,0|2,0,0]=4 1569 B11R1.20 NC1=CC=C(C=C1)CC(=O)O MCULE-7171963222 [2,0,0,0,0,0|1,0,0]=3 1570 B11R1.20 NC1=CC=C(C=C1)CC(=S)O MCULE-7097123857 [2,0,0,0,0,0|1,1,0]=4 1571 B11R1.20 NC1=CC=C(C=N1)CC(=O)O MCULE-6419974192 [2,0,0,0,0,0|2,0,0]=4 1572 B11R1.20 NC1=CN=C(C=C1)CC(=O)O MCULE-6727372902 [2,0,0,0,0,0|2,0,0]=4 1573 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)Br MCULE-1088437289 [2,0,0,0,0,0|2,0,0]=4 1574 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)Cl MCULE-5852291690 [2,0,0,0,0,0|2,0,0]=4 1575 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)F MCULE-9707670299 [2,0,0,0,0,0|2,0,0]=4 1576 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)I MCULE-1084666200 [2,0,0,0,0,0|2,0,0]=4 1577 B11R1.20 O=C(O)CC1=CC=C(C=C1)Br MCULE-8300414581 [2,0,0,0,0,0|1,0,0]=3 1578 B11R1.20 O=C(O)CC1=CC=C(C=C1)Cl MCULE-1634058139 [2,0,0,0,0,0|1,0,0]=3 1579 B11R1.20 O=C(O)CC1=CC=C(C=C1)F MCULE-8246447237 [2,0,0,0,0,0|1,0,0]=3 1580 B11R1.20 O=C(O)CC1=CC=C(C=C1)I MCULE-1221154743 [2,0,0,0,0,0|1,0,0]=3 1581 B11R1.20 O=C(O)CC1=CC=C(C=C1)O MCULE-7254180433 [2,0,0,0,0,0|0,0,0]=2 1582 B11R1.20 O=C(O)CC1=CC=C(C=C1)S MCULE-8771795045 [2,0,0,0,0,0|0,1,0]=3 1583 B11R1.20 O=C(O)CC1=CC=C(N=C1)Br MCULE-5955108459 [2,0,0,0,0,0|2,0,0]=4 1584 B11R1.20 O=C(O)CC1=CC=C(N=C1)Cl MCULE-8148043601 [2,0,0,0,0,0|2,0,0]=4 1585 B11R1.20 O=C(O)CC1=CNC(=O)C=C1 MCULE-7521356508 [2,0,0,0,0,0|1,0,1]=4 1586 B11R1.20 O=C(O)CC1=NC=C(C=C1)Br MCULE-5682923665 [2,0,0,0,0,0|2,0,0]=4 1587 B11R1.20 O=C(O)CC1=NC=C(C=C1)Br MCULE-6438430612 [2,0,0,0,0,0|2,0,0]=4 1588 B11R1.20 O=C(O)CC1=NC=C(C=C1)Cl MCULE-2200072147 [2,0,0,0,0,0|2,0,0]=4 1589 B11R1.20 O=C(O)CC1=NC=C(C=C1)Cl MCULE-9214741763 [2,0,0,0,0,0|2,0,0]=4 1590 B11R1.20 O=C(O)CC1=NC=C(C=C1)F MCULE-2871798928 [2,0,0,0,0,0|2,0,0]=4 1591 B11R1.20 O=C(O)CC1=NC=C(C=C1)F MCULE-6124722524 [2,0,0,0,0,0|2,0,0]=4 1592 B11R1.20 O=C(O)CC1=NC=C(C=C1)I MCULE-5351430465 [2,0,0,0,0,0|2,0,0]=4 1593 B11R1.20 O=C(O)CC1=NC=C(C=C1)O MCULE-3180190519 [2,0,0,0,0,0|1,0,0]=3 1594 B11R1.20 O=C([O-])CC1=CC=C(C=C1)F MCULE-7645691765 [2,0,0,0,0,0|1,0,1]=4 1595 B11R1.20 O=C1C=CN(C=C1)CC(=O)O MCULE-1041841208 [2,0,0,0,0,0|1,0,1]=4 1596 B11R1.20 O=N(=O)CC1=CC=C(C=C1)Br MCULE-4369643366 [2,0,0,0,0,0|2,0,0]=4 1597 B11R1.20 O=N(=O)CC1=CC=C(C=C1)Cl MCULE-7645426963 [2,0,0,0,0,0|2,0,0]=4 1598 B11R1.20 O=N(=O)CC1=CC=C(C=C1)F MCULE-9481829769 [2,0,0,0,0,0|2,0,0]=4 1599 B13R1.3 C#CC1=CC=C(C=C1)CCC(=O)O MCULE-5589526715 [1,1,0,0,0,0|1,0,1]=4 1600 B13R1.3 CCC1=CC=C(C=C1)/C=C/C(=O)O MCULE-3685032116 [1,1,0,0,0,0|1,0,1]=4 1601 B13R1.3 CCC1=CC=C(C=C1)C=CC(=O)O MCULE-2720585827 [1,1,0,0,0,0|1,0,1]=4 1602 B13R1.3 CCC1=CC=C(C=C1)CCC(=O)O MCULE-2110019416 [1,1,0,0,0,0|1,0,1]=4 1603 B13R1.3 COC1=CC=C(C=C1)/C=C/C(=O)C MCULE-7015001426 [1,1,0,0,0,0|1,0,1]=4 1604 B13R1.3 COC1=CC=C(C=C1)/C=C/C(=O)Cl MCULE-7256772196 [1,1,0,0,0,0|1,0,1]=4 1605 B13R1.3 COC1=CC=C(C=C1)/C=C/C(=O)O MCULE-6993960877 [1,1,0,0,0,0|0,0,1]=3 1606 B13R1.3 COC1=CC=C(C=C1)C#CC(=O)O MCULE-8139724004 [1,1,0,0,0,0|0,0,2]=4 1607 B13R1.3 COC1=CC=C(C=C1)C=CC(=O)C MCULE-3255320679 [1,1,0,0,0,0|1,0,1]=4 1608 B13R1.3 COC1=CC=C(C=C1)C=CC(=O)Cl MCULE-2384637852 [1,1,0,0,0,0|1,0,1]=4 1609 B13R1.3 COC1=CC=C(C=C1)C=CC(=O)O MCULE-4456423689 [1,1,0,0,0,0|0,0,1]=3 1610 B13R1.3 COC1=CC=C(C=C1)C=CC(=O)[O-] MCULE-3474372269 [1,1,0,0,0,0|0,0,2]=4 1611 B13R1.3 COC1=CC=C(C=C1)CCC(=O)C MCULE-5951016256 [1,1,0,0,0,0|1,0,1]=4 1612 B13R1.3 COC1=CC=C(C=C1)CCC(=O)Cl MCULE-1305857004 [1,1,0,0,0,0|1,0,1]=4 1613 B13R1.3 COC1=CC=C(C=C1)CCC(=O)N MCULE-5374679110 [1,1,0,0,0,0|1,0,1]=4 1614 B13R1.3 COC1=CC=C(C=C1)CCC(=O)O MCULE-1674311204 [1,1,0,0,0,0|0,0,1]=3 1615 B13R1.3 COC1=CC=C(C=C1)CCC(=O)[O-] MCULE-7823760413 [1,1,0,0,0,0|0,0,2]=4 1616 B13R1.3 COC1=CC=C(C=C1)CNC(=O)C MCULE-9545701688 [1,1,0,0,0,0|2,0,0]=4 1617 B13R1.3 COC1=CC=C(C=C1)CNC(=O)N MCULE-4222293256 [1,1,0,0,0,0|2,0,0]=4 1618 B13R1.3 COC1=CC=C(C=C1)CNC(=S)O MCULE-1562908189 [1,1,0,0,0,0|1,1,0]=4 1619 B13R1.3 COC1=CC=C(C=C1)COC(=O)C MCULE-2255812947 [1,1,0,0,0,0|2,0,0]=4 1620 B13R1.3 COC1=CC=C(C=C1)COC(=O)Cl MCULE-3261665339 [1,1,0,0,0,0|2,0,0]=4 1621 B13R1.3 COC1=CC=C(C=C1)NCC(=O)O MCULE-7179149062 [1,1,0,0,0,0|1,0,1]=4 1622 B13R1.3 COC1=CC=C(C=C1)OCC(=O)O MCULE-3881661052 [1,1,0,0,0,0|1,0,1]=4 1623 B13R1.3 COC1=CC=C(C=C1)SCC(=O)O MCULE-8573257372 [1,1,0,0,0,0|1,0,1]=4 1624 B13R1.3 COC1=CC=C(C=N1)/C=C/C(=O)O MCULE-1842553003 [1,1,0,0,0,0|1,0,1]=4 1625 B13R1.3 COC1=NC=C(C=C1)C=CC(=O)O MCULE-9082686105 [1,1,0,0,0,0|1,0,1]=4 1626 B13R1.3 COC1=NC=C(C=C1)CCC(=O)O MCULE-9807840022 [1,1,0,0,0,0|1,0,1]=4 1627 B13R1.3 CSC1=CC=C(C=C1)/C=C/C(=O)O MCULE-6324671016 [1,1,0,0,0,0|0,1,1]=4 1628 B13R1.3 CSC1=CC=C(C=C1)C=CC(=O)O MCULE-9285137157 [1,1,0,0,0,0|0,1,1]=4 1629 B13R1.3 CSC1=CC=C(C=C1)CCC(=O)O MCULE-9755721169 [1,1,0,0,0,0|0,1,1]=4 1630 B13R1.3 N#CC1=CC=C(C=C1)/C=C/C(=O)O MCULE-4484869195 [1,1,0,0,0,0|1,0,1]=4 1631 B13R1.3 N#CC1=CC=C(C=C1)C=CC(=O)O MCULE-9879860446 [1,1,0,0,0,0|1,0,1]=4 1632 B13R1.3 N#CC1=CC=C(C=C1)CCC(=O)O MCULE-6891261134 [1,1,0,0,0,0|1,0,1]=4 1633 B13R1.3 NCC1=CC=C(C=C1)CCC(=O)O MCULE-3166710921 [1,1,0,0,0,0|1,0,1]=4 1634 B13R1.3 NCC1=CC=C(C=C1)CCC(=O)O MCULE-3624977655 [1,1,0,0,0,0|1,0,1]=4 1635 B13R1.3 NNC1=CC=C(C=C1)CCC(=O)O MCULE-1705612417 [1,1,0,0,0,0|1,0,1]=4 1636 B13R1.3 NNC1=CC=C(C=C1)CCC(=O)O MCULE-2881336886 [1,1,0,0,0,0|1,0,1]=4 1637 B13R1.3 O=C(O)/C=C/C1=CC=C(C=C1)CBr MCULE-9998924523 [1,1,0,0,0,0|1,0,1]=4 1638 B13R1.3 O=C(O)C=CC1=CC=C(C=C1)CBr MCULE-1604768230 [1,1,0,0,0,0|1,0,1]=4 1639 B13R1.3 O=C(O)CCC1=CC=C(C=C1)CO MCULE-1979680062 [1,1,0,0,0,0|0,0,1]=3 1640 B13R1.3 O=C(O)COC1=CC=C(C=C1)CO MCULE-4472330611 [1,1,0,0,0,0|1,0,1]=4 1641 B13R1.3 O=CC1=CC=C(C=C1)/C=C/C(=O)O MCULE-5017170189 [1,1,0,0,0,0|0,0,2]=4 1642 B13R1.3 O=CC1=CC=C(C=C1)C=CC(=O)O MCULE-2468143780 [1,1,0,0,0,0|0,0,2]=4 1643 B13R1.3 O=CC1=CC=C(C=C1)CCC(=O)O MCULE-8265326595 [1,1,0,0,0,0|0,0,2]=4 1644 B13R1.14 CC(=NO)C=CC1=CC=C(C=C1)O MCULE-5377247609 [1,1,0,0,0,0|1,0,1]=4 1645 B13R1.14 COC(=O)/C=C/C1=CC=C(C=C1)Br MCULE-5724910797 [1,1,0,0,0,0|1,0,1]=4 1646 B13R1.14 COC(=O)/C=C/C1=CC=C(C=C1)C MCULE-3907582871 [1,1,0,0,0,0|1,0,1]=4 1647 B13R1.14 COC(=O)/C=C/C1=CC=C(C=C1)Cl MCULE-1058303485 [1,1,0,0,0,0|1,0,1]=4 1648 B13R1.14 COC(=O)/C=C/C1=CC=C(C=C1)F MCULE-9171784241 [1,1,0,0,0,0|1,0,1]=4 1649 B13R1.14 COC(=O)/C=C/C1=CC=C(C=C1)O MCULE-8717776291 [1,1,0,0,0,0|0,0,1]=3 1650 B13R1.14 COC(=O)/C=C\C1=CC=C(C=C1)O MCULE-5533869815 [1,1,0,0,0,0|0,0,1]=3 1651 B13R1.14 COC(=O)C=CC1=CC=C(C=C1)Br MCULE-6282370868 [1,1,0,0,0,0|1,0,1]=4 1652 B13R1.14 COC(=O)C=CC1=CC=C(C=C1)C MCULE-2475203381 [1,1,0,0,0,0|1,0,1]=4 1653 B13R1.14 COC(=O)C=CC1=CC=C(C=C1)Cl MCULE-9413133594 [1,1,0,0,0,0|1,0,1]=4 1654 B13R1.14 COC(=O)C=CC1=CC=C(C=C1)F MCULE-1509564336 [1,1,0,0,0,0|1,0,1]=4 1655 B13R1.14 COC(=O)C=CC1=CC=C(C=C1)N MCULE-7692368161 [1,1,0,0,0,0|1,0,1]=4 1656 B13R1.14 COC(=O)C=CC1=CC=C(C=C1)O MCULE-7654618031 [1,1,0,0,0,0|0,0,1]=3 1657 B13R1.14 COC(=O)CCC1=CC=C(C=C1)Br MCULE-1468234134 [1,1,0,0,0,0|1,0,1]=4 1658 B13R1.14 COC(=O)CCC1=CC=C(C=C1)C MCULE-1613073764 [1,1,0,0,0,0|1,0,1]=4 1659 B13R1.14 COC(=O)CCC1=CC=C(C=C1)Cl MCULE-6407005406 [1,1,0,0,0,0|1,0,1]=4 1660 B13R1.14 COC(=O)CCC1=CC=C(C=C1)F MCULE-7006332083 [1,1,0,0,0,0|1,0,1]=4 1661 B13R1.14 COC(=O)CCC1=CC=C(C=C1)I MCULE-8866758914 [1,1,0,0,0,0|1,0,1]=4 1662 B13R1.14 COC(=O)CCC1=CC=C(C=C1)N MCULE-7611051758 [1,1,0,0,0,0|1,0,1]=4 1663 B13R1.14 COC(=O)CCC1=CC=C(C=C1)N MCULE-9913688915 [1,1,0,0,0,0|1,0,1]=4 1664 B13R1.14 COC(=O)CCC1=CC=C(C=C1)O MCULE-3632791623 [1,1,0,0,0,0|0,0,1]=3 1665 B13R1.14 COC(=O)CNC1=CC=C(C=C1)O MCULE-1747138706 [1,1,0,0,0,0|1,0,1]=4 1666 B13R1.14 COC(=O)CNC1=CC=C(C=C1)O MCULE-8643592641 [1,1,0,0,0,0|1,0,1]=4 1667 B13R1.14 COC(=O)COC1=CC=C(C=C1)O MCULE-8336452434 [1,1,0,0,0,0|1,0,1]=4 1668 B13R1.14 COC(=O)CSC1=CC=C(C=C1)O MCULE-1215642980 [1,1,0,0,0,0|1,0,1]=4 1669 B13R1.14 COC(=O)NCC1=CC=C(C=C1)Cl MCULE-1320029694 [1,1,0,0,0,0|2,0,0]=4 1670 B13R1.14 COC(=O)NCC1=CC=C(C=C1)N MCULE-9960137532 [1,1,0,0,0,0|2,0,0]=4 1671 B13R1.14 NNC(=O)C=CC1=CC=C(C=C1)O MCULE-3967112953 [1,1,0,0,0,0|1,0,1]=4 1672 B13R1.14 NNC(=O)CCC1=CC=C(C=C1)O MCULE-6673334894 [1,1,0,0,0,0|1,0,1]=4 1673 B13R1.14 O=C(C=CC1=CC=C(C=C1)Cl)NO MCULE-8944291584 [1,1,0,0,0,0|1,0,1]=4 1674 B13R1.14 O=C(CO)NCC1=CC=C(C=C1)F MCULE-3702181547 [1,1,0,0,0,0|2,0,0]=4 1675 B13R1.132 CC(=CC(=O)O)C1=CC=C(C=C1)Br MCULE-4152187179 [1,1,0,0,0,0|1,0,1]=4 1676 B13R1.132 CC(=CC(=O)O)C1=CC=C(C=C1)Cl MCULE-4312688305 [1,1,0,0,0,0|1,0,1]=4 1677 B13R1.132 CC(=CC(=O)O)C1=CC=C(C=C1)F MCULE-2600956660 [1,1,0,0,0,0|1,0,1]=4 1678 B13R1.132 CC(=O)NC(C)C1=CC=C(C=C1)O MCULE-2334298539 [1,1,0,0,0,0|2,0,0]=4 1679 B13R1.132 CC(=O)N[C@@H](C)C1=CC=C(C=C1)O MCULE-1285422659 [1,1,0,0,0,0|2,0,0]=4 1680 B13R1.132 CC(=O)N[C@H](C)C1=CC=C(C=C1)O MCULE-3116131269 [1,1,0,0,0,0|2,0,0]=4 1681 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)Br MCULE-2016098947 [1,1,0,0,0,0|1,0,1]=4 1682 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)Cl MCULE-2722710140 [1,1,0,0,0,0|1,0,1]=4 1683 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)F MCULE-7127297434 [1,1,0,0,0,0|1,0,1]=4 1684 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)N MCULE-1218406621 [1,1,0,0,0,0|1,0,1]=4 1685 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)O MCULE-7578972799 [1,1,0,0,0,0|0,0,1]=3 1686 B13R1.132 CC1=CC=C(C=C1)C(=CC(=O)O)C MCULE-2198673132 [1,1,0,0,0,0|1,0,1]=4 1687 B13R1.132 CC1=CC=C(C=C1)C(C)CC(=O)O MCULE-8428341971 [1,1,0,0,0,0|1,0,1]=4 1688 B13R1.132 CC1=CC=C(C=C1)C(N)CC(=O)O MCULE-9173736504 [1,1,0,0,0,0|1,0,1]=4 1689 B13R1.132 CC1=CC=C(C=C1)C(O)CC(=O)O MCULE-4624408830 [1,1,0,0,0,0|1,0,1]=4 1690 B13R1.132 CC1=CC=C(C=C1)[C@@H](N)CC(=O)O MCULE-5031145088 [1,1,0,0,0,0|1,0,1]=4 1691 B13R1.132 CC1=CC=C(C=C1)[C@@H](N)CC(=O)O MCULE-7474694854 [1,1,0,0,0,0|1,0,1]=4 1692 B13R1.132 CC1=CC=C(C=C1)[C@H](N)CC(=O)O MCULE-4625661458 [1,1,0,0,0,0|1,0,1]=4 1693 B13R1.132 CC1=CC=C(C=C1)[C@H](N)CC(=O)O MCULE-5235266278 [1,1,0,0,0,0|1,0,1]=4 1694 B13R1.132 C[C@@H](CC(=O)O)C1=CC=C(C=C1)F MCULE-9711949511 [1,1,0,0,0,0|1,0,1]=4 1695 B13R1.132 C[C@H](CC(=O)O)C1=CC=C(C=C1)F MCULE-7731951555 [1,1,0,0,0,0|1,0,1]=4 1696 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)Br MCULE-2562479227 [1,1,0,0,0,0|1,0,1]=4 1697 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)Br MCULE-3145404080 [1,1,0,0,0,0|1,0,1]=4 1698 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)Br MCULE-4957228775 [1,1,0,0,0,0|1,0,1]=4 1699 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)Br MCULE-6667254725 [1,1,0,0,0,0|1,0,1]=4 1700 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)Cl MCULE-3615570804 [1,1,0,0,0,0|1,0,1]=4 1701 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)Cl MCULE-4520940339 [1,1,0,0,0,0|1,0,1]=4 1702 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)Cl MCULE-9553001923 [1,1,0,0,0,0|1,0,1]=4 1703 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)F MCULE-4157411281 [1,1,0,0,0,0|1,0,1]=4 1704 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)F MCULE-8698893976 [1,1,0,0,0,0|1,0,1]=4 1705 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)O MCULE-8022047792 [1,1,0,0,0,0|0,0,1]=3 1706 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)Br MCULE-3280690304 [1,1,0,0,0,0|1,0,1]=4 1707 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)Br MCULE-4585504777 [1,1,0,0,0,0|1,0,1]=4 1708 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)Br MCULE-6903403380 [1,1,0,0,0,0|1,0,1]=4 1709 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)Br MCULE-7166549699 [1,1,0,0,0,0|1,0,1]=4 1710 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)Cl MCULE-4628099540 [1,1,0,0,0,0|1,0,1]=4 1711 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)Cl MCULE-5508958389 [1,1,0,0,0,0|1,0,1]=4 1712 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)Cl MCULE-7286983486 [1,1,0,0,0,0|1,0,1]=4 1713 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)Cl MCULE-7838291156 [1,1,0,0,0,0|1,0,1]=4 1714 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)F MCULE-1061728753 [1,1,0,0,0,0|1,0,1]=4 1715 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)F MCULE-6327368529 [1,1,0,0,0,0|1,0,1]=4 1716 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)F MCULE-6947859998 [1,1,0,0,0,0|1,0,1]=4 1717 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)F MCULE-7945509136 [1,1,0,0,0,0|1,0,1]=4 1718 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)O MCULE-2907878626 [1,1,0,0,0,0|0,0,1]=3 1719 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)O MCULE-6136594346 [1,1,0,0,0,0|0,0,1]=3 1720 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)O MCULE-8247287459 [1,1,0,0,0,0|0,0,1]=3 1721 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(C=C1)Br MCULE-2112390316 [1,1,0,0,0,0|1,0,1]=4 1722 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(C=C1)Br MCULE-2269294845 [1,1,0,0,0,0|1,0,1]=4 1723 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(C=C1)Br MCULE-6481937572 [1,1,0,0,0,0|1,0,1]=4 1724 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(C=C1)Br MCULE-8905067487 [1,1,0,0,0,0|1,0,1]=4 1725 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(C=C1)Cl MCULE-2038848679 [1,1,0,0,0,0|1,0,1]=4 1726 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(C=C1)Cl MCULE-4123634292 [1,1,0,0,0,0|1,0,1]=4 1727 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(C=C1)F MCULE-2375735241 [1,1,0,0,0,0|1,0,1]=4 1728 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(C=C1)F MCULE-5721879123 [1,1,0,0,0,0|1,0,1]=4 1729 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(C=C1)O MCULE-4604116690 [1,1,0,0,0,0|0,0,1]=3 1730 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(C=C1)O MCULE-7232618432 [1,1,0,0,0,0|0,0,1]=3 1731 B13R1.132 O=C(O)CC(=O)C1=CC=C(C=C1)O MCULE-4533243268 [1,1,0,0,0,0|0,0,2]=4 1732 B13R1.132 O=C(O)CC(O)C1=CC=C(C=C1)Cl MCULE-2786363573 [1,1,0,0,0,0|1,0,1]=4 1733 B13R1.132 O=C(O)CC(O)C1=CC=C(C=C1)F MCULE-7115171473 [1,1,0,0,0,0|1,0,1]=4 1734 B13R1.132 O=C(O)CC(O)C1=CC=C(C=C1)O MCULE-7634229278 [1,1,0,0,0,0|0,0,1]=3 1735 B13R1.164 CC1=C(C=CC(=C1)F)CCC(=O)O MCULE-1013388620 [1,1,0,0,0,0|1,0,1]=4 1736 B13R1.164 CC1=CC(=C(C=C1)C=CC(=O)O)C MCULE-1694881584 [1,1,0,0,0,0|1,0,1]=4 1737 B13R1.164 CC1=CC(=C(C=C1)C=CC(=O)O)F MCULE-8808633497 [1,1,0,0,0,0|1,0,1]=4 1738 B13R1.164 CC1=CC(=C(C=C1)CCC(=O)O)Br MCULE-6766787776 [1,1,0,0,0,0|1,0,1]=4 1739 B13R1.164 CC1=CC(=C(C=C1)CCC(=O)O)C MCULE-6418950097 [1,1,0,0,0,0|1,0,1]=4 1740 B13R1.164 CC1=CC(=CC=C1C=CC(=O)O)F MCULE-5476342488 [1,1,0,0,0,0|1,0,1]=4 1741 B13R1.164 CC1=CC(=CC=C1C=CC(=O)O)O MCULE-1922876294 [1,1,0,0,0,0|0,0,1]=3 1742 B13R1.164 CC1=CC(=CC=C1CCC(=O)O)Br MCULE-8861086857 [1,1,0,0,0,0|1,0,1]=4 1743 B13R1.164 CC1=CC(=CC=C1CCC(=O)O)Cl MCULE-6046464602 [1,1,0,0,0,0|1,0,1]=4 1744 B13R1.164 CC1=CC=C(C(=C1)C)/C=C/C(=O)O MCULE-5580725255 [1,1,0,0,0,0|1,0,1]=4 1745 B13R1.164 CC1=CC=C(C(=C1)F)/C=C/C(=O)O MCULE-2061567327 [1,1,0,0,0,0|1,0,1]=4 1746 B13R1.164 CC1=CC=C(C(=C1)F)CCC(=O)O MCULE-4790737763 [1,1,0,0,0,0|1,0,1]=4 1747 B13R1.164 NC1=C(C=CC(=C1)Br)C=CC(=O)O MCULE-5659461895 [1,1,0,0,0,0|1,0,1]=4 1748 B13R1.164 NC1=CC=C(C(=C1)F)CCC(=O)O MCULE-3007647292 [1,1,0,0,0,0|1,0,1]=4 1749 B13R1.164 O=C(O)/C=C/C1=C(C=C(C=C1)O)O MCULE-8901806840 [1,1,0,0,0,0|0,0,1]=3 1750 B13R1.164 O=C(O)/C=C/C1=CC=C(C=C1Br)F MCULE-9551168842 [1,1,0,0,0,0|1,0,1]=4 1751 B13R1.164 O=C(O)/C=C/C1=CC=C(C=C1Cl)Br MCULE-7469766132 [1,1,0,0,0,0|1,0,1]=4 1752 B13R1.164 O=C(O)/C=C/C1=CC=C(C=C1Cl)Cl MCULE-8879950993 [1,1,0,0,0,0|1,0,1]=4 1753 B13R1.164 O=C(O)/C=C/C1=CC=C(C=C1Cl)F MCULE-2764533633 [1,1,0,0,0,0|1,0,1]=4 1754 B13R1.164 O=C(O)/C=C/C1=CC=C(C=C1Cl)O MCULE-5108458607 [1,1,0,0,0,0|0,0,1]=3 1755 B13R1.164 O=C(O)/C=C/C1=CC=C(C=C1F)Br MCULE-5377311171 [1,1,0,0,0,0|1,0,1]=4 1756 B13R1.164 O=C(O)/C=C/C1=CC=C(C=C1F)Cl MCULE-2920880729 [1,1,0,0,0,0|1,0,1]=4 1757 B13R1.164 O=C(O)/C=C/C1=CC=C(C=C1F)F MCULE-4700179137 [1,1,0,0,0,0|1,0,1]=4 1758 B13R1.164 O=C(O)/C=C/C1=CC=C(C=C1F)O MCULE-7956565234 [1,1,0,0,0,0|0,0,1]=3 1759 B13R1.164 O=C(O)C=CC1=C(C=C(C=C1)Br)Cl MCULE-6413142602 [1,1,0,0,0,0|1,0,1]=4 1760 B13R1.164 O=C(O)C=CC1=C(C=C(C=C1)F)Cl MCULE-6941911399 [1,1,0,0,0,0|1,0,1]=4 1761 B13R1.164 O=C(O)C=CC1=C(C=C(C=C1)O)O MCULE-9716894670 [1,1,0,0,0,0|0,0,1]=3 1762 B13R1.164 O=C(O)C=CC1=CC=C(C=C1Br)F MCULE-4038818020 [1,1,0,0,0,0|1,0,1]=4 1763 B13R1.164 O=C(O)C=CC1=CC=C(C=C1Cl)Cl MCULE-2855191386 [1,1,0,0,0,0|1,0,1]=4 1764 B13R1.164 O=C(O)C=CC1=CC=C(C=C1Cl)O MCULE-4385429603 [1,1,0,0,0,0|0,0,1]=3 1765 B13R1.164 O=C(O)C=CC1=CC=C(C=C1F)Br MCULE-5057667374 [1,1,0,0,0,0|1,0,1]=4 1766 B13R1.164 O=C(O)C=CC1=CC=C(C=C1F)Cl MCULE-1649504536 [1,1,0,0,0,0|1,0,1]=4 1767 B13R1.164 O=C(O)C=CC1=CC=C(C=C1F)F MCULE-6476217219 [1,1,0,0,0,0|1,0,1]=4 1768 B13R1.164 O=C(O)C=CC1=CC=C(C=C1F)O MCULE-4773815421 [1,1,0,0,0,0|0,0,1]=3 1769 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)Br)Br MCULE-2555097895 [1,1,0,0,0,0|1,0,1]=4 1770 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)Br)F MCULE-2307054648 [1,1,0,0,0,0|1,0,1]=4 1771 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)Cl)Cl MCULE-4616446158 [1,1,0,0,0,0|1,0,1]=4 1772 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)Cl)F MCULE-4908436802 [1,1,0,0,0,0|1,0,1]=4 1773 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)Cl)O MCULE-7610233894 [1,1,0,0,0,0|1,0,1]=4 1774 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)F)F MCULE-4713099592 [1,1,0,0,0,0|1,0,1]=4 1775 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)O)Cl MCULE-3999378523 [1,1,0,0,0,0|0,0,1]=3 1776 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)O)F MCULE-3984526308 [1,1,0,0,0,0|0,0,1]=3 1777 B13R1.164 O=C(O)CCC1=CC=C(C=C1Br)Cl MCULE-7576387587 [1,1,0,0,0,0|1,0,1]=4 1778 B13R1.164 O=C(O)CCC1=CC=C(C=C1Br)F MCULE-8205149810 [1,1,0,0,0,0|1,0,1]=4 1779 B13R1.164 O=C(O)CCC1=CC=C(C=C1Cl)Br MCULE-2448713732 [1,1,0,0,0,0|1,0,1]=4 1780 B13R1.164 O=C(O)CCC1=CC=C(C=C1Cl)F MCULE-2575221656 [1,1,0,0,0,0|1,0,1]=4 1781 B13R1.164 O=C(O)CCC1=CC=C(C=C1O)O MCULE-2725234741 [1,1,0,0,0,0|0,0,1]=3 1782 B13R1.164 O=C(O)COC1=CC=C(C=C1Cl)O MCULE-9424477231 [1,1,0,0,0,0|1,0,1]=4 1783 B13R1.511 CC(=O)/C=C/C1=CC(=C(C=C1)O)O MCULE-9987567980 [1,1,0,0,0,0|1,0,1]=4 1784 B13R1.511 CC(=O)C=CC1=CC=C(C(=C1)O)O MCULE-6986896881 [1,1,0,0,0,0|1,0,1]=4 1785 B13R1.511 CC(=O)CCC1=CC(=C(C=C1)O)O MCULE-9574412120 [1,1,0,0,0,0|1,0,1]=4 1786 B13R1.511 CC1=C(C=C(C=C1)/C=C/C(=O)O)C MCULE-8675537801 [1,1,0,0,0,0|1,0,1]=4 1787 B13R1.511 CC1=C(C=C(C=C1)C=CC(=O)O)C MCULE-6959300564 [1,1,0,0,0,0|1,0,1]=4 1788 B13R1.511 CC1=C(C=C(C=C1)CCC(=O)O)C MCULE-7369215560 [1,1,0,0,0,0|1,0,1]=4 1789 B13R1.511 CC1=C(C=C(C=C1)CCC(=O)O)Cl MCULE-9054375105 [1,1,0,0,0,0|1,0,1]=4 1790 B13R1.511 CC1=C(C=C(C=C1)CCC(=O)O)F MCULE-9844554977 [1,1,0,0,0,0|1,0,1]=4 1791 B13R1.511 CC1=C(C=CC(=C1)/C=C/C(=O)O)F MCULE-5173802637 [1,1,0,0,0,0|1,0,1]=4 1792 B13R1.511 CC1=C(C=CC(=C1)C=CC(=O)O)F MCULE-2657198608 [1,1,0,0,0,0|1,0,1]=4 1793 B13R1.511 CC1=C(C=CC(=C1)CCC(=O)O)Br MCULE-9232565026 [1,1,0,0,0,0|1,0,1]=4 1794 B13R1.511 CC1=C(C=CC(=C1)CCC(=O)O)Cl MCULE-3566859648 [1,1,0,0,0,0|1,0,1]=4 1795 B13R1.511 CC1=C(C=CC(=C1)CCC(=O)O)F MCULE-7289492177 [1,1,0,0,0,0|1,0,1]=4 1796 B13R1.511 CC1=CC(=CC=C1O)CCC(=O)O MCULE-3677897760 [1,1,0,0,0,0|0,0,1]=3 1797 B13R1.511 CC1=CC=C(C=C1Br)CCC(=O)O MCULE-8631544438 [1,1,0,0,0,0|1,0,1]=4 1798 B13R1.511 CC1=CC=C(C=C1F)/C=C/C(=O)O MCULE-3854652052 [1,1,0,0,0,0|1,0,1]=4 1799 B13R1.511 CC1=CC=C(C=C1F)C=CC(=O)O MCULE-5209264711 [1,1,0,0,0,0|1,0,1]=4 1800 B13R1.511 CC1=CC=C(C=C1N)CCC(=O)O MCULE-2806484036 [1,1,0,0,0,0|1,0,1]=4 1801 B13R1.511 CC1=CC=C(C=C1O)CCC(=O)O MCULE-7926065965 [1,1,0,0,0,0|1,0,1]=4 1802 B13R1.511 NC(=O)/C=C/C1=CC(=C(C=C1)O)O MCULE-2035675836 [1,1,0,0,0,0|1,0,1]=4 1803 B13R1.511 NC(=O)C=CC1=CC=C(C(=C1)O)O MCULE-9007618991 [1,1,0,0,0,0|1,0,1]=4 1804 B13R1.511 NC1=C(C=CC(=C1)C=CC(=O)O)Cl MCULE-1654219778 [1,1,0,0,0,0|1,0,1]=4 1805 B13R1.511 NC1=C(C=CC(=C1)CCC(=O)O)O MCULE-5447737067 [1,1,0,0,0,0|0,0,1]=3 1806 B13R1.511 NC1=CC(=CC=C1Br)CCC(=O)O MCULE-3775547039 [1,1,0,0,0,0|1,0,1]=4 1807 B13R1.511 NC1=CC=C(C=C1Cl)C=CC(=O)O MCULE-6975721435 [1,1,0,0,0,0|1,0,1]=4 1808 B13R1.511 O=C(O)/C=C/C1=CC(=C(C=C1)Cl)F MCULE-5576902212 [1,1,0,0,0,0|1,0,1]=4 1809 B13R1.511 O=C(O)/C=C/C1=CC(=C(C=C1)F)F MCULE-3234178172 [1,1,0,0,0,0|1,0,1]=4 1810 B13R1.511 O=C(O)/C=C/C1=CC(=C(C=C1)O)Br MCULE-7396580804 [1,1,0,0,0,0|0,0,1]=3 1811 B13R1.511 O=C(O)/C=C/C1=CC=C(C(=C1)Br)F MCULE-2729340184 [1,1,0,0,0,0|1,0,1]=4 1812 B13R1.511 O=C(O)/C=C/C1=CC=C(C(=C1)Cl)Cl MCULE-8962863133 [1,1,0,0,0,0|1,0,1]=4 1813 B13R1.511 O=C(O)/C=C/C1=CC=C(C(=C1)Cl)F MCULE-2895897404 [1,1,0,0,0,0|1,0,1]=4 1814 B13R1.511 O=C(O)/C=C/C1=CC=C(C(=C1)F)Br MCULE-3222597984 [1,1,0,0,0,0|1,0,1]=4 1815 B13R1.511 O=C(O)/C=C/C1=CC=C(C(=C1)O)Cl MCULE-3292670858 [1,1,0,0,0,0|1,0,1]=4 1816 B13R1.511 O=C(O)/C=C/C1=CC=C(C(=C1)O)O MCULE-7843599914 [1,1,0,0,0,0|0,0,1]=3 1817 B13R1.511 O=C(O)/C=C\C1=CC=C(C(=C1)O)O MCULE-3932376334 [1,1,0,0,0,0|0,0,1]=3 1818 B13R1.511 O=C(O)C=CC1=CC(=C(C=C1)Br)Cl MCULE-5185847063 [1,1,0,0,0,0|1,0,1]=4 1819 B13R1.511 O=C(O)C=CC1=CC(=C(C=C1)Cl)Cl MCULE-1205886577 [1,1,0,0,0,0|1,0,1]=4 1820 B13R1.511 O=C(O)C=CC1=CC(=C(C=C1)F)Cl MCULE-3526170057 [1,1,0,0,0,0|1,0,1]=4 1821 B13R1.511 O=C(O)C=CC1=CC(=C(C=C1)O)Br MCULE-9742346554 [1,1,0,0,0,0|0,0,1]=3 1822 B13R1.511 O=C(O)C=CC1=CC=C(C(=C1)Br)F MCULE-2097187879 [1,1,0,0,0,0|1,0,1]=4 1823 B13R1.511 O=C(O)C=CC1=CC=C(C(=C1)Cl)O MCULE-4338551904 [1,1,0,0,0,0|0,0,1]=3 1824 B13R1.511 O=C(O)C=CC1=CC=C(C(=C1)F)Br MCULE-1588801458 [1,1,0,0,0,0|1,0,1]=4 1825 B13R1.511 O=C(O)C=CC1=CC=C(C(=C1)F)Cl MCULE-9971364851 [1,1,0,0,0,0|1,0,1]=4 1826 B13R1.511 O=C(O)C=CC1=CC=C(C(=C1)F)F MCULE-9113864590 [1,1,0,0,0,0|1,0,1]=4 1827 B13R1.511 O=C(O)C=CC1=CC=C(C(=C1)F)O MCULE-8266589882 [1,1,0,0,0,0|0,0,1]=3 1828 B13R1.511 O=C(O)C=CC1=CC=C(C(=C1)O)O MCULE-2069871168 [1,1,0,0,0,0|0,0,1]=3 1829 B13R1.511 O=C(O)CCC1=CC(=C(C=C1)Br)Cl MCULE-2058184264 [1,1,0,0,0,0|1,0,1]=4 1830 B13R1.511 O=C(O)CCC1=CC(=C(C=C1)Cl)Cl MCULE-6356184282 [1,1,0,0,0,0|1,0,1]=4 1831 B13R1.511 O=C(O)CCC1=CC(=C(C=C1)Cl)F MCULE-2041860695 [1,1,0,0,0,0|1,0,1]=4 1832 B13R1.511 O=C(O)CCC1=CC(=C(C=C1)F)Cl MCULE-2045173249 [1,1,0,0,0,0|1,0,1]=4 1833 B13R1.511 O=C(O)CCC1=CC(=C(C=C1)F)F MCULE-8785469868 [1,1,0,0,0,0|1,0,1]=4 1834 B13R1.511 O=C(O)CCC1=CC(=C(C=C1)O)Br MCULE-7229181192 [1,1,0,0,0,0|0,0,1]=3 1835 B13R1.511 O=C(O)CCC1=CC(=C(C=C1)O)Cl MCULE-4283987039 [1,1,0,0,0,0|0,0,1]=3 1836 B13R1.511 O=C(O)CCC1=CC(=C(C=C1)O)F MCULE-8491503229 [1,1,0,0,0,0|0,0,1]=3 1837 B13R1.511 O=C(O)CCC1=CC=C(C(=C1)Br)Cl MCULE-3510621934 [1,1,0,0,0,0|1,0,1]=4 1838 B13R1.511 O=C(O)CCC1=CC=C(C(=C1)Br)F MCULE-4528970991 [1,1,0,0,0,0|1,0,1]=4 1839 B13R1.511 O=C(O)CCC1=CC=C(C(=C1)F)Br MCULE-2316980738 [1,1,0,0,0,0|1,0,1]=4 1840 B13R1.511 O=C(O)CCC1=CC=C(C(=C1)O)O MCULE-4912045197 [1,1,0,0,0,0|0,0,1]=3 1841 B13R1.135 C/C(=N\O)/C(=O)C[N+]1=CC=CC=C1 MCULE-3634867436 [1,1,0,0,0,0|2,0,0]=4 1842 B13R1.135 C/C(=N\O)/C(=O)C[N+]1=CC=CC=C1 MCULE-7508834206 [1,1,0,0,0,0|2,0,0]=4 1843 B13R1.135 C=C(CC1=CC=CC=C1)C(=O)OC MCULE-6213626819 [1,1,0,0,0,0|1,0,0]=3 1844 B13R1.135 CC(=NO)C(=O)NC1=CC=CC=C1 MCULE-8303131279 [1,1,0,0,0,0|2,0,0]=4 1845 B13R1.135 CNC(=O)C(=O)NC1=CC=CC=C1 MCULE-5016497629 [1,1,0,0,0,0|2,0,0]=4 1846 B13R1.135 COC(=O)/C(=C/C1=CC=CC=C1)/C MCULE-9820806938 [1,1,0,0,0,0|1,0,1]=4 1847 B13R1.135 COC(=O)C(=CC1=CC=CC=C1)Br MCULE-8022955416 [1,1,0,0,0,0|1,0,1]=4 1848 B13R1.135 COC(=O)C(=CC1=CC=CC=C1)C MCULE-9909014796 [1,1,0,0,0,0|1,0,1]=4 1849 B13R1.135 COC(=O)C(Br)CC1=CC=CC=C1 MCULE-1727282438 [1,1,0,0,0,0|1,0,1]=4 1850 B13R1.135 COC(=O)C(C)CC1=CC=CC=C1 MCULE-3514867680 [1,1,0,0,0,0|1,0,1]=4 1851 B13R1.135 COC(=O)C(Cl)CC1=CC=CC=C1 MCULE-7069297422 [1,1,0,0,0,0|1,0,1]=4 1852 B13R1.135 COC(=O)C(N)CC1=CC=CC=C1 MCULE-2582237555 [1,1,0,0,0,0|1,0,1]=4 1853 B13R1.135 COC(=O)C(N)CC1=CC=CC=C1 MCULE-3332878876 [1,1,0,0,0,0|1,0,1]=4 1854 B13R1.135 COC(=O)C(N)CC1=CC=CC=C1 MCULE-8835211261 [1,1,0,0,0,0|1,0,1]=4 1855 B13R1.135 COC(=O)C(O)CC1=CC=CC=C1 MCULE-6031932659 [1,1,0,0,0,0|0,0,2]=4 1856 B13R1.135 COC(=O)C(O)CC1=CC=CC=C1 MCULE-9590442554 [1,1,0,0,0,0|0,0,2]=4 1857 B13R1.135 COC(=O)C([NH3+])CC1=CC=CC=C1 MCULE-1626074104 [1,1,0,0,0,0|1,0,1]=4 1858 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-4108104134 [1,1,0,0,0,0|1,0,1]=4 1859 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-5129708210 [1,1,0,0,0,0|1,0,1]=4 1860 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-5580078035 [1,1,0,0,0,0|1,0,1]=4 1861 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 MCULE-8316158523 [1,1,0,0,0,0|1,0,1]=4 1862 B13R1.135 COC(=O)[C@@H](O)CC1=CC=CC=C1 MCULE-1258210976 [1,1,0,0,0,0|0,0,2]=4 1863 B13R1.135 COC(=O)[C@@H](O)CC1=CC=CC=C1 MCULE-5761303799 [1,1,0,0,0,0|0,0,2]=4 1864 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-1447476278 [1,1,0,0,0,0|1,0,1]=4 1865 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-2751110672 [1,1,0,0,0,0|1,0,1]=4 1866 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-3397498089 [1,1,0,0,0,0|1,0,1]=4 1867 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 MCULE-7887773710 [1,1,0,0,0,0|1,0,1]=4 1868 B13R1.135 COC(=O)[C@H](O)CC1=CC=CC=C1 MCULE-7480874576 [1,1,0,0,0,0|0,0,2]=4 1869 B13R1.135 COC(=O)[C@H](O)CC1=CC=CC=C1 MCULE-8892812779 [1,1,0,0,0,0|0,0,2]=4 1870 B13R1.135 CON(C)C(=O)CC1=CC=CC=C1 MCULE-7609137564 [1,1,0,0,0,0|2,0,0]=4 1871 B13R1.135 NNC(=O)C(=O)NC1=CC=CC=C1 MCULE-4216628118 [1,1,0,0,0,0|2,0,0]=4 1872 B13R1.135 O=C(CCl)C(=O)NC1=CC=CC=C1 MCULE-1165881866 [1,1,0,0,0,0|2,0,0]=4 1873 B13R1.148 CC(=CC1=CC(=CC=C1)Cl)C(=O)O MCULE-4849400009 [1,1,0,0,0,0|1,0,1]=4 1874 B13R1.148 CC(=O)C(=O)CC1=CC(=CC=C1)F MCULE-1998156165 [1,1,0,0,0,0|1,0,0]=3 1875 B13R1.148 CC(CC1=CC(=CC=C1)Cl)C(=O)O MCULE-6477232957 [1,1,0,0,0,0|1,0,1]=4 1876 B13R1.148 CC(CC1=CC(=CC=C1)F)C(=O)O MCULE-2517739295 [1,1,0,0,0,0|1,0,1]=4 1877 B13R1.148 CC(CC1=CC=CC(=C1)Br)C(=O)O MCULE-5772259355 [1,1,0,0,0,0|1,0,1]=4 1878 B13R1.148 CC(CC1=CC=CC(=C1)I)C(=O)O MCULE-8176960531 [1,1,0,0,0,0|1,0,1]=4 1879 B13R1.148 CC1=CC(=CC=C1)CC(N)C(=O)O MCULE-1997175050 [1,1,0,0,0,0|1,0,1]=4 1880 B13R1.148 CC1=CC(=CC=C1)CC(N)C(=O)O MCULE-9587136551 [1,1,0,0,0,0|1,0,1]=4 1881 B13R1.148 CC1=CC(=CC=C1)C[C@@H](N)C(=O)O MCULE-8447730242 [1,1,0,0,0,0|1,0,1]=4 1882 B13R1.148 CC1=CC(=CC=C1)C[C@H](N)C(=O)O MCULE-5228247053 [1,1,0,0,0,0|1,0,1]=4 1883 B13R1.148 CC1=CC(=CC=C1)C[C@H](N)C(=O)O MCULE-8475369617 [1,1,0,0,0,0|1,0,1]=4 1884 B13R1.148 CC1=CC(=CC=C1)NC(=O)C(=O)N MCULE-3778424048 [1,1,0,0,0,0|2,0,0]=4 1885 B13R1.148 CC1=CC(=CC=C1)NC(=O)C(=O)O MCULE-3978634658 [1,1,0,0,0,0|1,0,0]=3 1886 B13R1.148 CC1=CC=CC(=C1)CC(C)C(=O)O MCULE-8982907611 [1,1,0,0,0,0|1,0,1]=4 1887 B13R1.148 CC1=CC=CC(=C1)CC(N)C(=O)O MCULE-1770281237 [1,1,0,0,0,0|1,0,1]=4 1888 B13R1.148 CC1=CC=CC(=C1)C[C@@H](N)C(=O)O MCULE-8538987390 [1,1,0,0,0,0|1,0,1]=4 1889 B13R1.148 CC1=CC=CC(=N1)NC(=O)C(=O)O MCULE-8579730950 [1,1,0,0,0,0|2,0,0]=4 1890 B13R1.148 NC(=O)C(=O)NC1=CC(=CC=C1)N MCULE-2077500537 [1,1,0,0,0,0|2,0,0]=4 1891 B13R1.148 NC(=O)C(=O)NC1=CC(=CC=C1)O MCULE-7509959946 [1,1,0,0,0,0|2,0,0]=4 1892 B13R1.148 NC(CC1=CC(=CC=C1)Br)C(=O)O MCULE-2348274001 [1,1,0,0,0,0|1,0,1]=4 1893 B13R1.148 NC(CC1=CC(=CC=C1)Br)C(=O)O MCULE-6147884206 [1,1,0,0,0,0|1,0,1]=4 1894 B13R1.148 NC(CC1=CC(=CC=C1)Cl)C(=O)O MCULE-1289187602 [1,1,0,0,0,0|1,0,1]=4 1895 B13R1.148 NC(CC1=CC(=CC=C1)Cl)C(=O)O MCULE-8409034063 [1,1,0,0,0,0|1,0,1]=4 1896 B13R1.148 NC(CC1=CC(=CC=C1)F)C(=O)O MCULE-3048081903 [1,1,0,0,0,0|1,0,1]=4 1897 B13R1.148 NC(CC1=CC(=CC=C1)I)C(=O)O MCULE-4400986534 [1,1,0,0,0,0|1,0,1]=4 1898 B13R1.148 NC(CC1=CC(=CC=C1)O)C(=O)O MCULE-1682126004 [1,1,0,0,0,0|1,0,1]=4 1899 B13R1.148 NC(CC1=CC(=CC=C1)O)C(=O)O MCULE-1870924489 [1,1,0,0,0,0|1,0,1]=4 1900 B13R1.148 NC(CC1=CC=CC(=C1)Br)C(=O)O MCULE-8007269772 [1,1,0,0,0,0|1,0,1]=4 1901 B13R1.148 NC(CC1=CC=CC(=C1)Cl)C(=O)O MCULE-1743986990 [1,1,0,0,0,0|1,0,1]=4 1902 B13R1.148 NC(CC1=CC=CC(=C1)Cl)C(=O)O MCULE-6477168764 [1,1,0,0,0,0|1,0,1]=4 1903 B13R1.148 NC(CC1=CC=CC(=C1)F)C(=O)O MCULE-1037840303 [1,1,0,0,0,0|1,0,1]=4 1904 B13R1.148 NC(CC1=CC=CC(=C1)F)C(=O)O MCULE-1978574097 [1,1,0,0,0,0|1,0,1]=4 1905 B13R1.148 NC(CC1=CC=CC(=C1)O)C(=O)O MCULE-7197195437 [1,1,0,0,0,0|1,0,1]=4 1906 B13R1.148 NC1=CC(=CC=C1)CC(N)C(=O)O MCULE-2467932131 [1,1,0,0,0,0|1,0,1]=4 1907 B13R1.148 NC1=CC(=CC=C1)CC(N)C(=O)O MCULE-5537013080 [1,1,0,0,0,0|1,0,1]=4 1908 B13R1.148 NC1=CC(=CC=C1)C[C@H](N)C(=O)O MCULE-2052828414 [1,1,0,0,0,0|1,0,1]=4 1909 B13R1.148 NC1=CC(=CC=C1)C[C@H](N)C(=O)O MCULE-2924867217 [1,1,0,0,0,0|1,0,1]=4 1910 B13R1.148 NC1=CC(=CC=C1)C[C@H](N)C(=O)O MCULE-5878731697 [1,1,0,0,0,0|1,0,1]=4 1911 B13R1.148 NC1=CC(=CC=C1)C[C@H](N)C(=O)O MCULE-8248386535 [1,1,0,0,0,0|1,0,1]=4 1912 B13R1.148 NC1=CC=CC(=C1)CC(N)C(=O)O MCULE-6788793962 [1,1,0,0,0,0|1,0,1]=4 1913 B13R1.148 NC1=CC=CC(=C1)CC(N)C(=O)O MCULE-7989672916 [1,1,0,0,0,0|1,0,1]=4 1914 B13R1.148 NC1=CC=CC(=C1)NC(=O)C(=O)O MCULE-8856902244 [1,1,0,0,0,0|1,0,0]=3 1915 B13R1.148 N[C@@H](CC1=CC(=CC=C1)Br)C(=O)O MCULE-3495438482 [1,1,0,0,0,0|1,0,1]=4 1916 B13R1.148 N[C@@H](CC1=CC(=CC=C1)Cl)C(=O)O MCULE-9561585574 [1,1,0,0,0,0|1,0,1]=4 1917 B13R1.148 N[C@@H](CC1=CC(=CC=C1)O)C(=O)O MCULE-2356956274 [1,1,0,0,0,0|1,0,1]=4 1918 B13R1.148 N[C@@H](CC1=CC=CC(=C1)Br)C(=O)O MCULE-1686064373 [1,1,0,0,0,0|1,0,1]=4 1919 B13R1.148 N[C@@H](CC1=CC=CC(=C1)Br)C(=O)O MCULE-4183003026 [1,1,0,0,0,0|1,0,1]=4 1920 B13R1.148 N[C@@H](CC1=CC=CC(=C1)Cl)C(=O)O MCULE-5029761730 [1,1,0,0,0,0|1,0,1]=4 1921 B13R1.148 N[C@@H](CC1=CC=CC(=C1)Cl)C(=O)O MCULE-6284927524 [1,1,0,0,0,0|1,0,1]=4 1922 B13R1.148 N[C@@H](CC1=CC=CC(=C1)Cl)C(=O)O MCULE-9100547203 [1,1,0,0,0,0|1,0,1]=4 1923 B13R1.148 N[C@@H](CC1=CC=CC(=C1)F)C(=O)O MCULE-7481903657 [1,1,0,0,0,0|1,0,1]=4 1924 B13R1.148 N[C@@H](CC1=CC=CC(=C1)F)C(=O)O MCULE-8671021032 [1,1,0,0,0,0|1,0,1]=4 1925 B13R1.148 N[C@@H](CC1=CC=CC(=C1)I)C(=O)O MCULE-6787387564 [1,1,0,0,0,0|1,0,1]=4 1926 B13R1.148 N[C@@H](CC1=CC=CC(=C1)I)C(=O)O MCULE-8633614286 [1,1,0,0,0,0|1,0,1]=4 1927 B13R1.148 N[C@@H](CC1=CC=CC(=C1)O)C(=O)O MCULE-2174973339 [1,1,0,0,0,0|1,0,1]=4 1928 B13R1.148 N[C@@H](CC1=CC=CC(=C1)O)C(=O)O MCULE-6923480945 [1,1,0,0,0,0|1,0,1]=4 1929 B13R1.148 N[C@@H](CC1=CC=CC(=C1)O)C(=O)O MCULE-8483193639 [1,1,0,0,0,0|1,0,1]=4 1930 B13R1.148 N[C@H](CC1=CC(=CC=C1)O)C(=O)O MCULE-4455335179 [1,1,0,0,0,0|1,0,1]=4 1931 B13R1.148 N[C@H](CC1=CC(=CC=C1)O)C(=O)O MCULE-6512619298 [1,1,0,0,0,0|1,0,1]=4 1932 B13R1.148 N[C@H](CC1=CC=CC(=C1)Br)C(=O)O MCULE-6055691240 [1,1,0,0,0,0|1,0,1]=4 1933 B13R1.148 N[C@H](CC1=CC=CC(=C1)Br)C(=O)O MCULE-8797288798 [1,1,0,0,0,0|1,0,1]=4 1934 B13R1.148 N[C@H](CC1=CC=CC(=C1)Cl)C(=O)O MCULE-5153208600 [1,1,0,0,0,0|1,0,1]=4 1935 B13R1.148 N[C@H](CC1=CC=CC(=C1)Cl)C(=O)O MCULE-7991505295 [1,1,0,0,0,0|1,0,1]=4 1936 B13R1.148 N[C@H](CC1=CC=CC(=C1)F)C(=O)O MCULE-2189181945 [1,1,0,0,0,0|1,0,1]=4 1937 B13R1.148 N[C@H](CC1=CC=CC(=C1)F)C(=O)O MCULE-5152700511 [1,1,0,0,0,0|1,0,1]=4 1938 B13R1.148 N[C@H](CC1=CC=CC(=C1)I)C(=O)O MCULE-1640787822 [1,1,0,0,0,0|1,0,1]=4 1939 B13R1.148 N[C@H](CC1=CC=CC(=C1)I)C(=O)O MCULE-7721290088 [1,1,0,0,0,0|1,0,1]=4 1940 B13R1.148 O=C(O)C(=O)CC1=CC(=CC=C1)Br MCULE-6912901512 [1,1,0,0,0,0|0,0,0]=2 1941 B13R1.148 O=C(O)C(=O)CC1=CC(=CC=C1)Cl MCULE-8954054015 [1,1,0,0,0,0|0,0,0]=2 1942 B13R1.148 O=C(O)C(=O)CC1=CC=CC(=C1)F MCULE-1232211184 [1,1,0,0,0,0|0,0,0]=2 1943 B13R1.148 O=C(O)C(=O)CC1=CC=CC(=C1)O MCULE-1866756519 [1,1,0,0,0,0|0,0,0]=2 1944 B13R1.148 O=C(O)C(=O)NC1=CC=CC(=C1)Cl MCULE-5746099316 [1,1,0,0,0,0|1,0,0]=3 1945 B13R1.148 O=C(O)C(=O)NC1=CC=CC(=C1)F MCULE-9012310030 [1,1,0,0,0,0|1,0,0]=3 1946 B13R1.148 O=C(O)C(=S)CC1=CC(=CC=C1)O MCULE-6498936138 [1,1,0,0,0,0|0,1,0]=3 1947 B13R1.148 O=C(O)C(O)CC1=CC(=CC=C1)Br MCULE-3046403950 [1,1,0,0,0,0|0,0,2]=4 1948 B13R1.148 O=C(O)C(O)CC1=CC(=CC=C1)Cl MCULE-9442017506 [1,1,0,0,0,0|0,0,2]=4 1949 B13R1.148 O=C(O)C(O)CC1=CC(=CC=C1)F MCULE-2359914332 [1,1,0,0,0,0|0,0,2]=4 1950 B13R1.148 O=C(O)C(O)CC1=CC(=CC=C1)O MCULE-6217953446 [1,1,0,0,0,0|0,0,2]=4 1951 B13R1.148 O=C(O)[C@@H](O)CC1=CC=CC(=C1)F MCULE-4562223673 [1,1,0,0,0,0|0,0,2]=4 1952 B13R1.148 O=C(O)[C@@H](O)CC1=CC=CC(=C1)F MCULE-7772826280 [1,1,0,0,0,0|0,0,2]=4 1953 B13R1.148 O=C(O)[C@H](O)CC1=CC=CC(=C1)Br MCULE-5782934287 [1,1,0,0,0,0|0,0,2]=4 1954 B13R1.152 C=C(C(=O)C)C(O)C1=CC=CC=C1 MCULE-4317786730 [1,1,0,0,0,0|2,0,0]=4 1955 B13R1.152 CC(C(=O)O)C(N)C1=CC=CC=C1 MCULE-4471810169 [1,1,0,0,0,0|1,0,1]=4 1956 B13R1.152 CC(C(=O)O)C(N)C1=CC=CC=C1 MCULE-9697052753 [1,1,0,0,0,0|1,0,1]=4 1957 B13R1.152 CC(C1=CC=CC=C1)C(N)C(=O)O MCULE-8491955673 [1,1,0,0,0,0|1,0,1]=4 1958 B13R1.152 CC(C1=CC=CC=C1)C(N)C(=O)O MCULE-9701727761 [1,1,0,0,0,0|1,0,1]=4 1959 B13R1.152 CC(C1=CC=CC=C1)C(O)C(=O)O MCULE-2096048463 [1,1,0,0,0,0|0,0,2]=4 1960 B13R1.152 CC(C1=CC=CC=C1)[C@H](N)C(=O)O MCULE-5202341879 [1,1,0,0,0,0|1,0,1]=4 1961 B13R1.152 CN(C(=O)C(=O)O)C1=CC=CC=C1 MCULE-2797491080 [1,1,0,0,0,0|1,0,0]=3 1962 B13R1.152 C[C@@H](C1=CC=CC=C1)[C@@H](N)C(=O)O MCULE-3296564620 [1,1,0,0,0,0|1,0,1]=4 1963 B13R1.152 C[C@@H](C1=CC=CC=C1)[C@@H](N)C(=O)O MCULE-5770222064 [1,1,0,0,0,0|1,0,1]=4 1964 B13R1.152 C[C@@H](C1=CC=CC=C1)[C@H](N)C(=O)O MCULE-8614292304 [1,1,0,0,0,0|1,0,1]=4 1965 B13R1.152 C[C@@H](C1=CC=CC=C1)[C@H](N)C(=O)O MCULE-8697326618 [1,1,0,0,0,0|1,0,1]=4 1966 B13R1.152 C[C@H](C(=O)O)[C@H](O)C1=CC=CC=C1 MCULE-5479131562 [1,1,0,0,0,0|1,0,1]=4 1967 B13R1.152 C[C@H](C1=CC=CC=C1)[C@@H](N)C(=O)O MCULE-8687654257 [1,1,0,0,0,0|1,0,1]=4 1968 B13R1.152 C[C@H](C1=CC=CC=C1)[C@@H](N)C(=O)O MCULE-9499293392 [1,1,0,0,0,0|1,0,1]=4 1969 B13R1.152 C[C@H](C1=CC=CC=C1)[C@H](N)C(=O)O MCULE-1845048066 [1,1,0,0,0,0|1,0,1]=4 1970 B13R1.152 C[C@H](C1=CC=CC=C1)[C@H](N)C(=O)O MCULE-9752844525 [1,1,0,0,0,0|1,0,1]=4 1971 B13R1.152 NC(C(=O)O)C(Cl)C1=CC=CC=C1 MCULE-2618772778 [1,1,0,0,0,0|1,0,1]=4 1972 B13R1.152 NC(C(=O)O)C(O)C1=CC=CC=C1 MCULE-3348967519 [1,1,0,0,0,0|1,0,1]=4 1973 B13R1.152 NC(C(=O)O)C(O)C1=CC=CC=C1 MCULE-4051921601 [1,1,0,0,0,0|1,0,1]=4 1974 B13R1.152 NC(C1=CC=CC=C1)C(O)C(=O)O MCULE-2719281342 [1,1,0,0,0,0|0,0,2]=4 1975 B13R1.152 NC(C1=CC=CC=C1)C(O)C(=O)O MCULE-5123619879 [1,1,0,0,0,0|0,0,2]=4 1976 B13R1.152 N[C@@H](C(=O)O)[C@@H](O)C1=CC=CC=C1 MCULE-6532492719 [1,1,0,0,0,0|1,0,1]=4 1977 B13R1.152 N[C@@H](C(=O)O)[C@H](O)C1=CC=CC=C1 MCULE-7686375522 [1,1,0,0,0,0|1,0,1]=4 1978 B13R1.152 N[C@@H](C1=CC=CC=C1)[C@@H](O)C(=O)O MCULE-2183846050 [1,1,0,0,0,0|0,0,2]=4 1979 B13R1.152 N[C@@H](C1=CC=CC=C1)[C@@H](O)C(=O)O MCULE-3688029768 [1,1,0,0,0,0|0,0,2]=4 1980 B13R1.152 N[C@@H](C1=CC=CC=C1)[C@@H](O)C(=O)O MCULE-3819078710 [1,1,0,0,0,0|0,0,2]=4 1981 B13R1.152 N[C@@H](C1=CC=CC=C1)[C@@H](O)C(=O)O MCULE-5219240474 [1,1,0,0,0,0|0,0,2]=4 1982 B13R1.152 N[C@@H](C1=CC=CC=C1)[C@@H](O)C(=O)O MCULE-6868554139 [1,1,0,0,0,0|0,0,2]=4 1983 B13R1.152 N[C@@H](C1=CC=CC=C1)[C@@H](O)C(=O)O MCULE-7992078018 [1,1,0,0,0,0|0,0,2]=4 1984 B13R1.152 N[C@@H](C1=CC=CC=C1)[C@H](O)C(=O)O MCULE-9060327137 [1,1,0,0,0,0|0,0,2]=4 1985 B13R1.152 N[C@H](C(=O)O)[C@@H](O)C1=CC=CC=C1 MCULE-3533562532 [1,1,0,0,0,0|1,0,1]=4 1986 B13R1.152 N[C@H](C(=O)O)[C@H](O)C1=CC=CC=C1 MCULE-7276106585 [1,1,0,0,0,0|1,0,1]=4 1987 B13R1.152 N[C@H](C(=O)O)[C@H](O)C1=CC=CC=C1 MCULE-7798579567 [1,1,0,0,0,0|1,0,1]=4 1988 B13R1.152 N[C@H](C1=CC=CC=C1)[C@@H](O)C(=O)O MCULE-3650949263 [1,1,0,0,0,0|0,0,2]=4 1989 B13R1.152 N[C@H](C1=CC=CC=C1)[C@@H](O)C(=O)O MCULE-8610185053 [1,1,0,0,0,0|0,0,2]=4 1990 B13R1.152 N[C@H](C1=CC=CC=C1)[C@H](O)C(=O)O MCULE-5142392737 [1,1,0,0,0,0|0,0,2]=4 1991 B13R1.152 O=C(O)C(Br)C(Br)C1=CC=CC=C1 MCULE-2104980401 [1,1,0,0,0,0|1,0,1]=4 1992 B13R1.152 O=C(O)C(O)C(O)C1=CC=CC=C1 MCULE-7246952508 [1,1,0,0,0,0|0,0,2]=4 1993 B13R1.152 [C@@H](N)(C1=CC=CC=C1)[C@@H](O)C(=O)O MCULE-4071607168 [1,1,0,0,0,0|0,0,2]=4 1994 B13R1.202 CC(=CC1=C(C=CC=C1)Cl)C(=O)O MCULE-1555061198 [1,1,0,0,0,0|1,0,1]=4 1995 B13R1.202 CC(=CC1=C(C=CC=C1)F)C(=O)O MCULE-6968839763 [1,1,0,0,0,0|1,0,1]=4 1996 B13R1.202 CC(=O)C(=O)CC1=C(C=CC=C1)F MCULE-3380026143 [1,1,0,0,0,0|1,0,0]=3 1997 B13R1.202 CC(=O)C(=O)NC1=C(C=CC=C1)C MCULE-5710100372 [1,1,0,0,0,0|2,0,0]=4 1998 B13R1.202 CC(CC1=C(C=CC=C1)Br)C(=O)O MCULE-5369615416 [1,1,0,0,0,0|1,0,1]=4 1999 B13R1.202 CC(CC1=C(C=CC=C1)Cl)C(=O)O MCULE-1157893995 [1,1,0,0,0,0|1,0,1]=4 2000 B13R1.202 CC(CC1=C(C=CC=C1)F)C(=O)O MCULE-3357333139 [1,1,0,0,0,0|1,0,1]=4 2001 B13R1.202 CC1=C(C=CC=C1)CC(C)C(=O)O MCULE-2487760745 [1,1,0,0,0,0|1,0,1]=4 2002 B13R1.202 CC1=C(C=CC=C1)CC(N)C(=O)O MCULE-3928457353 [1,1,0,0,0,0|1,0,1]=4 2003 B13R1.202 CC1=C(C=CC=C1)CC(N)C(=O)O MCULE-4728915963 [1,1,0,0,0,0|1,0,1]=4 2004 B13R1.202 CC1=C(C=CC=C1)CC(N)C(=O)O MCULE-9582945892 [1,1,0,0,0,0|1,0,1]=4 2005 B13R1.202 CC1=C(C=CC=C1)C[C@@H](N)C(=O)O MCULE-7777290104 [1,1,0,0,0,0|1,0,1]=4 2006 B13R1.202 CC1=CC=CC=C1C[C@@H](N)C(=O)O MCULE-3139735845 [1,1,0,0,0,0|1,0,1]=4 2007 B13R1.202 CC1=CC=CC=C1C[C@H](N)C(=O)O MCULE-4423394672 [1,1,0,0,0,0|1,0,1]=4 2008 B13R1.202 CC1=CC=CC=C1C[C@H](N)C(=O)O MCULE-8459527082 [1,1,0,0,0,0|1,0,1]=4 2009 B13R1.202 CC1=CC=CC=C1NC(=O)C(=O)O MCULE-4521627182 [1,1,0,0,0,0|1,0,0]=3 2010 B13R1.202 NC(=O)C(=O)NC1=CC=CC=C1Cl MCULE-5643168560 [1,1,0,0,0,0|2,0,0]=4 2011 B13R1.202 NC(=O)C(=O)NC1=CC=CC=C1F MCULE-1250177509 [1,1,0,0,0,0|2,0,0]=4 2012 B13R1.202 NC(CC1=C(C=CC=C1)Br)C(=O)O MCULE-5724659686 [1,1,0,0,0,0|1,0,1]=4 2013 B13R1.202 NC(CC1=C(C=CC=C1)Br)C(=O)O MCULE-8657034756 [1,1,0,0,0,0|1,0,1]=4 2014 B13R1.202 NC(CC1=C(C=CC=C1)Cl)C(=O)O MCULE-1003643925 [1,1,0,0,0,0|1,0,1]=4 2015 B13R1.202 NC(CC1=C(C=CC=C1)Cl)C(=O)O MCULE-5234125993 [1,1,0,0,0,0|1,0,1]=4 2016 B13R1.202 NC(CC1=C(C=CC=C1)F)C(=O)O MCULE-1643139482 [1,1,0,0,0,0|1,0,1]=4 2017 B13R1.202 NC(CC1=C(C=CC=C1)F)C(=O)O MCULE-8132487617 [1,1,0,0,0,0|1,0,1]=4 2018 B13R1.202 NC(CC1=C(C=CC=C1)O)C(=O)O MCULE-2760582536 [1,1,0,0,0,0|1,0,1]=4 2019 B13R1.202 NC(CC1=C(C=CC=C1)O)C(=O)O MCULE-3181624921 [1,1,0,0,0,0|1,0,1]=4 2020 B13R1.202 NC(CC1=CC=CC=C1Br)C(=O)O MCULE-4720569207 [1,1,0,0,0,0|1,0,1]=4 2021 B13R1.202 NC(CC1=CC=CC=C1I)C(=O)O MCULE-5831466387 [1,1,0,0,0,0|1,0,1]=4 2022 B13R1.202 NC(CC1=CC=CC=C1O)C(=O)O MCULE-3693150441 [1,1,0,0,0,0|1,0,1]=4 2023 B13R1.202 NC(CC1=CC=CC=C1O)C(=O)O MCULE-8522650891 [1,1,0,0,0,0|1,0,1]=4 2024 B13R1.202 NC1=CC=CC=C1CC(N)C(=O)O MCULE-7465695275 [1,1,0,0,0,0|1,0,1]=4 2025 B13R1.202 NC1=CC=CC=C1C[C@@H](N)C(=O)O MCULE-6308202600 [1,1,0,0,0,0|1,0,1]=4 2026 B13R1.202 NC1=CC=CC=C1C[C@H](N)C(=O)O MCULE-2066886177 [1,1,0,0,0,0|1,0,1]=4 2027 B13R1.202 N[C@@H](CC1=C(C=CC=C1)F)C(=O)O MCULE-5925880420 [1,1,0,0,0,0|1,0,1]=4 2028 B13R1.202 N[C@@H](CC1=C(C=CC=C1)I)C(=O)O MCULE-5539213577 [1,1,0,0,0,0|1,0,1]=4 2029 B13R1.202 N[C@@H](CC1=CC=CC=C1Br)C(=O)O MCULE-7720110968 [1,1,0,0,0,0|1,0,1]=4 2030 B13R1.202 N[C@@H](CC1=CC=CC=C1Br)C(=O)O MCULE-8611213892 [1,1,0,0,0,0|1,0,1]=4 2031 B13R1.202 N[C@@H](CC1=CC=CC=C1Cl)C(=O)O MCULE-4843973004 [1,1,0,0,0,0|1,0,1]=4 2032 B13R1.202 N[C@@H](CC1=CC=CC=C1Cl)C(=O)O MCULE-6583454610 [1,1,0,0,0,0|1,0,1]=4 2033 B13R1.202 N[C@@H](CC1=CC=CC=C1Cl)C(=O)O MCULE-8729370801 [1,1,0,0,0,0|1,0,1]=4 2034 B13R1.202 N[C@@H](CC1=CC=CC=C1F)C(=O)O MCULE-1023509436 [1,1,0,0,0,0|1,0,1]=4 2035 B13R1.202 N[C@@H](CC1=CC=CC=C1I)C(=O)O MCULE-1271250491 [1,1,0,0,0,0|1,0,1]=4 2036 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O MCULE-3324530063 [1,1,0,0,0,0|1,0,1]=4 2037 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O MCULE-4252485679 [1,1,0,0,0,0|1,0,1]=4 2038 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O MCULE-8738209502 [1,1,0,0,0,0|1,0,1]=4 2039 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O MCULE-9497377193 [1,1,0,0,0,0|1,0,1]=4 2040 B13R1.202 N[C@H](CC1=C(C=CC=C1)F)C(=O)O MCULE-2582515595 [1,1,0,0,0,0|1,0,1]=4 2041 B13R1.202 N[C@H](CC1=CC=CC=C1Br)C(=O)O MCULE-1182640112 [1,1,0,0,0,0|1,0,1]=4 2042 B13R1.202 N[C@H](CC1=CC=CC=C1Br)C(=O)O MCULE-7433575732 [1,1,0,0,0,0|1,0,1]=4 2043 B13R1.202 N[C@H](CC1=CC=CC=C1Cl)C(=O)O MCULE-2211654501 [1,1,0,0,0,0|1,0,1]=4 2044 B13R1.202 N[C@H](CC1=CC=CC=C1Cl)C(=O)O MCULE-7072462727 [1,1,0,0,0,0|1,0,1]=4 2045 B13R1.202 N[C@H](CC1=CC=CC=C1F)C(=O)O MCULE-2083626274 [1,1,0,0,0,0|1,0,1]=4 2046 B13R1.202 N[C@H](CC1=CC=CC=C1F)C(=O)O MCULE-3474904707 [1,1,0,0,0,0|1,0,1]=4 2047 B13R1.202 N[C@H](CC1=CC=CC=C1F)C(=O)O MCULE-4069544287 [1,1,0,0,0,0|1,0,1]=4 2048 B13R1.202 N[C@H](CC1=CC=CC=C1I)C(=O)O MCULE-1367493363 [1,1,0,0,0,0|1,0,1]=4 2049 B13R1.202 N[C@H](CC1=CC=CC=C1I)C(=O)O MCULE-5236102575 [1,1,0,0,0,0|1,0,1]=4 2050 B13R1.202 N[C@H](CC1=CC=CC=C1O)C(=O)O MCULE-2348504704 [1,1,0,0,0,0|1,0,1]=4 2051 B13R1.202 N[C@H](CC1=CC=CC=C1O)C(=O)O MCULE-8147742693 [1,1,0,0,0,0|1,0,1]=4 2052 B13R1.202 O=C(O)C(=O)CC1=CC=CC=C1Cl MCULE-3144815997 [1,1,0,0,0,0|0,0,0]=2 2053 B13R1.202 O=C(O)C(=O)NC1=CC=CC=C1Cl MCULE-7962863693 [1,1,0,0,0,0|1,0,0]=3 2054 B13R1.202 O=C(O)C(=O)NC1=CC=CC=C1F MCULE-5243407306 [1,1,0,0,0,0|1,0,0]=3 2055 B13R1.202 O=C(O)C(=O)NC1=CC=CC=C1O MCULE-1410097283 [1,1,0,0,0,0|1,0,0]=3 2056 B13R1.202 O=C(O)C(Br)CC1=C(C=CC=C1)Br MCULE-5032087774 [1,1,0,0,0,0|1,0,1]=4 2057 B13R1.202 O=C(O)C(Br)CC1=CC=CC=C1Cl MCULE-4038063637 [1,1,0,0,0,0|1,0,1]=4 2058 B13R1.202 O=C(O)C(Br)CC1=CC=CC=C1F MCULE-3940590279 [1,1,0,0,0,0|1,0,1]=4 2059 B13R1.202 O=C(O)C(O)CC1=C(C=CC=C1)Br MCULE-1533586444 [1,1,0,0,0,0|0,0,2]=4 2060 B13R1.202 O=C(O)C(O)CC1=C(C=CC=C1)Cl MCULE-2811622154 [1,1,0,0,0,0|0,0,2]=4 2061 B13R1.418 CCC(=CC1=CC=CC=C1)C(=O)O MCULE-3580301610 [1,1,0,0,0,0|1,0,1]=4 2062 B13R1.418 CCC(CC1=CC=CC=C1)C(=O)O MCULE-7383023006 [1,1,0,0,0,0|1,0,1]=4 2063 B13R1.418 CNC(CC1=CC=CC=C1)C(=O)O MCULE-3842005714 [1,1,0,0,0,0|1,0,1]=4 2064 B13R1.418 CNC(CC1=CC=CC=C1)C(=O)O MCULE-7025734622 [1,1,0,0,0,0|1,0,1]=4 2065 B13R1.418 CN[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-5892127646 [1,1,0,0,0,0|1,0,1]=4 2066 B13R1.418 CN[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-6660510193 [1,1,0,0,0,0|1,0,1]=4 2067 B13R1.418 CN[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-7617883459 [1,1,0,0,0,0|1,0,1]=4 2068 B13R1.418 CN[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-9210211125 [1,1,0,0,0,0|1,0,1]=4 2069 B13R1.418 CN[C@H](CC1=CC=CC=C1)C(=O)O MCULE-2038566174 [1,1,0,0,0,0|1,0,1]=4 2070 B13R1.418 CN[C@H](CC1=CC=CC=C1)C(=O)O MCULE-8805615196 [1,1,0,0,0,0|1,0,1]=4 2071 B13R1.418 CN[C@H](CC1=CC=CC=C1)C(=O)O MCULE-9690973894 [1,1,0,0,0,0|1,0,1]=4 2072 B13R1.418 COC(=CC1=CC=CC=C1)C(=O)O MCULE-7536643288 [1,1,0,0,0,0|0,0,2]=4 2073 B13R1.418 COC(CC1=CC=CC=C1)C(=O)O MCULE-9999723715 [1,1,0,0,0,0|0,0,2]=4 2074 B13R1.418 CO[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-9906113693 [1,1,0,0,0,0|0,0,2]=4 2075 B13R1.418 N#C/C(=C\C1=CC=CC=C1)/C(=O)O MCULE-3656092849 [1,1,0,0,0,0|1,0,1]=4 2076 B13R1.418 N#CC(=CC1=CC=CC=C1)C(=O)O MCULE-7845058902 [1,1,0,0,0,0|1,0,1]=4 2077 B13R1.418 N#CC(CC1=CC=CC=C1)C(=O)O MCULE-2489113249 [1,1,0,0,0,0|1,0,1]=4 2078 B13R1.418 NCC(CC1=CC=CC=C1)C(=O)O MCULE-3435928554 [1,1,0,0,0,0|1,0,1]=4 2079 B13R1.418 NCC(CC1=CC=CC=C1)C(=O)O MCULE-4710137264 [1,1,0,0,0,0|1,0,1]=4 2080 B13R1.418 NCC(CC1=CC=CC=C1)C(=O)O MCULE-5594566401 [1,1,0,0,0,0|1,0,1]=4 2081 B13R1.418 NCC(CC1=CC=CC=C1)C(=O)O MCULE-7040954795 [1,1,0,0,0,0|1,0,1]=4 2082 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-4543639508 [1,1,0,0,0,0|1,0,1]=4 2083 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-6429844971 [1,1,0,0,0,0|1,0,1]=4 2084 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-7718503080 [1,1,0,0,0,0|1,0,1]=4 2085 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-9663366424 [1,1,0,0,0,0|1,0,1]=4 2086 B13R1.418 NC[C@H](CC1=CC=CC=C1)C(=O)O MCULE-3343846707 [1,1,0,0,0,0|1,0,1]=4 2087 B13R1.418 NC[C@H](CC1=CC=CC=C1)C(=O)O MCULE-4830325742 [1,1,0,0,0,0|1,0,1]=4 2088 B13R1.418 NC[C@H](CC1=CC=CC=C1)C(=O)O MCULE-6363695814 [1,1,0,0,0,0|1,0,1]=4 2089 B13R1.418 NC[C@H](CC1=CC=CC=C1)C(=O)O MCULE-8977991880 [1,1,0,0,0,0|1,0,1]=4 2090 B13R1.418 NOC(CC1=CC=CC=C1)C(=O)O MCULE-2996535605 [1,1,0,0,0,0|0,0,2]=4 2091 B13R1.418 NOC(CC1=CC=CC=C1)C(=O)O MCULE-3251573694 [1,1,0,0,0,0|0,0,2]=4 2092 B13R1.418 NOC(CC1=CC=CC=C1)C(=O)O MCULE-5462822882 [1,1,0,0,0,0|0,0,2]=4 2093 B13R1.418 NO[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-2535668835 [1,1,0,0,0,0|0,0,2]=4 2094 B13R1.418 NO[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-6514153575 [1,1,0,0,0,0|0,0,2]=4 2095 B13R1.418 O=C(O)/C(=C\C1=CC=CC=C1)/CO MCULE-7935096095 [1,1,0,0,0,0|0,0,2]=4 2096 B13R1.418 O=C(O)C(=NO)CC1=CC=CC=C1 MCULE-1174934902 [1,1,0,0,0,0|0,0,1]=3 2097 B13R1.418 O=C(O)C(CO)CC1=CC=CC=C1 MCULE-8227526589 [1,1,0,0,0,0|0,0,2]=4 2098 B13R1.418 O=C(O)[C@@H](CO)CC1=CC=CC=C1 MCULE-6466727593 [1,1,0,0,0,0|0,0,2]=4 2099 B13R1.418 O=C(O)[C@@H](CO)CC1=CC=CC=C1 MCULE-9405740406 [1,1,0,0,0,0|0,0,2]=4 2100 B13R1.418 O=C(O)[C@H](CO)CC1=CC=CC=C1 MCULE-2746275491 [1,1,0,0,0,0|0,0,2]=4 2101 B13R1.1073 CC(C)(CC1=CC=CC=C1)C(=O)O MCULE-3089413335 [1,1,0,0,0,0|1,0,1]=4 2102 B13R1.1073 CC(N)(CC1=CC=CC=C1)C(=O)O MCULE-3264509800 [1,1,0,0,0,0|1,0,1]=4 2103 B13R1.1073 CC(N)(CC1=CC=CC=C1)C(=O)O MCULE-8062918187 [1,1,0,0,0,0|1,0,1]=4 2104 B13R1.1073 CC(O)(CC1=CC=CC=C1)C(=O)O MCULE-6210049820 [1,1,0,0,0,0|0,0,2]=4 2105 B13R1.1073 C[C@@](N)(CC1=CC=CC=C1)C(=O)O MCULE-6080134898 [1,1,0,0,0,0|1,0,1]=4 2106 B13R1.1073 C[C@@](N)(CC1=CC=CC=C1)C(=O)O MCULE-8126155759 [1,1,0,0,0,0|1,0,1]=4 2107 B13R1.1073 C[C@](N)(CC1=CC=CC=C1)C(=O)O MCULE-1833368325 [1,1,0,0,0,0|1,0,1]=4 2108 B13R1.1073 C[C@](N)(CC1=CC=CC=C1)C(=O)O MCULE-7774485933 [1,1,0,0,0,0|1,0,1]=4 2109 B13R1.1073 NC(O)(CC1=CC=CC=C1)C(=O)O MCULE-3023341284 [1,1,0,0,0,0|0,0,2]=4 2110 B13R1.1073 O=C(O)C(F)(F)CC1=CC=CC=C1 MCULE-9117160881 [1,1,0,0,0,0|1,0,1]=4 2111 B13R1.5 C=CC(=O)NC1=CC=C(C=C1)OC MCULE-7368207731 [1,1,0,0,0,0|2,0,0]=4 2112 B13R1.5 CCC(=O)CC1=CC=C(C=C1)OC MCULE-6341349104 [1,1,0,0,0,0|1,0,1]=4 2113 B13R1.5 CNC(=O)CC1=CC=C(C=C1)OC MCULE-6005787971 [1,1,0,0,0,0|2,0,0]=4 2114 B13R1.5 COC(=O)CC1=CC=C(C=C1)CO MCULE-8018406257 [1,1,0,0,0,0|2,0,0]=4 2115 B13R1.5 COC(=O)CC1=CC=C(C=C1)OC MCULE-4770734024 [1,1,0,0,0,0|2,0,0]=4 2116 B13R1.5 COC1=CC=C(C=C1)C/C(=N/O)/N MCULE-1474727011 [1,1,0,0,0,0|2,0,0]=4 2117 B13R1.5 COC1=CC=C(C=C1)C=C(C)C=O MCULE-9557725432 [1,1,0,0,0,0|1,0,1]=4 2118 B13R1.5 COC1=CC=C(C=C1)CC(=NO)C MCULE-2497443972 [1,1,0,0,0,0|2,0,0]=4 2119 B13R1.5 COC1=CC=C(C=C1)CC(=O)CBr MCULE-6405145391 [1,1,0,0,0,0|1,0,1]=4 2120 B13R1.5 COC1=CC=C(C=C1)CC(=O)CCl MCULE-5101253838 [1,1,0,0,0,0|1,0,1]=4 2121 B13R1.5 COC1=CC=C(C=C1)CC(=O)NN MCULE-7563321675 [1,1,0,0,0,0|2,0,0]=4 2122 B13R1.5 COC1=CC=C(C=C1)CC(C)C=O MCULE-9790301615 [1,1,0,0,0,0|1,0,1]=4 2123 B13R1.5 COC1=CC=C(C=C1)NC(=O)CO MCULE-2342476662 [1,1,0,0,0,0|1,0,1]=4 2124 B13R1.19 CC1=CC=C(C=C1)NC(=O)C=NO MCULE-9817021252 [1,1,0,0,0,0|2,0,0]=4 2125 B13R1.19 CCOC(=O)CC1=CC=C(C=C1)O MCULE-1856201628 [1,1,0,0,0,0|1,0,1]=4 2126 B13R1.19 COCC(=O)NC1=CC=C(C=C1)O MCULE-9677771886 [1,1,0,0,0,0|1,0,1]=4 2127 B13R1.19 O=C(C=NO)NC1=CC=C(C=C1)Cl MCULE-3734685607 [1,1,0,0,0,0|2,0,0]=4 2128 B13R1.19 O=C(C=NO)NC1=CC=C(C=C1)F MCULE-6130778880 [1,1,0,0,0,0|2,0,0]=4 2129 B13R1.21 COC(=O)C(C)C1=CC=C(C=C1)O MCULE-8191854360 [1,1,0,0,0,0|2,0,0]=4 2130 B13R1.21 COC(=O)C(C)C1=CC=C(C=C1)O MCULE-8494294942 [1,1,0,0,0,0|2,0,0]=4 2131 B13R1.21 COC(=O)C(N)C1=CC=C(C=C1)O MCULE-2109258026 [1,1,0,0,0,0|2,0,0]=4 2132 B13R1.21 COC(=O)C(N)C1=CC=C(C=C1)O MCULE-8672939855 [1,1,0,0,0,0|2,0,0]=4 2133 B13R1.21 COC(=O)C(N)C1=CC=C(C=C1)O MCULE-9203913935 [1,1,0,0,0,0|2,0,0]=4 2134 B13R1.21 COC(=O)C(N)C1=CC=C(C=C1)O MCULE-9610103093 [1,1,0,0,0,0|2,0,0]=4 2135 B13R1.21 COC(=O)[C@@H](C)C1=CC=C(C=C1)O MCULE-5547350690 [1,1,0,0,0,0|2,0,0]=4 2136 B13R1.21 COC(=O)[C@@H](N)C1=CC=C(C=C1)O MCULE-3737987059 [1,1,0,0,0,0|2,0,0]=4 2137 B13R1.21 COC(=O)[C@@H](N)C1=CC=C(C=C1)O MCULE-4008481207 [1,1,0,0,0,0|2,0,0]=4 2138 B13R1.21 COC(=O)[C@@H](N)C1=CC=C(C=C1)O MCULE-4742567588 [1,1,0,0,0,0|2,0,0]=4 2139 B13R1.21 COC(=O)[C@@H](N)C1=CC=C(C=C1)O MCULE-4982390416 [1,1,0,0,0,0|2,0,0]=4 2140 B13R1.21 COC(=O)[C@H](C)C1=CC=C(C=C1)O MCULE-9287597841 [1,1,0,0,0,0|2,0,0]=4 2141 B13R1.21 COC(=O)[C@H](N)C1=CC=C(C=C1)O MCULE-1531799502 [1,1,0,0,0,0|2,0,0]=4 2142 B13R1.21 COC(=O)[C@H](N)C1=CC=C(C=C1)O MCULE-4690474943 [1,1,0,0,0,0|2,0,0]=4 2143 B13R1.21 COC(=O)[C@H](N)C1=CC=C(C=C1)O MCULE-9241884109 [1,1,0,0,0,0|2,0,0]=4 2144 B13R1.21 COC(=O)[C@H](N)C1=CC=C(C=C1)O MCULE-9766989603 [1,1,0,0,0,0|2,0,0]=4 2145 B13R1.2679 C=CC(=O)NC1=CC=C(C=C1C)O MCULE-8445398495 [1,1,0,0,0,0|2,0,0]=4 2146 B13R1.2679 COC(=O)CC1=C(C=C(C=C1)O)F MCULE-6497981876 [1,1,0,0,0,0|2,0,0]=4 2147 B13R1.2679 COC(=O)CC1=CC=C(C=C1O)O MCULE-1910669861 [1,1,0,0,0,0|2,0,0]=4 2148 B13R1.2879 COC(=O)CC1=CC(=C(C=C1)O)Cl MCULE-2216590228 [1,1,0,0,0,0|2,0,0]=4 2149 B13R1.2879 COC(=O)CC1=CC(=C(C=C1)O)F MCULE-4303607453 [1,1,0,0,0,0|2,0,0]=4 2150 B13R1.2879 COC(=O)CC1=CC(=C(C=C1)O)N MCULE-7940718339 [1,1,0,0,0,0|2,0,0]=4 2151 B13R1.2879 COC(=O)CC1=CC=C(C(=C1)Br)O MCULE-6534473003 [1,1,0,0,0,0|2,0,0]=4 2152 B13R1.2879 COC(=O)CC1=CC=C(C(=C1)C)O MCULE-9180434379 [1,1,0,0,0,0|2,0,0]=4 2153 B13R1.2879 COC(=O)CC1=CC=C(C(=C1)O)O MCULE-9960928491 [1,1,0,0,0,0|2,0,0]=4 2154 B13R1.2879 NNC(=O)CC1=CC=C(C(=C1)N)O MCULE-1447478567 [1,1,0,0,0,0|2,0,0]=4 2155 B13R1.36 C=C(C)C(=O)C1=CC=C(C=C1)OC MCULE-8453576418 [0,1,0,0,1,0|2,0,0]=4 2156 B13R1.36 CCC1=CC=C(C=C1)C(=O)C(=O)O MCULE-5127000926 [0,1,0,0,1,0|1,0,0]=3 2157 B13R1.36 COC1=CC=C(C=C1)C(=O)C(=O)C MCULE-3511988009 [0,1,0,0,1,0|1,0,0]=3 2158 B13R1.36 COC1=CC=C(C=C1)C(=O)C(=O)O MCULE-3624103493 [0,1,0,0,1,0|0,0,0]=2 2159 B13R1.36 COC1=CC=C(C=C1)C(=O)C(O)O MCULE-8334593533 [0,1,0,0,1,0|0,0,2]=4 2160 B13R1.36 COC1=CC=C(C=C1)C(Br)C(=O)O MCULE-9882705294 [0,1,0,0,1,0|1,0,1]=4 2161 B13R1.36 COC1=CC=C(C=C1)C(C)C(=O)O MCULE-3271823908 [0,1,0,0,1,0|1,0,1]=4 2162 B13R1.36 COC1=CC=C(C=C1)C(F)C(=O)O MCULE-3928324349 [0,1,0,0,1,0|1,0,1]=4 2163 B13R1.36 COC1=CC=C(C=C1)C(N)C(=O)O MCULE-6547601332 [0,1,0,0,1,0|1,0,1]=4 2164 B13R1.36 COC1=CC=C(C=C1)C(N)C(=O)O MCULE-8406708308 [0,1,0,0,1,0|1,0,1]=4 2165 B13R1.36 COC1=CC=C(C=C1)C(O)C(=O)O MCULE-2468839753 [0,1,0,0,1,0|0,0,2]=4 2166 B13R1.36 COC1=CC=C(C=C1)C(O)C(=O)O MCULE-3558912620 [0,1,0,0,1,0|0,0,2]=4 2167 B13R1.36 COC1=CC=C(C=C1)[C@@H](N)C(=O)O MCULE-1755446407 [0,1,0,0,1,0|1,0,1]=4 2168 B13R1.36 COC1=CC=C(C=C1)[C@@H](N)C(=O)O MCULE-4155221741 [0,1,0,0,1,0|1,0,1]=4 2169 B13R1.36 COC1=CC=C(C=C1)[C@@H](N)C(=O)O MCULE-8832989274 [0,1,0,0,1,0|1,0,1]=4 2170 B13R1.36 COC1=CC=C(C=C1)[C@@H](O)C(=O)O MCULE-5122633702 [0,1,0,0,1,0|0,0,2]=4 2171 B13R1.36 COC1=CC=C(C=C1)[C@@H](O)C(=O)O MCULE-9845559956 [0,1,0,0,1,0|0,0,2]=4 2172 B13R1.36 COC1=CC=C(C=C1)[C@H](C)C(=O)O MCULE-4289161147 [0,1,0,0,1,0|1,0,1]=4 2173 B13R1.36 COC1=CC=C(C=C1)[C@H](C)C(=O)O MCULE-9964310661 [0,1,0,0,1,0|1,0,1]=4 2174 B13R1.36 COC1=CC=C(C=C1)[C@H](N)C(=O)O MCULE-4196789392 [0,1,0,0,1,0|1,0,1]=4 2175 B13R1.36 COC1=CC=C(C=C1)[C@H](N)C(=O)O MCULE-7788610808 [0,1,0,0,1,0|1,0,1]=4 2176 B13R1.36 COC1=CC=C(C=C1)[C@H](O)C(=O)O MCULE-5426171312 [0,1,0,0,1,0|0,0,2]=4 2177 B13R1.36 COC1=CC=C(C=C1)[C@H](O)C(=O)O MCULE-7024031381 [0,1,0,0,1,0|0,0,2]=4 2178 B13R1.36 CSC1=CC=C(C=C1)C(=O)C(=O)O MCULE-2957779927 [0,1,0,0,1,0|0,1,0]=3 2179 B13R1.36 NC(C(=O)O)C1=CC=C(C=C1)CO MCULE-3378388885 [0,1,0,0,1,0|1,0,1]=4 2180 B13R1.36 NC(C(=O)O)C1=CC=C(C=C1)CO MCULE-6327147062 [0,1,0,0,1,0|1,0,1]=4 2181 B13R1.163 O=C(O)C(=O)C1=C(C=C(C=C1)Br)O MCULE-1920509355 [0,1,0,0,1,0|1,0,0]=3 2182 B13R1.163 O=C(O)C(=O)C1=C(C=C(C=C1)F)F MCULE-1719378401 [0,1,0,0,1,0|1,0,0]=3 2183 B13R1.510 CC1=C(C=C(C=C1)C(=O)C(=O)O)C MCULE-4159124622 [0,1,0,0,1,0|1,0,0]=3 2184 B13R1.510 CC1=C(C=C(C=C1)C(=O)C(=O)O)F MCULE-6820502880 [0,1,0,0,1,0|1,0,0]=3 2185 B13R1.510 CC1=C(C=CC(=C1)C(=O)C(=O)O)Cl MCULE-6190408338 [0,1,0,0,1,0|1,0,0]=3 2186 B13R1.510 CC1=C(C=CC(=C1)C(=O)C(=O)O)F MCULE-7974514808 [0,1,0,0,1,0|1,0,0]=3 2187 B13R1.510 NC(C(=O)O)C1=CC(=C(C=C1)O)O MCULE-3672375900 [0,1,0,0,1,0|1,0,1]=4 2188 B13R1.510 N[C@H](C(=O)O)C1=CC=C(C(=C1)Cl)O MCULE-9361411302 [0,1,0,0,1,0|1,0,1]=4 2189 B13R1.510 O=C(O)C(=O)C1=CC(=C(C=C1)Cl)Cl MCULE-9728659336 [0,1,0,0,1,0|1,0,0]=3 2190 B13R1.510 O=C(O)C(=O)C1=CC(=C(C=C1)Cl)F MCULE-7479208450 [0,1,0,0,1,0|1,0,0]=3 2191 B13R1.510 O=C(O)C(=O)C1=CC(=C(C=C1)F)F MCULE-4071702045 [0,1,0,0,1,0|1,0,0]=3 2192 B13R1.510 O=C(O)C(=O)C1=CC=C(C(=C1)Cl)F MCULE-1149438691 [0,1,0,0,1,0|1,0,0]=3 2193 B13R1.510 O=C(O)C(O)C1=CC(=C(C=C1)O)O MCULE-9231535304 [0,1,0,0,1,0|0,0,2]=4 2194 B13R1.522 CC(C)(C(=O)O)C1=CC=C(C=C1)O MCULE-5215541109 [0,1,0,0,1,0|1,0,1]=4 2195 B13R1.522 CC(N)(C(=O)O)C1=CC=C(C=C1)O MCULE-1828727203 [0,1,0,0,1,0|1,0,1]=4 2196 B13R1.522 CC(N)(C(=O)O)C1=CC=C(C=C1)O MCULE-5656303814 [0,1,0,0,1,0|1,0,1]=4 2197 B13R1.522 CC(O)(C(=O)O)C1=CC=C(C=C1)O MCULE-2318464805 [0,1,0,0,1,0|0,0,2]=4 2198 B13R1.706 COC(C(=O)O)C1=CC=C(C=C1)O MCULE-8984939196 [0,1,0,0,1,0|0,0,2]=4 2199 B15R1.205 COC1=CC=C(C=C1)CC[C@@H](N)C(=O)O MCULE-1415814129 [0,1,0,0,0,1|1,0,1]=4 2200 B15R1.205 COC1=CC=C(C=C1)CNC(=O)C(=O)N MCULE-8216108260 [0,1,0,0,0,1|1,0,0]=3 2201 B15R1.205 COC1=CC=C(C=C1)CNC(C)C(=O)O MCULE-4983768778 [0,1,0,0,0,1|1,0,1]=4 2202 B15R1.205 COC1=CC=C(C=C1)CNC(C)C(=O)O MCULE-8989459411 [0,1,0,0,0,1|1,0,1]=4 2203 B15R1.205 COC1=CC=C(C=C1)CSC(C)C(=O)O MCULE-4606748606 [0,1,0,0,0,1|1,0,1]=4 2204 B15R1.881 C=C(CC(=O)C1=CC=C(C=C1)C)C(=O)O MCULE-4896817843 [0,1,0,0,0,1|2,0,0]=4 2205 B15R1.881 O=C(O)C(=O)CC(=O)C1=CC=C(C=C1)Cl MCULE-8058501872 [0,1,0,0,0,1|1,0,0]=3 2206 B15R1.1001 CNC(=O)C(=O)NCC1=CC=C(C=C1)Cl MCULE-1214805097 [0,1,0,0,0,1|2,0,0]=4 2207 B15R1.1001 COC(=O)C(=O)/C=C/C1=CC=C(C=C1)Br MCULE-2396269981 [0,1,0,0,0,1|1,0,1]=4 2208 B15R1.1001 COC(=O)C(=O)C=CC1=CC=C(C=C1)Br MCULE-7790873364 [0,1,0,0,0,1|1,0,1]=4 2209 B15R1.1001 COC(=O)C(N)CCC1=CC=C(C=C1)O MCULE-1970443796 [0,1,0,0,0,1|1,0,1]=4 2210 B15R1.1001 NNC(=O)C(=O)NCC1=CC=C(C=C1)Cl MCULE-1138727885 [0,1,0,0,0,1|2,0,0]=4 2211 B15R1.1001 NNC(=O)C(=O)NCC1=CC=C(C=C1)F MCULE-3524406184 [0,1,0,0,0,1|2,0,0]=4 2212 B15R1.11347 CC(N)(CCC1=CC=C(C=C1)O)C(=O)O MCULE-7947243577 [0,1,0,0,0,1|1,0,1]=4 2213 B15R1.204 COC1=CC=C(C=C1)CC(=O)CC(=O)Cl MCULE-4559758872 [0,1,0,0,0,1|1,0,0]=3 2214 B15R1.204 COC1=CC=C(C=C1)CC(=O)CC(=O)O MCULE-4072630023 [0,1,0,0,0,1|0,0,0]=2 2215 B15R1.204 COC1=CC=C(C=C1)CC(N)CC(=O)O MCULE-5176054343 [0,1,0,0,0,1|1,0,1]=4 2216 B15R1.204 COC1=CC=C(C=C1)CN(C)CC(=O)O MCULE-7147967151 [0,1,0,0,0,1|2,0,0]=4 2217 B15R1.204 COC1=CC=C(C=C1)CN(C)CC(=O)O MCULE-7567088357 [0,1,0,0,0,1|2,0,0]=4 2218 B15R1.204 COC1=CC=C(C=C1)C[C@@H](N)CC(=O)O MCULE-7724841620 [0,1,0,0,0,1|1,0,1]=4 2219 B15R1.204 COC1=CC=C(C=C1)C[C@@H](N)CC(=O)O MCULE-8005114652 [0,1,0,0,0,1|1,0,1]=4 2220 B15R1.204 COC1=CC=C(C=C1)C[C@H](N)CC(=O)O MCULE-6401359963 [0,1,0,0,0,1|1,0,1]=4 2221 B15R1.204 COC1=CC=C(C=C1)C[C@H](N)CC(=O)O MCULE-8257757342 [0,1,0,0,0,1|1,0,1]=4 2222 B15R1.204 COC1=CC=C(C=C1)NC(=O)CC(=O)C MCULE-8283665548 [0,1,0,0,0,1|2,0,0]=4 2223 B15R1.204 COC1=CC=C(C=C1)NC(=O)CC(=O)O MCULE-3096314268 [0,1,0,0,0,1|1,0,0]=3 2224 B15R1.204 COC1=CC=C(C=C1)NC(=O)NC(=O)N MCULE-1064048855 [0,1,0,0,0,1|2,0,0]=4 2225 B15R1.204 COC1=CC=C(C=C1)OC(=O)CC(=O)O MCULE-3853352438 [0,1,0,0,0,1|1,0,0]=3 2226 B15R1.204 N#CC1=CC=C(C=C1)NC(=O)CC(=O)O MCULE-8071209657 [0,1,0,0,0,1|2,0,0]=4 2227 B15R1.883 CC1=C(C=C(C=C1)NC(=O)CC(=O)O)C MCULE-2653336728 [0,1,0,0,0,1|2,0,0]=4 2228 B15R1.883 CC1=C(C=C(C=C1)NC(=O)CC(=O)O)Cl MCULE-4019611589 [0,1,0,0,0,1|2,0,0]=4 2229 B15R1.883 O=C(O)CC(=O)NC1=CC(=C(C=C1)F)Cl MCULE-1754519012 [0,1,0,0,0,1|2,0,0]=4 2230 B15R1.883 O=C(O)CC(=O)NC1=CC=C(C(=C1)Cl)Cl MCULE-2496261823 [0,1,0,0,0,1|2,0,0]=4 2231 B15R1.981 COC(=O)C=C(N)CC1=CC=C(C=C1)Cl MCULE-6036714161 [0,1,0,0,0,1|2,0,0]=4 2232 B15R1.981 COC(=O)CC(=O)CC1=CC=C(C=C1)C MCULE-8000028895 [0,1,0,0,0,1|1,0,0]=3 2233 B15R1.981 COC(=O)CC(=O)CC1=CC=C(C=C1)Cl MCULE-2711742572 [0,1,0,0,0,1|1,0,0]=3 2234 B15R1.981 COC(=O)CC(=O)CC1=CC=C(C=C1)F MCULE-1801644726 [0,1,0,0,0,1|1,0,0]=3 2235 B15R1.981 COC(=O)CC(=O)NC1=CC=C(C=C1)C MCULE-5235836422 [0,1,0,0,0,1|2,0,0]=4 2236 B15R1.981 COC(=O)CC(=O)NC1=CC=C(C=C1)O MCULE-4869906994 [0,1,0,0,0,1|1,0,0]=3 2237 B15R1.8426 CC1=CC(=C(C=C1)NC(=O)CC(=O)O)C MCULE-2657183403 [0,1,0,0,0,1|2,0,0]=4 2238 B15R1.8426 O=C(O)CC(=O)NC1=C(C=C(C=C1)Cl)Cl MCULE-5494534224 [0,1,0,0,0,1|2,0,0]=4 2239 B15R1.8426 O=C(O)CC(=O)NC1=C(C=C(C=C1)F)F MCULE-4334513328 [0,1,0,0,0,1|2,0,0]=4 2240 B15R1.8426 O=C(O)CC(=O)OC1=C(C=C(C=C1)Cl)Cl MCULE-3795693939 [0,1,0,0,0,1|2,0,0]=4 2241 B15R1.11336 O=C(O)CS(=O)(=O)CC1=CC=C(C=C1)Br MCULE-9754916945 [0,1,0,0,0,1|2,0,0]=4 2242 B15R1.11336 O=C(O)CS(=O)(=O)CC1=CC=C(C=C1)Cl MCULE-3437148890 [0,1,0,0,0,1|2,0,0]=4 2243 B15R1.11336 O=C(O)CS(=O)(=O)CC1=CC=C(C=C1)F MCULE-2068072928 [0,1,0,0,0,1|2,0,0]=4 2244 B15R1.3 CNC(=O)C(=O)NC1=CC=C(C=C1)OC MCULE-1819834855 [0,2,0,0,0,0|2,0,0]=4 2245 B15R1.3 COC(=O)C(N)CC1=CC=C(C=C1)OC MCULE-5968367062 [0,2,0,0,0,0|1,0,1]=4 2246 B15R1.3 COC(=O)C(N)CC1=CC=C(C=C1)OC MCULE-9175958377 [0,2,0,0,0,0|1,0,1]=4 2247 B15R1.3 COC(=O)[C@@H](N)CC1=CC=C(C=C1)CO MCULE-3657995686 [0,2,0,0,0,0|1,0,1]=4 2248 B15R1.3 COC(=O)[C@@H](N)CC1=CC=C(C=C1)OC MCULE-1964667566 [0,2,0,0,0,0|1,0,1]=4 2249 B15R1.3 COC(=O)[C@@H](N)CC1=CC=C(C=C1)OC MCULE-2197725000 [0,2,0,0,0,0|1,0,1]=4 2250 B15R1.3 COC(=O)[C@@H](N)CC1=CC=C(C=C1)OC MCULE-4018285384 [0,2,0,0,0,0|1,0,1]=4 2251 B15R1.3 COC(=O)[C@@H](N)CC1=CC=C(C=C1)OC MCULE-5388287726 [0,2,0,0,0,0|1,0,1]=4 2252 B15R1.3 COC(=O)[C@H](N)CC1=CC=C(C=C1)CO MCULE-3455083830 [0,2,0,0,0,0|1,0,1]=4 2253 B15R1.3 COC(=O)[C@H](N)CC1=CC=C(C=C1)CO MCULE-5595385173 [0,2,0,0,0,0|1,0,1]=4 2254 B15R1.3 COC(=O)[C@H](N)CC1=CC=C(C=C1)OC MCULE-1210141782 [0,2,0,0,0,0|1,0,1]=4 2255 B15R1.3 COC(=O)[C@H](N)CC1=CC=C(C=C1)OC MCULE-4156792862 [0,2,0,0,0,0|1,0,1]=4 2256 B15R1.3 COC(=O)[C@H](N)CC1=CC=C(C=C1)OC MCULE-6152198180 [0,2,0,0,0,0|1,0,1]=4 2257 B15R1.3 COC(=O)[C@H](N)CC1=CC=C(C=C1)OC MCULE-9439175228 [0,2,0,0,0,0|1,0,1]=4 2258 B15R1.3 COC1=CC=C(C=C1)CC(=O)N(C)OC MCULE-9031038097 [0,2,0,0,0,0|2,0,0]=4 2259 B15R1.3 COC1=CC=C(C=C1)NC(=O)C(=O)NN MCULE-7578287793 [0,2,0,0,0,0|2,0,0]=4 2260 B15R1.6 COC1=CC=C(C=C1)C(C)C(N)C(=O)O MCULE-4240357039 [0,2,0,0,0,0|1,0,1]=4 2261 B15R1.6 COC1=CC=C(C=C1)C(C)C(N)C(=O)O MCULE-7761720411 [0,2,0,0,0,0|1,0,1]=4 2262 B15R1.6 COC1=CC=C(C=C1)C(N)C(O)C(=O)O MCULE-2125209405 [0,2,0,0,0,0|0,0,2]=4 2263 B15R1.6 COC1=CC=C(C=C1)C(O)C(N)C(=O)O MCULE-2110365086 [0,2,0,0,0,0|1,0,1]=4 2264 B15R1.6 COC1=CC=C(C=C1)[C@@H](C)[C@@H](N)C(=O)O MCULE-2318924527 [0,2,0,0,0,0|1,0,1]=4 2265 B15R1.6 COC1=CC=C(C=C1)[C@@H](C)[C@@H](N)C(=O)O MCULE-9848259990 [0,2,0,0,0,0|1,0,1]=4 2266 B15R1.6 COC1=CC=C(C=C1)[C@@H](C)[C@H](N)C(=O)O MCULE-1699189569 [0,2,0,0,0,0|1,0,1]=4 2267 B15R1.6 COC1=CC=C(C=C1)[C@@H](C)[C@H](N)C(=O)O MCULE-3097773877 [0,2,0,0,0,0|1,0,1]=4 2268 B15R1.6 COC1=CC=C(C=C1)[C@@H](N)[C@@H](O)C(=O)O MCULE-6337313454 [0,2,0,0,0,0|0,0,2]=4 2269 B15R1.6 COC1=CC=C(C=C1)[C@H](C)[C@@H](N)C(=O)O MCULE-8893589983 [0,2,0,0,0,0|1,0,1]=4 2270 B15R1.6 COC1=CC=C(C=C1)[C@H](C)[C@@H](N)C(=O)O MCULE-9791260020 [0,2,0,0,0,0|1,0,1]=4 2271 B15R1.6 COC1=CC=C(C=C1)[C@H](C)[C@H](N)C(=O)O MCULE-7399355195 [0,2,0,0,0,0|1,0,1]=4 2272 B15R1.6 COC1=CC=C(C=C1)[C@H](C)[C@H](N)C(=O)O MCULE-9465569959 [0,2,0,0,0,0|1,0,1]=4 2273 B15R1.16 CCOC1=CC=C(C=C1)CC(C)C(=O)O MCULE-7059004839 [0,2,0,0,0,0|1,0,1]=4 2274 B15R1.16 CCOC1=CC=C(C=C1)CC(N)C(=O)O MCULE-4474170078 [0,2,0,0,0,0|1,0,1]=4 2275 B15R1.16 CCOC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-4177099907 [0,2,0,0,0,0|1,0,1]=4 2276 B15R1.16 CCOC1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-7871331679 [0,2,0,0,0,0|1,0,1]=4 2277 B15R1.16 CCOC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-6155700571 [0,2,0,0,0,0|1,0,1]=4 2278 B15R1.16 CCOC1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-9752442085 [0,2,0,0,0,0|1,0,1]=4 2279 B15R1.208 CCC(CC1=CC=C(C=C1)OC)C(=O)O MCULE-8794147117 [0,2,0,0,0,0|1,0,1]=4 2280 B15R1.208 CNC(CC1=CC=C(C=C1)OC)C(=O)O MCULE-2926409390 [0,2,0,0,0,0|1,0,1]=4 2281 B15R1.208 CNC(CC1=CC=C(C=C1)OC)C(=O)O MCULE-7983990515 [0,2,0,0,0,0|1,0,1]=4 2282 B15R1.208 CN[C@@H](CC1=CC=C(C=C1)OC)C(=O)O MCULE-1380043796 [0,2,0,0,0,0|1,0,1]=4 2283 B15R1.208 CN[C@@H](CC1=CC=C(C=C1)OC)C(=O)O MCULE-4718377840 [0,2,0,0,0,0|1,0,1]=4 2284 B15R1.208 CN[C@@H](CC1=CC=C(C=C1)OC)C(=O)O MCULE-8573594584 [0,2,0,0,0,0|1,0,1]=4 2285 B15R1.208 COC1=CC=C(C=C1)C=C(C#N)C(=O)O MCULE-3590424221 [0,2,0,0,0,0|1,0,1]=4 2286 B15R1.208 COC1=CC=C(C=C1)C=C(NO)C(=O)O MCULE-3487060671 [0,2,0,0,0,0|0,0,2]=4 2287 B15R1.208 COC1=CC=C(C=C1)CC(=NO)C(=O)O MCULE-5538838177 [0,2,0,0,0,0|0,0,1]=3 2288 B15R1.208 COC1=CC=C(C=C1)CC(C#N)C(=O)O MCULE-7632998410 [0,2,0,0,0,0|1,0,1]=4 2289 B15R1.208 COC1=CC=C(C=C1)CC(CN)C(=O)O MCULE-6752736376 [0,2,0,0,0,0|1,0,1]=4 2290 B15R1.208 COC1=CC=C(C=C1)CC(OC)C(=O)O MCULE-5065742571 [0,2,0,0,0,0|0,0,2]=4 2291 B15R1.208 [C@@H](CC1=CC=C(C=C1)OC)(NC)C(=O)O MCULE-6522685807 [0,2,0,0,0,0|1,0,1]=4 2292 B15R1.216 COC1=CC=C(C=C1)CC(C)(C)C(=O)O MCULE-4733692263 [0,2,0,0,0,0|1,0,1]=4 2293 B15R1.216 COC1=CC=C(C=C1)C[C@](C)(N)C(=O)O MCULE-5924693298 [0,2,0,0,0,0|1,0,1]=4 2294 B15R1.495 C(N)(CC1=CC=C(C=C1)B(O)O)C(=O)O MCULE-9323204289 [0,2,0,0,0,0|1,0,1]=4 2295 B15R1.495 CC(=O)C1=CC=C(C=C1)NC(=O)C(=O)O MCULE-3101229902 [0,2,0,0,0,0|1,0,1]=4 2296 B15R1.495 NC(CC1=CC=C(C=C1)B(O)O)C(=O)O MCULE-2970291581 [0,2,0,0,0,0|1,0,1]=4 2297 B15R1.495 NC(CC1=CC=C(C=C1)C(=O)O)C(=O)O MCULE-8431079171 [0,2,0,0,0,0|1,0,1]=4 2298 B15R1.495 N[C@@H](CC1=CC=C(C=C1)B(O)O)C(=O)O MCULE-6531307541 [0,2,0,0,0,0|1,0,1]=4 2299 B15R1.495 N[C@@H](CC1=CC=C(C=C1)B(O)O)C(=O)O MCULE-7671849018 [0,2,0,0,0,0|1,0,1]=4 2300 B15R1.495 N[C@@H](CC1=CC=C(C=C1)C(=O)O)C(=O)O MCULE-2408168813 [0,2,0,0,0,0|1,0,1]=4 2301 B15R1.495 N[C@@H](CC1=CC=C(C=C1)C(=O)O)C(=O)O MCULE-7535447371 [0,2,0,0,0,0|1,0,1]=4 2302 B15R1.495 N[C@@H](CC1=CC=C(C=C1)C(=O)O)C(=O)O MCULE-9954201924 [0,2,0,0,0,0|1,0,1]=4 2303 B15R1.495 N[C@H](CC1=CC=C(C=C1)B(O)O)C(=O)O MCULE-6395401693 [0,2,0,0,0,0|1,0,1]=4 2304 B15R1.495 N[C@H](CC1=CC=C(C=C1)B(O)O)C(=O)O MCULE-7353945301 [0,2,0,0,0,0|1,0,1]=4 2305 B15R1.495 O=C(O)C(=O)CC1=CC=C(C=C1)N(=O)=O MCULE-6223294787 [0,2,0,0,0,0|0,0,1]=3 2306 B15R1.495 O=C(O)C(=O)NC1=CC=C(C=C1)N(=O)=O MCULE-2403191345 [0,2,0,0,0,0|1,0,1]=4 2307 B15R1.1855 COC1=CC(=C(C=C1)CC(C)C(=O)O)C MCULE-5159442893 [0,2,0,0,0,0|1,0,1]=4 2308 B15R1.1855 COC1=CC(=C(C=C1)CC(C)C(=O)O)F MCULE-3398480229 [0,2,0,0,0,0|1,0,1]=4 2309 B15R1.1855 COC1=CC(=C(C=C1)CC(N)C(=O)O)C MCULE-9953420159 [0,2,0,0,0,0|1,0,1]=4 2310 B15R1.1855 COC1=CC(=C(C=C1)CC(N)C(=O)O)Cl MCULE-6261173778 [0,2,0,0,0,0|1,0,1]=4 2311 B15R1.1855 COC1=CC(=C(C=C1)CC(N)C(=O)O)F MCULE-7095600213 [0,2,0,0,0,0|1,0,1]=4 2312 B15R1.1855 COC1=CC(=C(C=C1)C[C@H](N)C(=O)O)F MCULE-2884872242 [0,2,0,0,0,0|1,0,1]=4 2313 B15R1.1855 COC1=CC=C(C(=C1)C)CC(N)C(=O)O MCULE-1761375468 [0,2,0,0,0,0|1,0,1]=4 2314 B15R1.1855 COC1=CC=C(C(=C1)C)C[C@H](N)C(=O)O MCULE-9196435284 [0,2,0,0,0,0|1,0,1]=4 2315 B15R1.1855 COC1=CC=C(C(=C1)C)C[C@H](N)C(=O)O MCULE-9539414016 [0,2,0,0,0,0|1,0,1]=4 2316 B15R1.1855 COC1=CC=C(C(=C1)Cl)CC(N)C(=O)O MCULE-1506920207 [0,2,0,0,0,0|1,0,1]=4 2317 B15R1.1855 COC1=CC=C(C(=C1)Cl)C[C@H](N)C(=O)O MCULE-5053569664 [0,2,0,0,0,0|1,0,1]=4 2318 B15R1.1855 COC1=CC=C(C(=C1)Cl)C[C@H](N)C(=O)O MCULE-5063019199 [0,2,0,0,0,0|1,0,1]=4 2319 B15R1.3777 COC1=C(C=C(C=C1)CC(C)C(=O)O)C MCULE-4576635965 [0,2,0,0,0,0|1,0,1]=4 2320 B15R1.3777 COC1=C(C=C(C=C1)CC(C)C(=O)O)F MCULE-9585703204 [0,2,0,0,0,0|1,0,1]=4 2321 B15R1.3777 COC1=C(C=C(C=C1)CC(N)C(=O)O)O MCULE-5884291477 [0,2,0,0,0,0|1,0,1]=4 2322 B15R1.3777 COC1=C(C=C(C=C1)C[C@@H](N)C(=O)O)F MCULE-1496356474 [0,2,0,0,0,0|1,0,1]=4 2323 B15R1.3777 COC1=C(C=C(C=C1)C[C@H](N)C(=O)O)C MCULE-6784461708 [0,2,0,0,0,0|1,0,1]=4 2324 B15R1.3777 COC1=C(C=C(C=C1)C[C@H](N)C(=O)O)F MCULE-8709215261 [0,2,0,0,0,0|1,0,1]=4 2325 B15R1.3777 COC1=C(C=C(C=C1)NC(=O)C(=O)N)Cl MCULE-9533183026 [0,2,0,0,0,0|2,0,0]=4 2326 B15R1.3777 COC1=CC=C(C=C1F)CC(N)C(=O)O MCULE-6887943165 [0,2,0,0,0,0|1,0,1]=4 2327 B15R1.3777 COC1=CC=C(C=C1O)C[C@H](N)C(=O)O MCULE-4895674857 [0,2,0,0,0,0|1,0,1]=4 2328 B15R1.3777 COC1=CC=C(C=C1O)C[C@H](N)C(=O)O MCULE-6180340931 [0,2,0,0,0,0|1,0,1]=4 2329 B15R1.3777 COC1=CC=C(C=C1O)C[C@H](N)C(=O)O MCULE-6667736520 [0,2,0,0,0,0|1,0,1]=4 2330 B15R1.3777 COC1=CC=C(C=C1O)C[C@H](N)C(=O)O MCULE-6834322773 [0,2,0,0,0,0|1,0,1]=4 2331 B15R1.3777 N#CC1=C(C=C(C=C1)NC(=O)C(=O)O)Cl MCULE-6198829615 [0,2,0,0,0,0|2,0,0]=4 2332 B15R1.75 C=C(C(=O)OC)C(O)C1=CC=C(C=C1)Cl MCULE-3714354398 [0,2,0,0,0,0|2,0,0]=4 2333 B15R1.75 COC(=O)C(=O)C(Cl)C1=CC=C(C=C1)C MCULE-6316012730 [0,2,0,0,0,0|1,0,0]=3 2334 B15R1.890 NC(C(=O)O)C(O)C1=CC=C(C(=C1)O)O MCULE-2196760309 [0,2,0,0,0,0|1,0,1]=4 2335 B15R1.890 N[C@@H](C(=O)O)[C@@H](O)C1=CC=C(C(=C1)O)O MCULE-6927631657 [0,2,0,0,0,0|1,0,1]=4 2336 B15R1.890 N[C@@H](C(=O)O)[C@H](O)C1=CC=C(C(=C1)Cl)O MCULE-3894027171 [0,2,0,0,0,0|1,0,1]=4 2337 B15R1.890 N[C@H](C(=O)O)[C@H](O)C1=CC(=C(C=C1)O)O MCULE-2260723124 [0,2,0,0,0,0|1,0,1]=4 2338 B15R1.890 N[C@H](C(=O)O)[C@H](O)C1=CC(=C(C=C1)O)O MCULE-5172677574 [0,2,0,0,0,0|1,0,1]=4 2339 B15R1.890 N[C@H](C(=O)O)[C@H](O)C1=CC=C(C(=C1)Cl)O MCULE-5832005568 [0,2,0,0,0,0|1,0,1]=4 2340 B15R1.11315 CC(C)(C(=O)O)C(O)C1=CC=C(C=C1)O MCULE-8938905266 [0,2,0,0,0,0|1,0,1]=4 2341 B15R1.48 C=C(CC1=CC=C(C=C1)Br)C(=O)OCC MCULE-7922861099 [0,2,0,0,0,0|2,0,0]=4 2342 B15R1.48 CCOC(=O)C(=O)CC1=CC=C(C=C1)Cl MCULE-9309057618 [0,2,0,0,0,0|1,0,0]=3 2343 B15R1.48 CCOC(=O)C(=O)CC1=CC=C(C=C1)N MCULE-3137134104 [0,2,0,0,0,0|1,0,0]=3 2344 B15R1.48 CCOC(=O)C(=O)NC1=CC=C(C=C1)Br MCULE-6942954207 [0,2,0,0,0,0|2,0,0]=4 2345 B15R1.48 CCOC(=O)C(=O)NC1=CC=C(C=C1)C MCULE-1837872929 [0,2,0,0,0,0|2,0,0]=4 2346 B15R1.48 CCOC(=O)C(=O)NC1=CC=C(C=C1)Cl MCULE-5769688144 [0,2,0,0,0,0|2,0,0]=4 2347 B15R1.48 CCOC(=O)C(=O)NC1=CC=C(C=C1)F MCULE-7881161909 [0,2,0,0,0,0|2,0,0]=4 2348 B15R1.48 CCOC(=O)C(=O)SC1=CC=C(C=C1)Cl MCULE-2800957841 [0,2,0,0,0,0|2,0,0]=4 2349 B15R1.48 CCOC(=O)C(=O)SC1=CC=C(C=C1)F MCULE-4062881219 [0,2,0,0,0,0|2,0,0]=4 2350 B15R1.48 CCOC(=O)C(N)CC1=CC=C(C=C1)O MCULE-5038993745 [0,2,0,0,0,0|1,0,1]=4 2351 B15R1.48 CCOC(=O)C(O)CC1=CC=C(C=C1)O MCULE-6844224272 [0,2,0,0,0,0|0,0,2]=4 2352 B15R1.48 CCOC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-2169429737 [0,2,0,0,0,0|1,0,1]=4 2353 B15R1.48 CCOC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-5716512399 [0,2,0,0,0,0|1,0,1]=4 2354 B15R1.48 CCOC(=O)[C@@H](N)CC1=CC=C(C=C1)O MCULE-7842225044 [0,2,0,0,0,0|1,0,1]=4 2355 B15R1.48 [C@@H](N)(CC1=CC=C(C=C1)O)C(=O)OCC MCULE-3513448897 [0,2,0,0,0,0|1,0,1]=4 2356 B15R1.48 [C@@H](N)(CC1=CC=C(C=C1)O)C(=O)OCC MCULE-4412223391 [0,2,0,0,0,0|1,0,1]=4 2357 B15R1.48 [C@@H](N)(CC1=CC=C(C=C1)O)C(=O)OCC MCULE-8515529091 [0,2,0,0,0,0|1,0,1]=4 2358 B15R1.48 [C@@H](N)(CC1=CC=C(C=C1)O)C(=O)OCC MCULE-8709029173 [0,2,0,0,0,0|1,0,1]=4 2359 B15R1.48 [C@H](N)(CC1=CC=C(C=C1)O)C(=O)OCC MCULE-5794748461 [0,2,0,0,0,0|1,0,1]=4 2360 B15R1.48 [NH3+]C(CC1=CC=C(C=C1)O)C(=O)OCC MCULE-1868277109 [0,2,0,0,0,0|1,0,1]=4 2361 B15R1.1373 CNC(CC1=CC=C(C=C1)O)C(=O)OC MCULE-3686987188 [0,2,0,0,0,0|1,0,1]=4 2362 B15R1.1373 CNC(CC1=CC=C(C=C1)O)C(=O)OC MCULE-5554035019 [0,2,0,0,0,0|1,0,1]=4 2363 B15R1.1373 CN[C@@H](CC1=CC=C(C=C1)O)C(=O)OC MCULE-1076989300 [0,2,0,0,0,0|1,0,1]=4 2364 B15R1.1373 CN[C@@H](CC1=CC=C(C=C1)O)C(=O)OC MCULE-2319838752 [0,2,0,0,0,0|1,0,1]=4 2365 B15R1.1373 CN[C@@H](CC1=CC=C(C=C1)O)C(=O)OC MCULE-5332389566 [0,2,0,0,0,0|1,0,1]=4 2366 B15R1.1373 CN[C@@H](CC1=CC=C(C=C1)O)C(=O)OC MCULE-8225913489 [0,2,0,0,0,0|1,0,1]=4 2367 B15R1.1373 COC(=O)/C(=N/O)/CC1=CC=C(C=C1)O MCULE-5429842871 [0,2,0,0,0,0|0,0,1]=3 2368 B15R1.1373 COC(=O)C(=CC1=CC=C(C=C1)O)C#N MCULE-6519208436 [0,2,0,0,0,0|1,0,1]=4 2369 B15R1.1373 COC(=O)C(=NO)CC1=CC=C(C=C1)O MCULE-5648124869 [0,2,0,0,0,0|0,0,1]=3 2370 B15R1.1373 COC(=O)C(CN)CC1=CC=C(C=C1)O MCULE-1616940127 [0,2,0,0,0,0|1,0,1]=4 2371 B15R1.1373 COC(=O)C(CN)CC1=CC=C(C=C1)O MCULE-5011413908 [0,2,0,0,0,0|1,0,1]=4 2372 B15R1.5521 COC(=O)C(N)CC1=CC(=C(C=C1)O)F MCULE-1440475052 [0,2,0,0,0,0|1,0,1]=4 2373 B15R1.5521 COC(=O)C(N)CC1=CC(=C(C=C1)O)F MCULE-2390202300 [0,2,0,0,0,0|1,0,1]=4 2374 B15R1.5521 COC(=O)C(N)CC1=CC(=C(C=C1)O)I MCULE-6783616801 [0,2,0,0,0,0|1,0,1]=4 2375 B15R1.5521 COC(=O)C(N)CC1=CC(=C(C=C1)O)O MCULE-5224971073 [0,2,0,0,0,0|1,0,1]=4 2376 B15R1.5521 COC(=O)C(N)CC1=CC(=C(C=C1)O)O MCULE-9236741215 [0,2,0,0,0,0|1,0,1]=4 2377 B15R1.5521 COC(=O)C(N)CC1=CC=C(C(=C1)I)O MCULE-1550420120 [0,2,0,0,0,0|1,0,1]=4 2378 B15R1.5521 COC(=O)[C@@H](N)CC1=CC(=C(C=C1)O)C MCULE-1144633759 [0,2,0,0,0,0|1,0,1]=4 2379 B15R1.5521 COC(=O)[C@@H](N)CC1=CC(=C(C=C1)O)Cl MCULE-9082614619 [0,2,0,0,0,0|1,0,1]=4 2380 B15R1.5521 COC(=O)[C@@H](N)CC1=CC(=C(C=C1)O)I MCULE-1453641501 [0,2,0,0,0,0|1,0,1]=4 2381 B15R1.5521 COC(=O)[C@@H](N)CC1=CC=C(C(=C1)F)O MCULE-4643702580 [0,2,0,0,0,0|1,0,1]=4 2382 B15R1.5521 COC(=O)[C@@H](N)CC1=CC=C(C(=C1)F)O MCULE-9841550381 [0,2,0,0,0,0|1,0,1]=4 2383 B15R1.5521 COC(=O)[C@@H](N)CC1=CC=C(C(=C1)I)O MCULE-5476102781 [0,2,0,0,0,0|1,0,1]=4 2384 B15R1.5521 COC(=O)[C@@H](N)CC1=CC=C(C(=C1)I)O MCULE-5790251739 [0,2,0,0,0,0|1,0,1]=4 2385 B15R1.5521 COC(=O)[C@@H](N)CC1=CC=C(C(=C1)N)O MCULE-3506197717 [0,2,0,0,0,0|1,0,1]=4 2386 B15R1.5521 COC(=O)[C@@H](N)CC1=CC=C(C(=C1)N)O MCULE-5696536890 [0,2,0,0,0,0|1,0,1]=4 2387 B15R1.5521 COC(=O)[C@@H](N)CC1=CC=C(C(=C1)O)O MCULE-3252157436 [0,2,0,0,0,0|1,0,1]=4 2388 B15R1.5521 COC(=O)[C@@H](N)CC1=CC=C(C(=C1)O)O MCULE-6374263286 [0,2,0,0,0,0|1,0,1]=4 2389 B15R1.5521 COC(=O)[C@@H](N)CC1=CC=C(C(=C1)O)O MCULE-8067117723 [0,2,0,0,0,0|1,0,1]=4 2390 B15R1.5521 COC(=O)[C@@H](N)CC1=CC=C(C(=C1)O)O MCULE-8985334842 [0,2,0,0,0,0|1,0,1]=4 2391 B15R1.5521 COC(=O)[C@H](N)CC1=CC(=C(C=C1)O)C MCULE-8960861848 [0,2,0,0,0,0|1,0,1]=4 2392 B15R1.5521 COC(=O)[C@H](N)CC1=CC(=C(C=C1)O)Cl MCULE-4935118102 [0,2,0,0,0,0|1,0,1]=4 2393 B15R1.5521 COC(=O)[C@H](N)CC1=CC(=C(C=C1)O)F MCULE-3709153442 [0,2,0,0,0,0|1,0,1]=4 2394 B15R1.5521 COC(=O)[C@H](N)CC1=CC(=C(C=C1)O)O MCULE-2863430745 [0,2,0,0,0,0|1,0,1]=4 2395 B15R1.5521 COC(=O)[C@H](N)CC1=CC(=C(C=C1)O)O MCULE-6047781856 [0,2,0,0,0,0|1,0,1]=4 2396 B15R1.5521 COC(=O)[C@H](N)CC1=CC=C(C(=C1)N)O MCULE-8782971236 [0,2,0,0,0,0|1,0,1]=4 2397 B15R1.5521 [C@H](N)(CC1=CC(=C(C=C1)O)I)C(=O)OC MCULE-7708678960 [0,2,0,0,0,0|1,0,1]=4 2398 B15R1.11652 COC(=O)C(C)(N)CC1=CC=C(C=C1)O MCULE-4854128014 [0,2,0,0,0,0|1,0,1]=4 2399 B15R1.11652 COC(=O)C(C)(N)CC1=CC=C(C=C1)O MCULE-5578591093 [0,2,0,0,0,0|1,0,1]=4 2400 B15R1.11652 COC(=O)[C@@](C)(N)CC1=CC=C(C=C1)O MCULE-1397969090 [0,2,0,0,0,0|1,0,1]=4 2401 B15R1.11652 COC(=O)[C@@](C)(N)CC1=CC=C(C=C1)O MCULE-6155233524 [0,2,0,0,0,0|1,0,1]=4 2402 B15R1.14339 COC(=O)C(=O)NC1=CC=C(C=C1O)O MCULE-8249665978 [0,2,0,0,0,0|1,0,0]=3 2403 B15R1.14339 COC(=O)[C@@H](N)CC1=C(C=C(C=C1)O)C MCULE-5998374316 [0,2,0,0,0,0|1,0,1]=4 2404 B15R1.14339 COC(=O)[C@@H](N)CC1=C(C=C(C=C1)O)O MCULE-7663834544 [0,2,0,0,0,0|1,0,1]=4 2405 B15R1.14339 COC(=O)[C@@H](N)CC1=CC=C(C=C1Cl)O MCULE-1667626954 [0,2,0,0,0,0|1,0,1]=4 2406 B15R1.14339 COC(=O)[C@@H](N)CC1=CC=C(C=C1F)O MCULE-3335852769 [0,2,0,0,0,0|1,0,1]=4 2407 B15R1.14339 COC(=O)[C@H](N)CC1=C(C=C(C=C1)O)C MCULE-9454858174 [0,2,0,0,0,0|1,0,1]=4 2408 B15R1.14339 COC(=O)[C@H](N)CC1=C(C=C(C=C1)O)O MCULE-8632906630 [0,2,0,0,0,0|1,0,1]=4 2409 B15R1.14339 COC(=O)[C@H](N)CC1=CC=C(C=C1Cl)O MCULE-7083169878 [0,2,0,0,0,0|1,0,1]=4 2410 B15R1.14339 COC(=O)[C@H](N)CC1=CC=C(C=C1F)O MCULE-3405385023 [0,2,0,0,0,0|1,0,1]=4 2411 B15R1.676 CCC(CC1=CC=C(C(=C1)C)O)C(=O)O MCULE-7881346727 [0,2,0,0,0,0|1,0,1]=4 2412 B15R1.676 N#C/C(=C\C1=CC(=C(C=C1)O)O)/C(=O)O MCULE-1168886289 [0,2,0,0,0,0|1,0,1]=4 2413 B15R1.676 N#CC(=CC1=CC=C(C(=C1)O)O)C(=O)O MCULE-5246627641 [0,2,0,0,0,0|1,0,1]=4 2414 B15R1.676 O=C(O)/C(=N/O)/CC1=CC(=C(C=C1)O)Br MCULE-3242323588 [0,2,0,0,0,0|0,0,1]=3 2415 B15R1.676 O=C(O)C(=NO)CC1=CC(=C(C=C1)O)Br MCULE-4287679993 [0,2,0,0,0,0|0,0,1]=3 2416 B15R1.1295 CCOC(CC1=CC=C(C=C1)O)C(=O)O MCULE-7919063826 [0,2,0,0,0,0|0,0,2]=4 2417 B15R1.1295 CCO[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-5269695503 [0,2,0,0,0,0|0,0,2]=4 2418 B15R1.1295 CCO[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-9829756291 [0,2,0,0,0,0|0,0,2]=4 2419 B15R1.1295 O=CNC(CC1=CC=C(C=C1)I)C(=O)O MCULE-2685509238 [0,2,0,0,0,0|1,0,1]=4 2420 B15R1.1295 O=CNC(CC1=CC=C(C=C1)O)C(=O)O MCULE-1101349598 [0,2,0,0,0,0|0,0,1]=3 2421 B15R1.1295 O=CN[C@@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-7482714239 [0,2,0,0,0,0|1,0,1]=4 2422 B15R1.1295 O=CN[C@@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-8750794144 [0,2,0,0,0,0|1,0,1]=4 2423 B15R1.1295 O=CN[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-4274998340 [0,2,0,0,0,0|0,0,1]=3 2424 B15R1.1295 O=CN[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-5381941789 [0,2,0,0,0,0|0,0,1]=3 2425 B15R1.1295 [N-]=[N+]=N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-1632382718 [0,2,0,0,0,0|1,0,1]=4 2426 B15R1.1295 [N-]=[N+]=N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-3768876015 [0,2,0,0,0,0|1,0,1]=4 2427 B15R1.1295 [N-]=[N+]=N[C@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-3772567322 [0,2,0,0,0,0|1,0,1]=4 2428 B15R1.1295 [N-]=[N+]=N[C@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-4175445504 [0,2,0,0,0,0|1,0,1]=4 2429 B15R1.11335 CC(=O)C(CC1=CC=C(C=C1)O)C(=O)C MCULE-7932523086 [0,2,0,0,0,0|1,0,1]=4 2430 B15R1.11335 CN(C)[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-5346987925 [0,2,0,0,0,0|1,0,1]=4 2431 B15R1.11335 CN(C)[C@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-1017016325 [0,2,0,0,0,0|1,0,1]=4 2432 B15R1.11335 O=C(O)C(=CC1=CC=C(C=C1)O)C(=O)O MCULE-4027340164 [0,2,0,0,0,0|0,0,1]=3 2433 B15R1.11335 O=C(O)C(CC1=CC=C(C=C1)Br)C(=O)O MCULE-6363357139 [0,2,0,0,0,0|1,0,1]=4 2434 B15R1.11335 O=C(O)C(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-3208860243 [0,2,0,0,0,0|1,0,1]=4 2435 B15R1.11335 O=C(O)C(CC1=CC=C(C=C1)O)C(=O)O MCULE-5923382507 [0,2,0,0,0,0|0,0,1]=3 2436 B15R1.4038 COC1=C(C=CC(=C1)CC(=O)C(=O)O)O MCULE-8932848796 [0,2,0,0,0,0|0,0,0]=2 2437 B15R1.4038 COC1=C(C=CC(=C1)CC(N)C(=O)O)O MCULE-4733493787 [0,2,0,0,0,0|1,0,1]=4 2438 B15R1.4038 COC1=C(C=CC(=C1)C[C@H](N)C(=O)O)O MCULE-1430768082 [0,2,0,0,0,0|1,0,1]=4 2439 B15R1.4038 COC1=C(C=CC(=C1)C[C@H](N)C(=O)O)O MCULE-6491381871 [0,2,0,0,0,0|1,0,1]=4 2440 B15R1.4038 COC1=CC(=CC=C1O)CC(N)C(=O)O MCULE-5255380629 [0,2,0,0,0,0|1,0,1]=4 2441 B15R1.4038 COC1=CC(=CC=C1O)CC(O)C(=O)O MCULE-4905795738 [0,2,0,0,0,0|0,0,2]=4 2442 B15R1.4038 COC1=CC(=CC=C1O)C[C@H](N)C(=O)O MCULE-4154194049 [0,2,0,0,0,0|1,0,1]=4 2443 B15R1.4038 COC1=CC(=CC=C1O)C[C@H](O)C(=O)O MCULE-2286648207 [0,2,0,0,0,0|0,0,2]=4 2444 B15R1.4038 COC1=CC(=CC=C1O)C[C@H](O)C(=O)O MCULE-3682555469 [0,2,0,0,0,0|0,0,2]=4 2445 B15R1.4038 N#CC1=CC(=CC=C1O)C[C@H](N)C(=O)O MCULE-4983890225 [0,2,0,0,0,0|1,0,1]=4 2446 B15R1.8394 NC(CC1=CC(=C(C=C1O)O)O)C(=O)O MCULE-2477170525 [0,2,0,0,0,0|1,0,1]=4 2447 B15R1.8394 N[C@@H](CC1=CC(=C(C=C1F)O)O)C(=O)O MCULE-4971741080 [0,2,0,0,0,0|1,0,1]=4 2448 B15R1.8394 N[C@@H](CC1=CC(=C(C=C1O)O)O)C(=O)O MCULE-2121185408 [0,2,0,0,0,0|1,0,1]=4 2449 B15R1.8394 N[C@@H](CC1=CC(=C(C=C1O)O)O)C(=O)O MCULE-2764183839 [0,2,0,0,0,0|1,0,1]=4 2450 B15R1.8408 N[C@@H](CC1=CC=C(C(=C1Cl)Cl)O)C(=O)O MCULE-3118843241 [0,2,0,0,0,0|1,0,1]=4 2451 B15R1.11316 CC(N)(CC1=CC(=C(C=C1)O)O)C(=O)O MCULE-3456177599 [0,2,0,0,0,0|1,0,1]=4 2452 B15R1.11316 CC(N)(CC1=CC=C(C(=C1)O)O)C(=O)O MCULE-9799621874 [0,2,0,0,0,0|1,0,1]=4 2453 B15R1.11316 C[C@@](N)(CC1=CC(=C(C=C1)O)O)C(=O)O MCULE-1237132549 [0,2,0,0,0,0|1,0,1]=4 2454 B15R1.11316 C[C@@](N)(CC1=CC=C(C(=C1)O)O)C(=O)O MCULE-5420221348 [0,2,0,0,0,0|1,0,1]=4 2455 B15R1.11316 C[C@@](N)(CC1=CC=C(C(=C1)O)O)C(=O)O MCULE-8162687635 [0,2,0,0,0,0|1,0,1]=4 2456 B15R1.11316 C[C@@](N)(CC1=CC=C(C(=C1)O)O)C(=O)O MCULE-8417570910 [0,2,0,0,0,0|1,0,1]=4 2457 B15R1.11316 C[C@](N)(CC1=CC(=C(C=C1)O)O)C(=O)O MCULE-3420546236 [0,2,0,0,0,0|1,0,1]=4 2458 B15R1.11316 C[C@](N)(CC1=CC(=C(C=C1)O)O)C(=O)O MCULE-8885874119 [0,2,0,0,0,0|1,0,1]=4 2459 B15R1.11316 C[C@](N)(CC1=CC=C(C(=C1)O)O)C(=O)O MCULE-1576289240 [0,2,0,0,0,0|1,0,1]=4 2460 B15R1.28955 CC1=CC(=CC(=C1O)C)C[C@H](N)C(=O)O MCULE-8080579062 [0,2,0,0,0,0|1,0,1]=4 2461 B15R1.28955 CC1=CC(=CC(=C1O)C)C[C@H](N)C(=O)O MCULE-8891684168 [0,2,0,0,0,0|1,0,1]=4 2462 B15R1.28955 CC1=CC(=CC(=C1O)C)C[C@H](N)C(=O)O MCULE-8928222101 [0,2,0,0,0,0|1,0,1]=4 2463 B15R1.28955 NC(CC1=CC(=C(C(=C1)Br)O)Br)C(=O)O MCULE-5166640674 [0,2,0,0,0,0|1,0,1]=4 2464 B15R1.28955 NC(CC1=CC(=C(C(=C1)Br)O)Br)C(=O)O MCULE-8363391164 [0,2,0,0,0,0|1,0,1]=4 2465 B15R1.28955 NC(CC1=CC(=C(C(=C1)Cl)O)Cl)C(=O)O MCULE-3334322632 [0,2,0,0,0,0|1,0,1]=4 2466 B15R1.28955 NC(CC1=CC(=C(C(=C1)Cl)O)Cl)C(=O)O MCULE-3657815295 [0,2,0,0,0,0|1,0,1]=4 2467 B15R1.28955 NC(CC1=CC(=C(C(=C1)F)O)F)C(=O)O MCULE-8487991141 [0,2,0,0,0,0|1,0,1]=4 2468 B15R1.28955 NC(CC1=CC(=C(C(=C1)I)O)I)C(=O)O MCULE-1616749918 [0,2,0,0,0,0|1,0,1]=4 2469 B15R1.28955 NC(CC1=CC(=C(C(=C1)I)O)I)C(=O)O MCULE-1965639885 [0,2,0,0,0,0|1,0,1]=4 2470 B15R1.28955 NC1=CC(=CC(=C1O)N)C[C@H](N)C(=O)O MCULE-5978028537 [0,2,0,0,0,0|1,0,1]=4 2471 B15R1.28955 N[C@@H](CC1=CC(=C(C(=C1)Br)O)Br)C(=O)O MCULE-8410912496 [0,2,0,0,0,0|1,0,1]=4 2472 B15R1.28955 N[C@@H](CC1=CC(=C(C(=C1)Br)O)Br)C(=O)O MCULE-9516823368 [0,2,0,0,0,0|1,0,1]=4 2473 B15R1.28955 N[C@@H](CC1=CC(=C(C(=C1)Cl)O)Cl)C(=O)O MCULE-1219203098 [0,2,0,0,0,0|1,0,1]=4 2474 B15R1.28955 N[C@@H](CC1=CC(=C(C(=C1)Cl)O)Cl)C(=O)O MCULE-8663520163 [0,2,0,0,0,0|1,0,1]=4 2475 B15R1.28955 N[C@@H](CC1=CC(=C(C(=C1)F)O)F)C(=O)O MCULE-4142079700 [0,2,0,0,0,0|1,0,1]=4 2476 B15R1.28955 N[C@@H](CC1=CC(=C(C(=C1)F)O)F)C(=O)O MCULE-5983808972 [0,2,0,0,0,0|1,0,1]=4 2477 B15R1.28955 N[C@@H](CC1=CC(=C(C(=C1)F)O)F)C(=O)O MCULE-9134060130 [0,2,0,0,0,0|1,0,1]=4 2478 B15R1.28955 N[C@@H](CC1=CC(=C(C(=C1)I)O)I)C(=O)O MCULE-2428039618 [0,2,0,0,0,0|1,0,1]=4 2479 B15R1.28955 N[C@@H](CC1=CC(=C(C(=C1)I)O)I)C(=O)O MCULE-3219127934 [0,2,0,0,0,0|1,0,1]=4 2480 B15R1.28955 N[C@H](CC1=CC(=C(C(=C1)Br)O)Br)C(=O)O MCULE-6979596463 [0,2,0,0,0,0|1,0,1]=4 2481 B15R1.28955 N[C@H](CC1=CC(=C(C(=C1)Br)O)Br)C(=O)O MCULE-7323663103 [0,2,0,0,0,0|1,0,1]=4 2482 B15R1.28955 N[C@H](CC1=CC(=C(C(=C1)I)O)I)C(=O)O MCULE-1037881535 [0,2,0,0,0,0|1,0,1]=4 2483 B15R1.28955 N[C@H](CC1=CC(=C(C(=C1)I)O)I)C(=O)O MCULE-2649053573 [0,2,0,0,0,0|1,0,1]=4 2484 B15R1.28955 N[C@H](CC1=CC(=C(C(=C1)I)O)I)C(=O)O MCULE-3002342156 [0,2,0,0,0,0|1,0,1]=4 2485 B15R1.28955 N[C@H](CC1=CC(=C(C(=C1)I)O)I)C(=O)O MCULE-8023653344 [0,2,0,0,0,0|1,0,1]=4 2486 B15R1.28955 O=C(O)C(=CC1=CC(=C(C(=C1)I)O)I)O MCULE-2240790415 [0,2,0,0,0,0|0,0,2]=4 2487 B15R1.28955 O=C(O)C(=O)CC1=CC(=C(C(=C1)I)O)I MCULE-6159082409 [0,2,0,0,0,0|0,0,0]=2 2488 B15R1.3552 CC1=CC(=C(C(=C1)C)NC(=O)C(=O)O)C MCULE-6397913790 [0,2,0,0,0,0|2,0,0]=4 2489 B15R1.3552 CC1=CC(=CC(=C1CC(N)C(=O)O)C)O MCULE-3528979301 [0,2,0,0,0,0|1,0,1]=4 2490 B15R1.3552 CC1=CC(=CC(=C1CC(N)C(=O)O)C)O MCULE-4096674612 [0,2,0,0,0,0|1,0,1]=4 2491 B15R1.3552 CC1=CC(=CC(=C1CC(N)C(=O)O)C)O MCULE-6434365773 [0,2,0,0,0,0|1,0,1]=4 2492 B15R1.3552 CC1=CC(=CC(=C1CC(N)C(=O)O)C)O MCULE-6538588246 [0,2,0,0,0,0|1,0,1]=4 2493 B15R1.3552 CC1=CC(=CC(=C1C[C@@H](N)C(=O)O)C)O MCULE-1921088727 [0,2,0,0,0,0|1,0,1]=4 2494 B15R1.3552 CC1=CC(=CC(=C1C[C@@H](N)C(=O)O)C)O MCULE-5039746762 [0,2,0,0,0,0|1,0,1]=4 2495 B15R1.3552 CC1=CC(=CC(=C1C[C@@H](N)C(=O)O)C)O MCULE-6653767064 [0,2,0,0,0,0|1,0,1]=4 2496 B15R1.3552 CC1=CC(=CC(=C1C[C@@H](N)C(=O)O)C)O MCULE-9366808925 [0,2,0,0,0,0|1,0,1]=4 2497 B15R1.3552 CC1=CC(=CC(=C1C[C@H](C)C(=O)O)C)O MCULE-4421952936 [0,2,0,0,0,0|1,0,1]=4 2498 B15R1.3552 CC1=CC(=CC(=C1C[C@H](C)C(=O)O)C)O MCULE-6207057400 [0,2,0,0,0,0|1,0,1]=4 2499 B15R1.3552 CC1=CC(=CC(=C1C[C@H](N)C(=O)O)C)O MCULE-5420373170 [0,2,0,0,0,0|1,0,1]=4 2500 B15R1.3552 CC1=CC(=CC(=C1C[C@H](N)C(=O)O)C)O MCULE-6297085956 [0,2,0,0,0,0|1,0,1]=4 2501 B15R1.3552 CC1=CC(=CC(=C1C[C@H](N)C(=O)O)C)O MCULE-7986194105 [0,2,0,0,0,0|1,0,1]=4 2502 B15R1.3552 CC1=CC(=CC(=C1C[C@H](N)C(=O)O)C)O MCULE-9474098059 [0,2,0,0,0,0|1,0,1]=4 2503 B15R1.3552 N[C@@H](CC1=C(C=C(C=C1F)O)F)C(=O)O MCULE-1101977882 [0,2,0,0,0,0|1,0,1]=4 2504 B15R1.3552 N[C@@H](CC1=C(C=C(C=C1F)O)F)C(=O)O MCULE-4942603585 [0,2,0,0,0,0|1,0,1]=4 2505 B13R2.155 CC1=CC=C2C=CC(=O)OC2=C1 MCULE-2415904047 [1,0,0,1,0,0|1,0,1]=4 2506 B13R2.155 NC1=CC2=C(C=CC(=O)O2)C=C1 MCULE-7327867052 [1,0,0,1,0,0|1,0,1]=4 2507 B13R2.155 O=C1C=CC2=C(O1)C=C(C=C2)Br MCULE-2559035501 [1,0,0,1,0,0|1,0,1]=4 2508 B13R2.155 O=C1C=CC2=C(O1)C=C(C=C2)Cl MCULE-2787520400 [1,0,0,1,0,0|1,0,1]=4 2509 B13R2.155 O=C1C=CC2=C(O1)C=C(C=C2)F MCULE-9052691894 [1,0,0,1,0,0|1,0,1]=4 2510 B13R2.155 O=C1C=CC2=CC=C(C=C2N1)O MCULE-3037006214 [1,0,0,1,0,0|1,0,1]=4 2511 B13R2.155 O=C1C=CC2=CC=C(C=C2O1)O MCULE-5007617058 [1,0,0,1,0,0|0,0,1]=3 2512 B13R2.155 O=C1CCC2=C(C1)C=C(C=C2)O MCULE-5192490745 [1,0,0,1,0,0|1,0,1]=4 2513 B13R2.155 O=C1CCC2=C(O1)C=C(C=C2)Br MCULE-2010710950 [1,0,0,1,0,0|1,0,1]=4 2514 B13R2.155 O=C1CCC2=C(O1)C=C(C=C2)O MCULE-6746977571 [1,0,0,1,0,0|0,0,1]=3 2515 B13R2.155 O=C1NCC2=C(O1)C=C(C=C2)O MCULE-4827911064 [1,0,0,1,0,0|1,0,0]=3 2516 B13R2.155 OC1=CC2=C(C=C1)C=CC(=C2)O MCULE-7424967710 [1,0,0,1,0,0|1,0,1]=4 2517 B13R2.155 OC1=CC=C2CCC(=NC2=C1)O MCULE-7778836604 [1,0,0,1,0,0|1,0,1]=4 2518 B13R2.4930 CC1=CC2=C(C=C1)CC2C(=O)O MCULE-7386817391 [1,0,0,1,0,0|1,0,1]=4 2519 B13R2.4930 O=C(O)C1CC2=C1C=C(C=C2)Cl MCULE-5001801283 [1,0,0,1,0,0|1,0,1]=4 2520 B13R2.4930 O=C(O)C1CC2=C1C=C(C=C2)F MCULE-2875865098 [1,0,0,1,0,0|1,0,1]=4 2521 B13R2.369 CC1=CC2=C(C=CC=C2)OC1=O MCULE-1111698914 [1,0,0,1,0,0|1,0,1]=4 2522 B13R2.369 CN1CC2=C(C=CC=C2)OC1=O MCULE-4474226504 [1,0,0,1,0,0|2,0,0]=4 2523 B13R2.369 NC1=CC2=CC=CC=C2OC1=O MCULE-7196390822 [1,0,0,1,0,0|1,0,1]=4 2524 B13R2.369 NC1=NC2=C(C=CC=C2)OC1=O MCULE-2400048476 [1,0,0,1,0,0|2,0,0]=4 2525 B13R2.369 O=C1N=C2C=CC=CC2=NC1=O MCULE-6044433953 [1,0,0,1,0,0|2,0,0]=4 2526 B13R2.369 O=C1NC2=C(C=CC=C2)C=C1O MCULE-1635902857 [1,0,0,1,0,0|2,0,0]=4 2527 B13R2.369 O=C1NC2=CC=CC=C2NC1=O MCULE-6753530638 [1,0,0,1,0,0|2,0,0]=4 2528 B13R2.369 O=C1NC2=CC=CC=C2OC1=O MCULE-3913603886 [1,0,0,1,0,0|1,0,0]=3 2529 B13R2.369 O=C1OC2=C(C=CC=C2)C=C1Cl MCULE-3866317668 [1,0,0,1,0,0|1,0,1]=4 2530 B13R2.369 O=C1OC2=C(C=CC=C2)C=C1O MCULE-4074896000 [1,0,0,1,0,0|0,0,2]=4 2531 B13R2.369 O=C1OC2=C(C=CC=C2)N=C1Cl MCULE-4606825528 [1,0,0,1,0,0|2,0,0]=4 2532 B13R2.369 O=C1OC2=C(C=CC=C2)OC1=O MCULE-4510405652 [1,0,0,1,0,0|1,0,0]=3 2533 B13R2.369 O=C1OC2=CC=CC=C2C=C1Br MCULE-3891577553 [1,0,0,1,0,0|1,0,1]=4 2534 B13R2.423 O=C(O)C1CC1C2=CC=CC=C2 MCULE-4945206002 [1,0,0,1,0,0|1,0,1]=4 2535 B13R2.423 O=C(O)C1OC1C2=CC=CC=C2 MCULE-3727767896 [1,0,0,1,0,0|0,0,2]=4 2536 B13R2.423 O=C(O)[C@@H]1C[C@@H]1C2=CC=CC=C2 MCULE-2192210615 [1,0,0,1,0,0|1,0,1]=4 2537 B13R2.423 O=C(O)[C@@H]1C[C@@H]1C2=CC=CC=C2 MCULE-2860569521 [1,0,0,1,0,0|1,0,1]=4 2538 B13R2.423 O=C(O)[C@@H]1C[C@@H]1C2=CC=CC=C2 MCULE-3348394121 [1,0,0,1,0,0|1,0,1]=4 2539 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CC=C2 MCULE-3210600666 [1,0,0,1,0,0|1,0,1]=4 2540 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CC=C2 MCULE-4561189919 [1,0,0,1,0,0|1,0,1]=4 2541 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CC=C2 MCULE-5985179860 [1,0,0,1,0,0|1,0,1]=4 2542 B13R2.423 O=C(O)[C@H]1C[C@@H]1C2=CC=CC=C2 MCULE-1690730677 [1,0,0,1,0,0|1,0,1]=4 2543 B13R2.423 O=C(O)[C@H]1C[C@@H]1C2=CC=CC=C2 MCULE-6690615833 [1,0,0,1,0,0|1,0,1]=4 2544 B13R2.423 O=C(O)[C@H]1C[C@H]1C2=CC=CC=C2 MCULE-1673792789 [1,0,0,1,0,0|1,0,1]=4 2545 B13R2.423 O=C(O)[C@H]1C[C@H]1C2=CC=CC=C2 MCULE-6444612585 [1,0,0,1,0,0|1,0,1]=4 2546 B13R2.435 O=C(O)C1=CC2=C(C1)C=CC=C2 MCULE-2006282606 [1,0,0,1,0,0|1,0,0]=3 2547 B13R2.435 O=C(O)C1=CC2=C(N1)C=CC=C2 MCULE-2072698467 [1,0,0,1,0,0|1,0,1]=4 2548 B13R2.435 O=C(O)C1=CC2=C(O1)C=CC=C2 MCULE-5646971945 [1,0,0,1,0,0|0,0,2]=4 2549 B13R2.435 O=C(O)C1=CC2=C(S1)C=CC=C2 MCULE-6165149428 [1,0,0,1,0,0|0,1,1]=4 2550 B13R2.435 O=C(O)C1=CC2=C([Se]1)C=CC=C2 MCULE-8555452372 [1,0,0,1,0,0|0,1,1]=4 2551 B13R2.435 O=C(O)C1=NC2=C(N1)C=CC=C2 MCULE-1651833296 [1,0,0,1,0,0|2,0,0]=4 2552 B13R2.435 O=C(O)C1=NC2=CC=CC=C2N1 MCULE-7276869954 [1,0,0,1,0,0|2,0,0]=4 2553 B13R2.435 O=C(O)C1=NC2=CC=CC=C2O1 MCULE-7872604073 [1,0,0,1,0,0|1,0,1]=4 2554 B13R2.435 O=C(O)C1=NC2=CC=CC=C2S1 MCULE-7842106080 [1,0,0,1,0,0|1,1,0]=4 2555 B13R2.435 O=C(O)C1CC2=C(N1)C=CC=C2 MCULE-2562454412 [1,0,0,1,0,0|1,0,1]=4 2556 B13R2.435 O=C(O)C1CC2=C(N1)C=CC=C2 MCULE-7215841209 [1,0,0,1,0,0|1,0,1]=4 2557 B13R2.435 O=C(O)C1CC2=CC=CC=C2C1 MCULE-3552591967 [1,0,0,1,0,0|1,0,1]=4 2558 B13R2.435 O=C(O)C1CC2=CC=CC=C2O1 MCULE-7206708690 [1,0,0,1,0,0|0,0,2]=4 2559 B13R2.435 O=C(O)C1CC2=CC=CC=C2S1 MCULE-1880873093 [1,0,0,1,0,0|0,1,1]=4 2560 B13R2.435 O=C(O)[C@@H]1CC2=C(N1)C=CC=C2 MCULE-7672663112 [1,0,0,1,0,0|1,0,1]=4 2561 B13R2.435 O=C(O)[C@@H]1CC2=CC=CC=C2N1 MCULE-8181141847 [1,0,0,1,0,0|1,0,1]=4 2562 B13R2.435 O=C(O)[C@H]1CC2=C(N1)C=CC=C2 MCULE-1818842898 [1,0,0,1,0,0|1,0,1]=4 2563 B13R2.435 O=C(O)[C@H]1CC2=C(N1)C=CC=C2 MCULE-5551098234 [1,0,0,1,0,0|1,0,1]=4 2564 B13R2.43 O=CC1=CC2=C(N1)C=CC(=C2)O MCULE-8850924149 [1,0,0,1,0,0|2,0,0]=4 2565 B13R2.43 O=CC1=NC2=CC(=CC=C2S1)O MCULE-2114254714 [1,0,0,1,0,0|2,0,0]=4 2566 B13R2.43 O=CC1=NC2=CC=C(C=C2S1)O MCULE-2234519694 [1,0,0,1,0,0|1,1,0]=4 2567 B13R2.3028 CC1=CC2=C(C=C1)NC(=O)C2=O MCULE-1468573844 [1,0,0,1,0,0|2,0,0]=4 2568 B13R2.3028 CC1=CC2=C(C=C1)SC(=O)C2=O MCULE-7098744358 [1,0,0,1,0,0|2,0,0]=4 2569 B13R2.3028 CN1C(=O)CC2=C1C=C(C=C2)O MCULE-9092764538 [1,0,0,1,0,0|2,0,0]=4 2570 B13R2.3028 CN1CC2=CC=C(C=C2C1=O)O MCULE-8613568498 [1,0,0,1,0,0|2,0,0]=4 2571 B13R2.3028 NC1=CC=C2NC(=O)C(=O)C2=C1 MCULE-3199559430 [1,0,0,1,0,0|2,0,0]=4 2572 B13R2.3028 NC1=CC=C2NC(=O)C(=O)C2=C1 MCULE-7892277417 [1,0,0,1,0,0|2,0,0]=4 2573 B13R2.3028 O=C1NC2=C(C1=O)C=C(C=C2)Br MCULE-7183184474 [1,0,0,1,0,0|2,0,0]=4 2574 B13R2.3028 O=C1NC2=C(C1=O)C=C(C=C2)Cl MCULE-6950215786 [1,0,0,1,0,0|2,0,0]=4 2575 B13R2.3028 O=C1NC2=C(C1=O)C=C(C=C2)F MCULE-1624734258 [1,0,0,1,0,0|2,0,0]=4 2576 B13R2.3028 O=C1NC2=C(C1=O)C=C(C=C2)O MCULE-4801677498 [1,0,0,1,0,0|1,0,0]=3 2577 B13R2.3028 O=C1NC2=CC=C(C=C2C1=O)I MCULE-7165182272 [1,0,0,1,0,0|2,0,0]=4 2578 B13R2.3683 O=C1C=CC2=CC(=CC=C2O1)O MCULE-6489847953 [1,0,0,1,0,0|2,0,0]=4 2579 B13R2.3683 O=C1CC2=C(C=C(C=C2)O)CN1 MCULE-2690679179 [1,0,0,1,0,0|2,0,0]=4 2580 B13R2.3683 O=C1CCC2=C(C1)C=CC(=C2)O MCULE-7690640656 [1,0,0,1,0,0|1,0,1]=4 2581 B13R2.3683 O=C1COC2=C(C1)C=CC(=C2)Br MCULE-2429357696 [1,0,0,1,0,0|1,0,1]=4 2582 B13R2.3683 O=C1COC2=CC(=CC=C2C1)Cl MCULE-8248917022 [1,0,0,1,0,0|1,0,1]=4 2583 B13R2.3683 O=C1COC2=CC(=CC=C2N1)O MCULE-4723678580 [1,0,0,1,0,0|1,0,1]=4 2584 B13R2.5190 CC1=CC=C2C(=O)C(=O)NC2=C1 MCULE-8730957612 [0,0,0,1,1,0|2,0,0]=4 2585 B13R2.5190 CN1C(=O)OC2=CC(=CC=C12)O MCULE-6686441384 [0,0,0,1,1,0|2,0,0]=4 2586 B13R2.5190 O=C1NC2=C(C1=O)C=CC(=C2)Br MCULE-9349038819 [0,0,0,1,1,0|2,0,0]=4 2587 B13R2.5190 O=C1NC2=C(C1=O)C=CC(=C2)O MCULE-7096270203 [0,0,0,1,1,0|1,0,0]=3 2588 B13R2.5190 O=C1NC2=CC(=CC=C2C1=O)Cl MCULE-8495842687 [0,0,0,1,1,0|2,0,0]=4 2589 B13R2.5190 O=C1NC2=CC(=CC=C2C1=O)F MCULE-7346276869 [0,0,0,1,1,0|2,0,0]=4 2590 B13R2.5190 O=C1NC2=CC(=CC=C2C1=O)I MCULE-2114244883 [0,0,0,1,1,0|2,0,0]=4 2591 B15R2.307 CC1=CC=C(C=C1)C2=CC(=O)C(=O)O2 MCULE-1457083887 [0,0,0,1,0,1|1,0,1]=4 2592 B15R2.7174 CC1=CC2=C(C=C1)OCC(=C2)C(=O)O MCULE-4703688230 [0,0,0,1,0,1|2,0,0]=4 2593 B15R2.7174 O=C(O)C1=CC2=C(C=CC(=C2)Br)OC1 MCULE-8212665432 [0,0,0,1,0,1|2,0,0]=4 2594 B15R2.7174 O=C(O)C1=CC2=C(C=CC(=C2)Cl)OC1 MCULE-4419791875 [0,0,0,1,0,1|2,0,0]=4 2595 B15R2.7174 O=C(O)C1=CC2=C(C=CC(=C2)F)OC1 MCULE-8095321735 [0,0,0,1,0,1|2,0,0]=4 2596 B15R2.7174 O=C(O)C1=CC2=CC(=CC=C2N=C1)O MCULE-8921308073 [0,0,0,1,0,1|1,0,1]=4 2597 B15R2.7174 O=C(O)C1=CC=C2C=CC(=CC2=C1)O MCULE-2450622052 [0,0,0,1,0,1|1,0,1]=4 2598 B15R2.7174 O=C(O)C1=NC2=CC(=CC=C2C=C1)O MCULE-4161695045 [0,0,0,1,0,1|1,0,1]=4 2599 B15R2.7174 O=C(O)C1CC2=CC(=CC=C2CN1)O MCULE-9994538164 [0,0,0,1,0,1|1,0,1]=4 2600 B15R2.7174 O=C(O)C1CCC2=C(C1)C=C(C=C2)O MCULE-3667283732 [0,0,0,1,0,1|1,0,1]=4 2601 B15R2.7174 O=C(O)C1CCC2=CC=C(C=C2O1)O MCULE-8766573842 [0,0,0,1,0,1|0,0,2]=4 2602 B15R2.7174 O=C(O)C1COC2=C(O1)C=C(C=C2)O MCULE-5644990151 [0,0,0,1,0,1|0,0,2]=4 2603 B15R2.7174 O=C(O)[C@@H]1CC2=C(C=CC(=C2)O)CN1 MCULE-1770004260 [0,0,0,1,0,1|1,0,1]=4 2604 B15R2.98 O=C1NC(CO1)CC2=CC=C(C=C2)O MCULE-6997341284 [0,0,0,1,0,1|1,0,1]=4 2605 B15R2.309 CC1=CC=C(C=C1)C2CC(=O)NC2=O MCULE-6426344457 [0,0,0,1,0,1|2,0,0]=4 2606 B15R2.309 CC1=CC=C(C=C1)C2CC(=O)OC2=O MCULE-4893463469 [0,0,0,1,0,1|2,0,0]=4 2607 B15R2.309 CC1=CC=C(C=C1)C2NC(=O)NC2=O MCULE-6716262262 [0,0,0,1,0,1|2,0,0]=4 2608 B15R2.309 CC1=CC=C(C=C1)C2OC(=NC2=O)N MCULE-8231157457 [0,0,0,1,0,1|2,0,0]=4 2609 B15R2.309 NC1=CC=C(C=C1)C2CC(=O)NC2=O MCULE-7310985704 [0,0,0,1,0,1|2,0,0]=4 2610 B15R2.309 NC1=CC=C(C=C1)C2NC(=O)NC2=O MCULE-4117502060 [0,0,0,1,0,1|2,0,0]=4 2611 B15R2.309 NC1=CC=C(C=C1)C2NC(=O)NC2=O MCULE-9358046207 [0,0,0,1,0,1|2,0,0]=4 2612 B15R2.309 O=C1CC(=O)C(N1)C2=CC=C(C=C2)Br MCULE-6903330810 [0,0,0,1,0,1|2,0,0]=4 2613 B15R2.309 O=C1CC(C(=O)N1)C2=CC=C(C=C2)Br MCULE-5300634578 [0,0,0,1,0,1|2,0,0]=4 2614 B15R2.309 O=C1CC(C(=O)N1)C2=CC=C(C=C2)Cl MCULE-1347738736 [0,0,0,1,0,1|2,0,0]=4 2615 B15R2.309 O=C1CC(C(=O)N1)C2=CC=C(C=C2)F MCULE-5416390662 [0,0,0,1,0,1|2,0,0]=4 2616 B15R2.309 O=C1CC(C(=O)N1)C2=CC=C(C=C2)O MCULE-7549769072 [0,0,0,1,0,1|1,0,0]=3 2617 B15R2.309 O=C1CC(C(=O)O1)C2=CC=C(C=C2)Br MCULE-3942545915 [0,0,0,1,0,1|2,0,0]=4 2618 B15R2.309 O=C1CC(C(=O)O1)C2=CC=C(C=C2)Cl MCULE-5773983159 [0,0,0,1,0,1|2,0,0]=4 2619 B15R2.309 O=C1CC(C(=O)O1)C2=CC=C(C=C2)F MCULE-4673684891 [0,0,0,1,0,1|2,0,0]=4 2620 B15R2.309 O=C1CN(C(=O)N1)C2=CC=C(C=C2)O MCULE-9602428946 [0,0,0,1,0,1|2,0,0]=4 2621 B15R2.309 O=C1NC(=O)C(N1)C2=CC=C(C=C2)Br MCULE-5194636735 [0,0,0,1,0,1|2,0,0]=4 2622 B15R2.309 O=C1NC(=O)C(N1)C2=CC=C(C=C2)Cl MCULE-4605403970 [0,0,0,1,0,1|2,0,0]=4 2623 B15R2.309 O=C1NC(=O)C(N1)C2=CC=C(C=C2)F MCULE-9895492602 [0,0,0,1,0,1|2,0,0]=4 2624 B15R2.309 O=C1NC(=O)C(N1)C2=CC=C(C=C2)I MCULE-9085027209 [0,0,0,1,0,1|2,0,0]=4 2625 B15R2.309 O=C1NC(=O)C(N1)C2=CC=C(C=C2)O MCULE-5638077056 [0,0,0,1,0,1|1,0,0]=3 2626 B15R2.309 O=C1NC(C(=O)O1)C2=CC=C(C=C2)Br MCULE-5910329028 [0,0,0,1,0,1|2,0,0]=4 2627 B15R2.309 O=C1NC(C(=O)O1)C2=CC=C(C=C2)Cl MCULE-9993784230 [0,0,0,1,0,1|2,0,0]=4 2628 B15R2.309 O=C1NC(C(=O)O1)C2=CC=C(C=C2)F MCULE-5740334517 [0,0,0,1,0,1|2,0,0]=4 2629 B15R2.309 O=C1N[C@@H](C(=O)O1)C2=CC=C(C=C2)F MCULE-1494061002 [0,0,0,1,0,1|2,0,0]=4 2630 B15R2.309 O=C1N[C@@H](C(=O)O1)C2=CC=C(C=C2)O MCULE-3344345174 [0,0,0,1,0,1|1,0,0]=3 2631 B15R2.309 O=C1N[C@H](C(=O)O1)C2=CC=C(C=C2)Cl MCULE-1078663432 [0,0,0,1,0,1|2,0,0]=4 2632 B15R2.309 O=C1N[C@H](C(=O)O1)C2=CC=C(C=C2)F MCULE-2743034505 [0,0,0,1,0,1|2,0,0]=4 2633 B15R2.7204 CC(=O)N1C(=O)CC2=C1C=C(C=C2)Br MCULE-3130300564 [0,0,0,1,0,1|2,0,0]=4 2634 B15R2.7204 CC1=C(C2=C(N1)C=CC(=C2)O)C(=O)O MCULE-2514356921 [0,0,0,1,0,1|2,0,0]=4 2635 B15R2.7204 CC1=C(C2=C(O1)C=CC(=C2)O)C(=O)O MCULE-5913259130 [0,0,0,1,0,1|2,0,0]=4 2636 B15R2.7204 O=C(O)C1C(=O)NC2=C1N=C(C=C2)O MCULE-6606527122 [0,0,0,1,0,1|2,0,0]=4 2637 B15R2.7252 O=C(O)CC1=CC2=C(N1)C=CC(=C2)O MCULE-2209370034 [0,0,0,1,0,1|2,0,0]=4 2638 B15R2.7252 O=C(O)CC1CC2=C(C1)C=C(C=C2)O MCULE-4855373269 [0,0,0,1,0,1|1,0,1]=4 2639 B15R2.7252 O=C(O)CC1CC2=C(O1)C=C(C=C2)O MCULE-8546336326 [0,0,0,1,0,1|0,0,2]=4 2640 B15R2.451 COC1=CC=C(C=C1)C2CC2C(=O)O MCULE-4089933930 [0,1,0,1,0,0|1,0,1]=4 2641 B15R2.451 COC1=CC=C(C=C1)C2OC2C(=O)O MCULE-1934934826 [0,1,0,1,0,0|0,0,2]=4 2642 B15R2.451 COC1=CC=C(C=C1)[C@@H]2C[C@H]2C(=O)O MCULE-7166143073 [0,1,0,1,0,0|1,0,1]=4 2643 B15R2.451 COC1=CC=C(C=C1)[C@H]2C[C@@H]2C(=O)O MCULE-7321139419 [0,1,0,1,0,0|1,0,1]=4 2644 B15R2.4834 COC1=CC2=C(C=C1)N=C(S2)C(=O)O MCULE-5261994676 [0,1,0,1,0,0|1,1,0]=4 2645 B15R2.4834 COC1=CC2=C(C=C1)OC(=N2)C(=O)O MCULE-7115373627 [0,1,0,1,0,0|2,0,0]=4 2646 B15R2.4834 COC1=CC2=C(C=C1)SC(=N2)C(=O)O MCULE-2819995000 [0,1,0,1,0,0|2,0,0]=4 2647 B15R2.4834 COC1=CC=C2C=C(NC2=C1)C(=O)O MCULE-9779495169 [0,1,0,1,0,0|1,0,1]=4 2648 B15R2.4834 COC1=CC=C2C=C(OC2=C1)C(=O)O MCULE-6586637543 [0,1,0,1,0,0|0,0,2]=4 2649 B15R2.4834 COC1=CC=C2C=C(SC2=C1)C(=O)O MCULE-1577459000 [0,1,0,1,0,0|0,1,1]=4 2650 B15R2.4834 COC1=CC=C2CC(NC2=C1)C(=O)O MCULE-4641376562 [0,1,0,1,0,0|1,0,1]=4 2651 B15R2.4834 COC1=CC=C2CC(OC2=C1)C(=O)O MCULE-6412237474 [0,1,0,1,0,0|0,0,2]=4 2652 B15R2.4834 COC1=CC=C2N=C(OC2=C1)C(=O)O MCULE-2218792376 [0,1,0,1,0,0|1,0,1]=4 2653 B15R2.4834 COC1=CC=C2NC(=CC2=C1)C(=O)O MCULE-2607079926 [0,1,0,1,0,0|2,0,0]=4 2654 B15R2.4834 COC1=CC=C2NC(=NC2=C1)C(=O)O MCULE-2923330006 [0,1,0,1,0,0|2,0,0]=4 2655 B15R2.4834 COC1=CC=C2OC(=CC2=C1)C(=O)O MCULE-9530119356 [0,1,0,1,0,0|2,0,0]=4 2656 B15R2.4834 COC1=CC=C2SC(=CC2=C1)C(=O)O MCULE-2996887718 [0,1,0,1,0,0|2,0,0]=4 2657 B15R2.21336 COC1=CC2=C(C=C1)C=C(C(=O)O2)N MCULE-5851587912 [0,1,0,1,0,0|1,0,1]=4 2658 B15R2.63893 CC1=C(C(=O)OC2=CC(=CC=C12)O)Br MCULE-7570357423 [0,1,0,1,0,0|1,0,1]=4 2659 B15R2.63893 CC1=C(C(=O)OC2=CC(=CC=C12)O)Cl MCULE-4331289754 [0,1,0,1,0,0|1,0,1]=4 2660 B15R2.63893 CC1=C(C(=O)OC2=CC(=CC=C12)O)F MCULE-1258858376 [0,1,0,1,0,0|1,0,1]=4 2661 B15R2.63893 CC1=C(C2=C(C=C(C=C2)O)OC1=O)C MCULE-1196764977 [0,1,0,1,0,0|1,0,1]=4 2662 B15R2.63893 NC1=C(C2=C(C=C(C=C2)O)OC1=O)O MCULE-6465004163 [0,1,0,1,0,0|1,0,1]=4 2663 B15R2.63893 NC1=C(C2=C(C=C(C=C2)O)OC1=O)O MCULE-8245975845 [0,1,0,1,0,0|1,0,1]=4 2664 B15R2.1510 O=C1OCCC1=CC2=CC=C(C=C2)O MCULE-5784050788 [0,1,0,1,0,0|1,0,1]=4 2665 B15R2.1590 COC(=O)C1=CC2=C(O1)C=C(C=C2)O MCULE-7826968443 [0,1,0,1,0,0|0,0,2]=4 2666 B15R2.1590 COC(=O)C1=CC2=CC(=CC=C2N1)O MCULE-3237848354 [0,1,0,1,0,0|2,0,0]=4 2667 B15R2.1590 COC(=O)C1=CC2=CC(=CC=C2O1)O MCULE-4171789060 [0,1,0,1,0,0|2,0,0]=4 2668 B15R2.1590 COC(=O)C1=CC2=CC(=CC=C2S1)O MCULE-7109136207 [0,1,0,1,0,0|2,0,0]=4 2669 B15R2.1590 COC(=O)C1=CC2=CC=C(C=C2N1)O MCULE-5358480402 [0,1,0,1,0,0|1,0,1]=4 2670 B15R2.1590 COC(=O)C1=NC2=CC(=CC=C2S1)O MCULE-6367103828 [0,1,0,1,0,0|2,0,0]=4 2671 B15R2.1590 COC(=O)C1=NC2=CC=C(C=C2S1)O MCULE-2370659063 [0,1,0,1,0,0|1,1,0]=4 2672 B15R2.1590 COC(=O)C1CC2=CC=C(C=C2O1)O MCULE-2595255058 [0,1,0,1,0,0|0,0,2]=4 2673 B15R2.1824 O=CC1=CC2=CC(=CC=C2OC1=O)O MCULE-2387332052 [0,1,0,1,0,0|2,0,0]=4 2674 B15R2.1754 N#CC1=CC2=CC=C(C=C2OC1=O)O MCULE-7704175572 [0,1,0,1,0,0|1,0,1]=4 2675 B15R2.1754 O=CC1=CC2=CC=C(C=C2OC1=O)O MCULE-8929419979 [0,1,0,1,0,0|0,0,1]=3 2676 B15R2.6979 O=C(O)C1(CC1)CC2=CC=C(C=C2)O MCULE-3141181253 [0,1,0,1,0,0|1,0,1]=4 2677 B15R2.7180 O=C(O)C1=CC2=C(C=C(C=C2)O)CC1 MCULE-8693038698 [0,1,0,1,0,0|1,0,1]=4 2678 B15R2.7180 O=C(O)C1=CC2=C(C=C(C=C2)O)N=C1 MCULE-1400918653 [0,1,0,1,0,0|1,0,1]=4 2679 B15R2.7180 O=C(O)C1=CC2=C(C=C1)C=C(C=C2)O MCULE-4871945782 [0,1,0,1,0,0|1,0,1]=4 2680 B15R2.7180 O=C(O)C1=CC2=CC=C(C=C2N=C1)O MCULE-8472040934 [0,1,0,1,0,0|1,0,1]=4 2681 B15R2.7180 O=C(O)C1=NC2=C(C=C1)C=C(C=C2)O MCULE-5262349085 [0,1,0,1,0,0|2,0,0]=4 2682 B15R2.7180 O=C(O)C1CC2=C(C=C(C=C2)O)CN1 MCULE-1383594891 [0,1,0,1,0,0|1,0,1]=4 2683 B15R2.7180 O=C(O)C1CC2=C(C=C(C=C2)O)CN1 MCULE-9280520247 [0,1,0,1,0,0|1,0,1]=4 2684 B15R2.7180 O=C(O)C1COC2=C(C1)C=CC(=C2)O MCULE-5783041391 [0,1,0,1,0,0|0,0,2]=4 2685 B15R2.7180 O=C(O)[C@@H]1CC2=C(C=C(C=C2)O)CN1 MCULE-7132136238 [0,1,0,1,0,0|1,0,1]=4 2686 B15R2.7180 O=C(O)[C@@H]1CC2=C(C=C(C=C2)O)CN1 MCULE-7616794897 [0,1,0,1,0,0|1,0,1]=4 2687 B15R2.7180 O=C(O)[C@H]1CC2=C(C=C(C=C2)O)CN1 MCULE-1440525296 [0,1,0,1,0,0|1,0,1]=4 2688 B15R2.7180 O=C(O)[C@H]1CC2=C(C=C(C=C2)O)CN1 MCULE-5574496709 [0,1,0,1,0,0|1,0,1]=4 2689 B15R2.1102 O=C(O)C1=CC2=C(N1)C=C(C(=C2)O)O MCULE-1570636484 [0,1,0,1,0,0|1,0,1]=4 2690 B15R2.1102 O=C(O)C1=CC2=C(S1)C=C(C(=C2)O)O MCULE-3402675689 [0,1,0,1,0,0|0,1,1]=4 2691 B15R2.62227 CC1=CC2=CC(=C(C=C2OC1=O)O)O MCULE-9639451464 [0,1,0,1,0,0|1,0,1]=4 2692 B15R2.62227 NC1CC2=C(C=C(C(=C2)O)O)OC1=O MCULE-4143419133 [0,1,0,1,0,0|1,0,1]=4 2693 B15R2.62227 N[C@H]1CC2=C(C=C(C(=C2)O)O)OC1=O MCULE-9213968469 [0,1,0,1,0,0|1,0,1]=4 2694 B15R2.62227 N[C@H]1CC2=C(C=C(C(=C2)O)O)OC1=O MCULE-9679632698 [0,1,0,1,0,0|1,0,1]=4 2695 B15R2.62227 [NH3+]C1CC2=CC(=C(C=C2OC1=O)O)O MCULE-7086909276 [0,1,0,1,0,0|1,0,1]=4 2696 B11R1.35 O=C(O)C(=O)CC1=CC=CS1 MCULE-8806340356 [1,0,0,0,1,0|1,0,0]=3 2697 B11R1.35 O=C(O)C(=O)CC1=CNC=N1 MCULE-3580978419 [1,0,0,0,1,0|2,0,0]=4 2698 B11R1.36 C(O)(C(=O)O)C1=CC=CC=C1 MCULE-3645088931 [1,0,0,0,1,0|0,0,2]=4 2699 B11R1.36 C=C(C(=O)Cl)C1=CC=CC=C1 MCULE-8710211843 [1,0,0,0,1,0|2,0,0]=4 2700 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 MCULE-5986972742 [1,0,0,0,1,0|1,0,0]=3 2701 B11R1.36 C=C(C(=O)O)C1=CC=NC=C1 MCULE-7866320740 [1,0,0,0,1,0|2,0,0]=4 2702 B11R1.36 C=C(C)C(=O)C1=CC=CC=C1 MCULE-8641510738 [1,0,0,0,1,0|2,0,0]=4 2703 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 MCULE-5571144917 [1,0,0,0,1,0|1,0,0]=3 2704 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 MCULE-4465662040 [1,0,0,0,1,0|1,0,1]=4 2705 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 MCULE-4769978518 [1,0,0,0,1,0|1,0,1]=4 2706 B11R1.36 CC(O)C(=O)C1=CC=CC=C1 MCULE-8936145326 [1,0,0,0,1,0|1,0,1]=4 2707 B11R1.36 CN(O)C(=O)C1=CC=CC=C1 MCULE-3815799525 [1,0,0,0,1,0|2,0,0]=4 2708 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 MCULE-3247258409 [1,0,0,0,1,0|1,0,1]=4 2709 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 MCULE-4619212613 [1,0,0,0,1,0|1,0,1]=4 2710 B11R1.36 C[C@H](C(=O)O)C1=CC=CC=C1 MCULE-2457281374 [1,0,0,0,1,0|1,0,1]=4 2711 B11R1.36 C[C@H](C(=O)O)C1=CC=CC=C1 MCULE-5042449970 [1,0,0,0,1,0|1,0,1]=4 2712 B11R1.36 NC(=S)C(=O)C1=CC=CC=C1 MCULE-4583238988 [1,0,0,0,1,0|1,1,0]=4 2713 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 MCULE-1541760076 [1,0,0,0,1,0|1,0,1]=4 2714 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 MCULE-7084105095 [1,0,0,0,1,0|1,0,1]=4 2715 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 MCULE-1151649771 [1,0,0,0,1,0|1,0,1]=4 2716 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 MCULE-4882172946 [1,0,0,0,1,0|1,0,1]=4 2717 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 MCULE-5961405650 [1,0,0,0,1,0|1,0,1]=4 2718 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 MCULE-6391573296 [1,0,0,0,1,0|1,0,1]=4 2719 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 MCULE-6139481120 [1,0,0,0,1,0|1,0,1]=4 2720 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 MCULE-8262037456 [1,0,0,0,1,0|1,0,1]=4 2721 B11R1.36 O=C(C1=CC=CC=C1)C(O)Br MCULE-2312155884 [1,0,0,0,1,0|1,0,1]=4 2722 B11R1.36 O=C(C1=CC=CC=C1)C(O)O MCULE-8391488510 [1,0,0,0,1,0|0,0,2]=4 2723 B11R1.36 O=C(Cl)C(=O)C1=CC=CC=C1 MCULE-8930488500 [1,0,0,0,1,0|1,0,0]=3 2724 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 MCULE-9114449089 [1,0,0,0,1,0|0,0,0]=2 2725 B11R1.36 O=C(O)C(=O)C1=CC=CN=C1 MCULE-3222192839 [1,0,0,0,1,0|1,0,0]=3 2726 B11R1.36 O=C(O)C(Br)C1=CC=CC=C1 MCULE-4937476805 [1,0,0,0,1,0|1,0,1]=4 2727 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 MCULE-8059678553 [1,0,0,0,1,0|1,0,1]=4 2728 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 MCULE-5274925948 [1,0,0,0,1,0|1,0,1]=4 2729 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 MCULE-3206518139 [1,0,0,0,1,0|0,0,2]=4 2730 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 MCULE-3993533957 [1,0,0,0,1,0|0,0,2]=4 2731 B11R1.36 O=C(O)C(S)C1=CC=CC=C1 MCULE-7109199321 [1,0,0,0,1,0|0,1,1]=4 2732 B11R1.36 O=C(O)[C@@H](Br)C1=CC=CC=C1 MCULE-8189789476 [1,0,0,0,1,0|1,0,1]=4 2733 B11R1.36 O=C(O)[C@@H](Cl)C1=CC=CC=C1 MCULE-8175708585 [1,0,0,0,1,0|1,0,1]=4 2734 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 MCULE-5790478734 [1,0,0,0,1,0|0,0,2]=4 2735 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 MCULE-7845432123 [1,0,0,0,1,0|0,0,2]=4 2736 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 MCULE-1756603704 [1,0,0,0,1,0|0,0,2]=4 2737 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 MCULE-7674691218 [1,0,0,0,1,0|0,0,2]=4 2738 B11R1.36 O=C([O-])C(=O)C1=CC=CC=C1 MCULE-2177521486 [1,0,0,0,1,0|0,0,1]=3 2739 B11R1.36 O=C([O-])C(=O)C1=CC=CC=N1 MCULE-6126957711 [1,0,0,0,1,0|1,0,1]=4 2740 B11R1.36 O=C([O-])C(=O)C1=CC=CC=N1 MCULE-9946713163 [1,0,0,0,1,0|1,0,1]=4 2741 B11R1.36 [NH3+]C(C(=O)O)C1=CC=CC=C1 MCULE-9538674888 [1,0,0,0,1,0|1,0,1]=4 2742 B11R1.22 C=CC(=O)C1=CC=C(C=C1)Br MCULE-9312605338 [1,0,0,0,1,0|2,0,0]=4 2743 B11R1.22 C=CC(=O)C1=CC=C(C=C1)Cl MCULE-2637917205 [1,0,0,0,1,0|2,0,0]=4 2744 B11R1.22 C=CC(=O)C1=CC=C(C=C1)F MCULE-5013295279 [1,0,0,0,1,0|2,0,0]=4 2745 B11R1.22 CC(=NO)C1=CC=C(C=C1)O MCULE-7699787838 [1,0,0,0,1,0|2,0,0]=4 2746 B11R1.22 CC1=CC=C(C=C1)C(=O)C=O MCULE-5603578897 [1,0,0,0,1,0|1,0,0]=3 2747 B11R1.22 CC1=CC=C(C=C1)C(=O)CO MCULE-8758040146 [1,0,0,0,1,0|1,0,1]=4 2748 B11R1.22 CC1=CC=C(C=C1)C(=O)NO MCULE-7664165328 [1,0,0,0,1,0|2,0,0]=4 2749 B11R1.22 CCC(=O)C1=CC=C(C=C1)O MCULE-7251046610 [1,0,0,0,1,0|1,0,1]=4 2750 B11R1.22 CNC(=O)C1=CC=C(C=C1)O MCULE-2741654782 [1,0,0,0,1,0|2,0,0]=4 2751 B11R1.22 COC(=O)C1=CC=C(C=C1)O MCULE-5368262482 [1,0,0,0,1,0|2,0,0]=4 2752 B11R1.22 N/C(=N\O)/C1=CC=C(C=C1)O MCULE-7277548656 [1,0,0,0,1,0|2,0,0]=4 2753 B11R1.22 NC1=CC=C(C=C1)C(=O)NO MCULE-7784081826 [1,0,0,0,1,0|2,0,0]=4 2754 B11R1.22 NCC(=O)C1=CC=C(C=C1)O MCULE-5685093129 [1,0,0,0,1,0|1,0,1]=4 2755 B11R1.22 NCC(=O)C1=CC=C(C=C1)O MCULE-5879302050 [1,0,0,0,1,0|1,0,1]=4 2756 B11R1.22 NNC(=O)C1=CC=C(C=C1)O MCULE-1791196578 [1,0,0,0,1,0|2,0,0]=4 2757 B11R1.22 O/N=C(/O)\C1=CC=C(C=C1)O MCULE-7433211147 [1,0,0,0,1,0|1,0,1]=4 2758 B11R1.22 O=C(CBr)C1=CC=C(C=C1)O MCULE-3039597251 [1,0,0,0,1,0|1,0,1]=4 2759 B11R1.22 O=C(CCl)C1=CC=C(C=C1)O MCULE-2774285397 [1,0,0,0,1,0|1,0,1]=4 2760 B11R1.22 O=C(CO)C1=CC=C(C=C1)Br MCULE-5747207409 [1,0,0,0,1,0|1,0,1]=4 2761 B11R1.22 O=C(CO)C1=CC=C(C=C1)Cl MCULE-4166338180 [1,0,0,0,1,0|1,0,1]=4 2762 B11R1.22 O=C(CO)C1=CC=C(C=C1)F MCULE-4339830093 [1,0,0,0,1,0|1,0,1]=4 2763 B11R1.22 O=C(CO)C1=CC=C(C=C1)I MCULE-3612959579 [1,0,0,0,1,0|1,0,1]=4 2764 B11R1.22 O=C(CO)C1=CC=C(C=C1)O MCULE-3870574636 [1,0,0,0,1,0|0,0,1]=3 2765 B11R1.22 O=C(NO)C1=CC=C(C=C1)Br MCULE-4510290140 [1,0,0,0,1,0|2,0,0]=4 2766 B11R1.22 O=C(NO)C1=CC=C(C=C1)Cl MCULE-3055422292 [1,0,0,0,1,0|2,0,0]=4 2767 B11R1.22 O=C(NO)C1=CC=C(C=C1)F MCULE-2404142851 [1,0,0,0,1,0|2,0,0]=4 2768 B11R1.22 O=C(NO)C1=CC=C(C=C1)I MCULE-3184298763 [1,0,0,0,1,0|2,0,0]=4 2769 B11R1.22 O=CC(=O)C1=CC=C(C=C1)Br MCULE-3215150278 [1,0,0,0,1,0|1,0,0]=3 2770 B11R1.22 O=CC(=O)C1=CC=C(C=C1)Cl MCULE-5206246228 [1,0,0,0,1,0|1,0,0]=3 2771 B11R1.22 O=CC(=O)C1=CC=C(C=C1)F MCULE-9845144361 [1,0,0,0,1,0|1,0,0]=3 2772 B11R1.22 O=CC(=O)C1=CC=C(C=C1)O MCULE-5905031919 [1,0,0,0,1,0|0,0,0]=2 2773 B11R1.314 O=C(O)C(=O)C1=CC=C(S1)Br MCULE-8370383819 [0,0,0,0,2,0|2,0,0]=4 2774 B11R1.314 O=C(O)C(=O)C1=CC=C(S1)Cl MCULE-9143047721 [0,0,0,0,2,0|2,0,0]=4 2775 B13R1.513 CC(=O)NCCC1=CC=C(C=C1)O MCULE-9894285650 [1,0,0,0,0,1|1,0,1]=4 2776 B13R1.513 CC(=O)OCCC1=CC=C(C=C1)O MCULE-5545902411 [1,0,0,0,0,1|1,0,1]=4 2777 B13R1.513 CC1=CC=C(C=C1)CCCC(=O)O MCULE-9264700102 [1,0,0,0,0,1|1,0,1]=4 2778 B13R1.513 CC1=CC=C(C=C1)CNCC(=O)O MCULE-2470476224 [1,0,0,0,0,1|1,0,1]=4 2779 B13R1.513 CC1=CC=C(C=C1)CNCC(=O)O MCULE-9439243852 [1,0,0,0,0,1|1,0,1]=4 2780 B13R1.513 CC1=CC=C(C=C1)COCC(=O)O MCULE-9012141447 [1,0,0,0,0,1|1,0,1]=4 2781 B13R1.513 CC1=CC=C(C=C1)CSCC(=O)O MCULE-1969486511 [1,0,0,0,0,1|1,0,1]=4 2782 B13R1.513 CC1=CC=C(C=C1)NCCC(=O)O MCULE-8652681898 [1,0,0,0,0,1|1,0,1]=4 2783 B13R1.513 CC1=CC=C(C=C1)OCCC(=O)O MCULE-9368077352 [1,0,0,0,0,1|1,0,1]=4 2784 B13R1.513 CC1=CC=C(C=C1)SC=CC(=O)O MCULE-5988515588 [1,0,0,0,0,1|1,0,1]=4 2785 B13R1.513 CC1=CC=C(C=C1)SCCC(=O)O MCULE-1755571946 [1,0,0,0,0,1|1,0,1]=4 2786 B13R1.513 NC1=CC=C(C=C1)CCCC(=O)O MCULE-4534927390 [1,0,0,0,0,1|1,0,1]=4 2787 B13R1.513 NC1=CC=C(C=C1)OCCC(=O)O MCULE-6932857541 [1,0,0,0,0,1|1,0,1]=4 2788 B13R1.513 O=C(O)CC=CC1=CC=C(C=C1)F MCULE-6574652903 [1,0,0,0,0,1|1,0,1]=4 2789 B13R1.513 O=C(O)CCCC1=CC=C(C=C1)Br MCULE-3233980702 [1,0,0,0,0,1|1,0,1]=4 2790 B13R1.513 O=C(O)CCCC1=CC=C(C=C1)Cl MCULE-8089882538 [1,0,0,0,0,1|1,0,1]=4 2791 B13R1.513 O=C(O)CCCC1=CC=C(C=C1)F MCULE-6338279408 [1,0,0,0,0,1|1,0,1]=4 2792 B13R1.513 O=C(O)CCCC1=CC=C(C=C1)I MCULE-5120307139 [1,0,0,0,0,1|1,0,1]=4 2793 B13R1.513 O=C(O)CCCC1=CC=C(C=C1)O MCULE-6084225772 [1,0,0,0,0,1|0,0,1]=3 2794 B13R1.513 O=C(O)CCNC1=CC=C(C=C1)Br MCULE-9183981024 [1,0,0,0,0,1|1,0,1]=4 2795 B13R1.513 O=C(O)CCNC1=CC=C(C=C1)Cl MCULE-7907272480 [1,0,0,0,0,1|1,0,1]=4 2796 B13R1.513 O=C(O)CCOC1=CC=C(C=C1)Br MCULE-4054160375 [1,0,0,0,0,1|1,0,1]=4 2797 B13R1.513 O=C(O)CCOC1=CC=C(C=C1)Cl MCULE-1925407378 [1,0,0,0,0,1|1,0,1]=4 2798 B13R1.513 O=C(O)CCOC1=CC=C(C=C1)F MCULE-3183471561 [1,0,0,0,0,1|1,0,1]=4 2799 B13R1.513 O=C(O)CCSC1=CC=C(C=C1)Br MCULE-2054430905 [1,0,0,0,0,1|1,0,1]=4 2800 B13R1.513 O=C(O)CCSC1=CC=C(C=C1)Cl MCULE-9176337975 [1,0,0,0,0,1|1,0,1]=4 2801 B13R1.513 O=C(O)CCSC1=CC=C(C=C1)F MCULE-1982470844 [1,0,0,0,0,1|1,0,1]=4 2802 B13R1.513 O=C(O)CNCC1=CC=C(C=C1)Br MCULE-4700701484 [1,0,0,0,0,1|1,0,1]=4 2803 B13R1.513 O=C(O)CNCC1=CC=C(C=C1)Br MCULE-8611912575 [1,0,0,0,0,1|1,0,1]=4 2804 B13R1.513 O=C(O)CNCC1=CC=C(C=C1)Cl MCULE-6575413490 [1,0,0,0,0,1|1,0,1]=4 2805 B13R1.513 O=C(O)CNCC1=CC=C(C=C1)Cl MCULE-6982527308 [1,0,0,0,0,1|1,0,1]=4 2806 B13R1.513 O=C(O)CNCC1=CC=C(C=C1)F MCULE-2442159290 [1,0,0,0,0,1|1,0,1]=4 2807 B13R1.513 O=C(O)CNCC1=CC=C(C=C1)F MCULE-5020020469 [1,0,0,0,0,1|1,0,1]=4 2808 B13R1.513 O=C(O)CNCC1=CC=C(C=C1)O MCULE-6442035108 [1,0,0,0,0,1|0,0,1]=3 2809 B13R1.513 O=C(O)CNCC1=CC=C(C=C1)O MCULE-9086510260 [1,0,0,0,0,1|0,0,1]=3 2810 B13R1.513 O=C(O)COCC1=CC=C(C=C1)Br MCULE-8289570060 [1,0,0,0,0,1|1,0,1]=4 2811 B13R1.513 O=C(O)COCC1=CC=C(C=C1)F MCULE-9658760132 [1,0,0,0,0,1|1,0,1]=4 2812 B13R1.513 O=C(O)CSCC1=CC=C(C=C1)Br MCULE-4654048658 [1,0,0,0,0,1|1,0,1]=4 2813 B13R1.513 O=C(O)CSCC1=CC=C(C=C1)Cl MCULE-2783761494 [1,0,0,0,0,1|1,0,1]=4 2814 B13R1.513 O=C(O)CSCC1=CC=C(C=C1)F MCULE-1497978694 [1,0,0,0,0,1|1,0,1]=4 2815 B13R1.348 CC(=O)CC(=O)CC1=CC=CC=C1 MCULE-5266500580 [1,0,0,0,0,1|1,0,0]=3 2816 B13R1.348 CC(=O)CC(=O)NC1=CC=CC=C1 MCULE-8887978901 [1,0,0,0,0,1|2,0,0]=4 2817 B13R1.348 CC(=O)CC(=O)OC1=CC=CC=C1 MCULE-3033637525 [1,0,0,0,0,1|2,0,0]=4 2818 B13R1.348 CC(=O)NC(=O)NC1=CC=CC=C1 MCULE-4570583479 [1,0,0,0,0,1|2,0,0]=4 2819 B13R1.348 CN(CC(=O)O)CC1=CC=CC=C1 MCULE-3843466268 [1,0,0,0,0,1|2,0,0]=4 2820 B13R1.348 CN(CC(=O)O)CC1=CC=CC=C1 MCULE-3886065372 [1,0,0,0,0,1|2,0,0]=4 2821 B13R1.348 NC(=O)NC(=O)CC1=CC=CC=C1 MCULE-7359277785 [1,0,0,0,0,1|1,0,0]=3 2822 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 MCULE-7312149583 [1,0,0,0,0,1|1,0,1]=4 2823 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 MCULE-7562642812 [1,0,0,0,0,1|1,0,1]=4 2824 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 MCULE-1099480064 [1,0,0,0,0,1|1,0,1]=4 2825 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 MCULE-1511536989 [1,0,0,0,0,1|1,0,1]=4 2826 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 MCULE-3741596903 [1,0,0,0,0,1|1,0,1]=4 2827 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 MCULE-5386657741 [1,0,0,0,0,1|1,0,1]=4 2828 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 MCULE-1213190445 [1,0,0,0,0,1|1,0,1]=4 2829 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 MCULE-4947387639 [1,0,0,0,0,1|1,0,1]=4 2830 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 MCULE-7320146706 [1,0,0,0,0,1|1,0,1]=4 2831 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 MCULE-9110835818 [1,0,0,0,0,1|1,0,1]=4 2832 B13R1.348 O=C(CC1=CC=CC=C1)CN(=O)=O MCULE-7434543820 [1,0,0,0,0,1|1,0,1]=4 2833 B13R1.348 O=C(Cl)CC(=O)CC1=CC=CC=C1 MCULE-9142165063 [1,0,0,0,0,1|1,0,0]=3 2834 B13R1.348 O=C(O)CC(=O)CC1=CC=CC=C1 MCULE-2648013104 [1,0,0,0,0,1|0,0,0]=2 2835 B13R1.348 O=C(O)CC(=O)NC1=CC=CC=C1 MCULE-6974581142 [1,0,0,0,0,1|1,0,0]=3 2836 B13R1.348 O=C(O)CC(=O)OC1=CC=CC=C1 MCULE-7011371799 [1,0,0,0,0,1|1,0,0]=3 2837 B13R1.348 O=C(O)CC(O)CC1=CC=CC=C1 MCULE-8990071495 [1,0,0,0,0,1|0,0,2]=4 2838 B13R1.351 C/C(=N\NC1=CC=CC=C1)/C(=O)O MCULE-6700497732 [1,0,0,0,0,1|2,0,0]=4 2839 B13R1.351 C=C(C)C(=O)OCC1=CC=CC=C1 MCULE-7867648503 [1,0,0,0,0,1|2,0,0]=4 2840 B13R1.351 CC(=NNC1=CC=CC=C1)C(=O)O MCULE-6990896251 [1,0,0,0,0,1|2,0,0]=4 2841 B13R1.351 CC(=O)C(=O)OCC1=CC=CC=C1 MCULE-9377592448 [1,0,0,0,0,1|1,0,0]=3 2842 B13R1.351 CC(CCC1=CC=CC=C1)C(=O)O MCULE-7379407319 [1,0,0,0,0,1|1,0,1]=4 2843 B13R1.351 CC(COC1=CC=CC=C1)C(=O)O MCULE-9503504513 [1,0,0,0,0,1|1,0,1]=4 2844 B13R1.351 CC(CSC1=CC=CC=C1)C(=O)O MCULE-5686565762 [1,0,0,0,0,1|1,0,1]=4 2845 B13R1.351 CC(NCC1=CC=CC=C1)C(=O)O MCULE-8047591178 [1,0,0,0,0,1|1,0,1]=4 2846 B13R1.351 CC(NCC1=CC=CC=C1)C(=O)O MCULE-9112844841 [1,0,0,0,0,1|1,0,1]=4 2847 B13R1.351 CC(O)C(=O)OCC1=CC=CC=C1 MCULE-9171810637 [1,0,0,0,0,1|1,0,1]=4 2848 B13R1.351 CC(OCC1=CC=CC=C1)C(=O)O MCULE-7789298081 [1,0,0,0,0,1|1,0,1]=4 2849 B13R1.351 CC(OCC1=CC=CC=C1)C(=O)O MCULE-8485315352 [1,0,0,0,0,1|1,0,1]=4 2850 B13R1.351 CC(SCC1=CC=CC=C1)C(=O)O MCULE-3001042921 [1,0,0,0,0,1|1,0,1]=4 2851 B13R1.351 CN(O)C(=O)OCC1=CC=CC=C1 MCULE-7332248169 [1,0,0,0,0,1|2,0,0]=4 2852 B13R1.351 C[C@@H](O)C(=O)OCC1=CC=CC=C1 MCULE-3831906784 [1,0,0,0,0,1|1,0,1]=4 2853 B13R1.351 C[C@@H](O)C(=O)OCC1=CC=CC=C1 MCULE-6634437210 [1,0,0,0,0,1|1,0,1]=4 2854 B13R1.351 C[C@@H](OCC1=CC=CC=C1)C(=O)O MCULE-4434459617 [1,0,0,0,0,1|1,0,1]=4 2855 B13R1.351 C[C@@H](OCC1=CC=CC=C1)C(=O)O MCULE-7168308206 [1,0,0,0,0,1|1,0,1]=4 2856 B13R1.351 C[C@H](NCC1=CC=CC=C1)C(=O)O MCULE-6038689952 [1,0,0,0,0,1|1,0,1]=4 2857 B13R1.351 C[C@H](NCC1=CC=CC=C1)C(=O)O MCULE-8390998499 [1,0,0,0,0,1|1,0,1]=4 2858 B13R1.351 C[C@H](NCC1=CC=CC=C1)C(=O)O MCULE-9525640847 [1,0,0,0,0,1|1,0,1]=4 2859 B13R1.351 C[C@H](O)C(=O)OCC1=CC=CC=C1 MCULE-2293247695 [1,0,0,0,0,1|1,0,1]=4 2860 B13R1.351 C[C@H](O)C(=O)OCC1=CC=CC=C1 MCULE-6954726345 [1,0,0,0,0,1|1,0,1]=4 2861 B13R1.351 C[C@H](OCC1=CC=CC=C1)C(=O)O MCULE-7749356438 [1,0,0,0,0,1|1,0,1]=4 2862 B13R1.351 C[C@H](OCC1=CC=CC=C1)C(=O)O MCULE-8451141700 [1,0,0,0,0,1|1,0,1]=4 2863 B13R1.351 NC(=O)C(=O)NCC1=CN=CC=C1 MCULE-6260811167 [1,0,0,0,0,1|2,0,0]=4 2864 B13R1.351 NC(=S)C(=O)OCC1=CC=CC=C1 MCULE-3556770476 [1,0,0,0,0,1|1,1,0]=4 2865 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O MCULE-5846714028 [1,0,0,0,0,1|1,0,1]=4 2866 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O MCULE-6298102909 [1,0,0,0,0,1|1,0,1]=4 2867 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O MCULE-6801867186 [1,0,0,0,0,1|1,0,1]=4 2868 B13R1.351 NC(CNC1=CC=CC=C1)C(=O)O MCULE-6123987164 [1,0,0,0,0,1|1,0,1]=4 2869 B13R1.351 NC(COC1=CC=CC=C1)C(=O)O MCULE-1983365366 [1,0,0,0,0,1|1,0,1]=4 2870 B13R1.351 NC(CSC1=CC=CC=C1)C(=O)O MCULE-1203820662 [1,0,0,0,0,1|1,0,1]=4 2871 B13R1.351 NC(CSC1=CC=CC=C1)C(=O)O MCULE-9787337080 [1,0,0,0,0,1|1,0,1]=4 2872 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O MCULE-4559879821 [1,0,0,0,0,1|1,0,1]=4 2873 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O MCULE-6703664755 [1,0,0,0,0,1|1,0,1]=4 2874 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O MCULE-6919063042 [1,0,0,0,0,1|1,0,1]=4 2875 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O MCULE-8742414639 [1,0,0,0,0,1|1,0,1]=4 2876 B13R1.351 N[C@@H](CNC1=CC=CC=C1)C(=O)O MCULE-8235847783 [1,0,0,0,0,1|1,0,1]=4 2877 B13R1.351 N[C@@H](COC1=CC=CC=C1)C(=O)O MCULE-3653516384 [1,0,0,0,0,1|1,0,1]=4 2878 B13R1.351 N[C@@H](CSC1=CC=CC=C1)C(=O)O MCULE-3064974464 [1,0,0,0,0,1|1,0,1]=4 2879 B13R1.351 N[C@@H](CSC1=CC=CC=C1)C(=O)O MCULE-7600953452 [1,0,0,0,0,1|1,0,1]=4 2880 B13R1.351 N[C@@H](C[Se]C1=CC=CC=C1)C(=O)O MCULE-2645239845 [1,0,0,0,0,1|1,0,1]=4 2881 B13R1.351 N[C@@H](C[Se]C1=CC=CC=C1)C(=O)O MCULE-2650735200 [1,0,0,0,0,1|1,0,1]=4 2882 B13R1.351 N[C@H](CCC1=CC=CC=C1)C(=O)O MCULE-4182463122 [1,0,0,0,0,1|1,0,1]=4 2883 B13R1.351 N[C@H](CCC1=CC=CC=C1)C(=O)O MCULE-5087054270 [1,0,0,0,0,1|1,0,1]=4 2884 B13R1.351 N[C@H](CCC1=CC=CC=C1)C(=O)O MCULE-7679113471 [1,0,0,0,0,1|1,0,1]=4 2885 B13R1.351 N[C@H](CCC1=CC=CC=C1)C(=O)O MCULE-7791619414 [1,0,0,0,0,1|1,0,1]=4 2886 B13R1.351 N[C@H](COC1=CC=CC=C1)C(=O)O MCULE-1181768450 [1,0,0,0,0,1|1,0,1]=4 2887 B13R1.351 N[C@H](COC1=CC=CC=C1)C(=O)O MCULE-2658156823 [1,0,0,0,0,1|1,0,1]=4 2888 B13R1.351 N[C@H](CSC1=CC=CC=C1)C(=O)O MCULE-7999236192 [1,0,0,0,0,1|1,0,1]=4 2889 B13R1.351 O=C(Cl)C(=O)CCC1=CC=CC=C1 MCULE-8520253494 [1,0,0,0,0,1|1,0,0]=3 2890 B13R1.351 O=C(Cl)C(=O)OCC1=CC=CC=C1 MCULE-6681192285 [1,0,0,0,0,1|1,0,0]=3 2891 B13R1.351 O=C(O)C(=O)/C=C/C1=CC=CC=C1 MCULE-4300687212 [1,0,0,0,0,1|0,0,1]=3 2892 B13R1.351 O=C(O)C(=O)C=CC1=CC=CC=C1 MCULE-5360185203 [1,0,0,0,0,1|0,0,1]=3 2893 B13R1.351 O=C(O)C(=O)CCC1=CC=CC=C1 MCULE-5355166420 [1,0,0,0,0,1|0,0,0]=2 2894 B13R1.351 O=C(O)C(=O)NCC1=CC=CC=C1 MCULE-8728202129 [1,0,0,0,0,1|0,0,0]=2 2895 B13R1.351 O=C(O)C(Br)CCC1=CC=CC=C1 MCULE-5292402211 [1,0,0,0,0,1|1,0,1]=4 2896 B13R1.351 O=C(O)C(O)CCC1=CC=CC=C1 MCULE-4257585560 [1,0,0,0,0,1|0,0,2]=4 2897 B13R1.351 O=C(O)C(O)CCC1=CC=CC=C1 MCULE-5664756838 [1,0,0,0,0,1|0,0,2]=4 2898 B13R1.351 O=C(O)[C@@H](O)CCC1=CC=CC=C1 MCULE-5061224318 [1,0,0,0,0,1|0,0,2]=4 2899 B13R1.351 O=C(O)[C@@H](O)CCC1=CC=CC=C1 MCULE-8347273271 [1,0,0,0,0,1|0,0,2]=4 2900 B13R1.351 O=C(O)[C@H](O)CCC1=CC=CC=C1 MCULE-2268613096 [1,0,0,0,0,1|0,0,2]=4 2901 B13R1.351 O=C(O)[C@H](O)CCC1=CC=CC=C1 MCULE-9835086512 [1,0,0,0,0,1|0,0,2]=4 2902 B15R1.112 NC(=O)C(=O)NN=CC1=CC=C(C=C1)O MCULE-9515756611 [0,0,0,0,0,2|1,0,1]=4 2903 B15R1.870 CC(=O)CC(=O)NCC1=CC=C(C=C1)C MCULE-4466263963 [0,0,0,0,0,2|2,0,0]=4 2904 B15R1.870 CC(=O)CC(=O)NCC1=CC=C(C=C1)Cl MCULE-7254972313 [0,0,0,0,0,2|2,0,0]=4 2905 B15R1.870 CC(=O)CC(=O)NCC1=CC=C(C=C1)F MCULE-4657683270 [0,0,0,0,0,2|2,0,0]=4 2906 B15R1.111 C(=CC(=O)NC1=CC=C(C=C1)I)C(=O)O MCULE-2572913533 [0,0,0,0,0,2|2,0,0]=4 2907 B15R1.111 CC(=O)NNC(=O)CC1=CC=C(C=C1)Cl MCULE-9373192453 [0,0,0,0,0,2|2,0,0]=4 2908 B15R1.111 CC(=O)OCC(=O)CC1=CC=C(C=C1)Cl MCULE-5792717812 [0,0,0,0,0,2|2,0,0]=4 2909 B15R1.111 CC1=CC=C(C=C1)NC(=O)/C=C/C(=O)O MCULE-2210484669 [0,0,0,0,0,2|2,0,0]=4 2910 B15R1.111 CC1=CC=C(C=C1)NC(=O)C=CC(=O)O MCULE-6989556184 [0,0,0,0,0,2|2,0,0]=4 2911 B15R1.111 CC1=CC=C(C=C1)NC(=O)CCC(=O)O MCULE-1457555670 [0,0,0,0,0,2|2,0,0]=4 2912 B15R1.111 CC1=CC=C(C=C1)OC(=O)C=CC(=O)O MCULE-7670023611 [0,0,0,0,0,2|2,0,0]=4 2913 B15R1.111 CC1=CC=C(C=C1)OC(=O)CCC(=O)O MCULE-9806132974 [0,0,0,0,0,2|2,0,0]=4 2914 B15R1.111 NC1=CC=C(C=C1)NC(=O)C=CC(=O)O MCULE-1017008234 [0,0,0,0,0,2|2,0,0]=4 2915 B15R1.111 NC1=CC=C(C=C1)NC(=O)CCC(=O)O MCULE-6270210041 [0,0,0,0,0,2|2,0,0]=4 2916 B15R1.111 O=C(O)/C=C/C(=O)NC1=CC=C(C=C1)Br MCULE-8564563783 [0,0,0,0,0,2|2,0,0]=4 2917 B15R1.111 O=C(O)/C=C/C(=O)NC1=CC=C(C=C1)Cl MCULE-8566423669 [0,0,0,0,0,2|2,0,0]=4 2918 B15R1.111 O=C(O)/C=C/C(=O)NC1=CC=C(C=C1)F MCULE-8858823075 [0,0,0,0,0,2|2,0,0]=4 2919 B15R1.111 O=C(O)/C=C/C(=O)NC1=CC=C(C=C1)I MCULE-7212180243 [0,0,0,0,0,2|2,0,0]=4 2920 B15R1.111 O=C(O)/C=C/C(=O)NC1=CC=C(C=C1)O MCULE-1257378372 [0,0,0,0,0,2|1,0,0]=3 2921 B15R1.111 O=C(O)/C=C\C(=O)NC1=CC=C(C=C1)Cl MCULE-3122434558 [0,0,0,0,0,2|2,0,0]=4 2922 B15R1.111 O=C(O)/C=C\C(=O)NC1=CC=C(C=C1)F MCULE-2653769301 [0,0,0,0,0,2|2,0,0]=4 2923 B15R1.111 O=C(O)C=CC(=O)NC1=CC=C(C=C1)Br MCULE-4358098270 [0,0,0,0,0,2|2,0,0]=4 2924 B15R1.111 O=C(O)C=CC(=O)NC1=CC=C(C=C1)Cl MCULE-1421939745 [0,0,0,0,0,2|2,0,0]=4 2925 B15R1.111 O=C(O)C=CC(=O)NC1=CC=C(C=C1)F MCULE-6339586213 [0,0,0,0,0,2|2,0,0]=4 2926 B15R1.111 O=C(O)C=CC(=O)NC1=CC=C(C=C1)O MCULE-5471049510 [0,0,0,0,0,2|1,0,0]=3 2927 B15R1.111 O=C(O)CCC(=O)NC1=CC=C(C=C1)Br MCULE-7077142480 [0,0,0,0,0,2|2,0,0]=4 2928 B15R1.111 O=C(O)CCC(=O)NC1=CC=C(C=C1)Cl MCULE-6199460292 [0,0,0,0,0,2|2,0,0]=4 2929 B15R1.111 O=C(O)CCC(=O)NC1=CC=C(C=C1)F MCULE-2511143515 [0,0,0,0,0,2|2,0,0]=4 2930 B15R1.111 O=C(O)CCC(=O)NC1=CC=C(C=C1)I MCULE-5935650895 [0,0,0,0,0,2|2,0,0]=4 2931 B15R1.111 O=C(O)CCC(=O)NC1=CC=C(C=C1)O MCULE-4231074153 [0,0,0,0,0,2|1,0,0]=3 2932 B15R1.111 O=C(O)CNC(=O)CC1=CC=C(C=C1)Cl MCULE-1845170449 [0,0,0,0,0,2|1,0,0]=3 2933 B15R1.111 O=C(O)CNC(=O)CC1=CC=C(C=C1)F MCULE-3004504335 [0,0,0,0,0,2|1,0,0]=3 2934 B15R1.111 O=C(O)CNC(=O)CC1=CC=C(C=C1)O MCULE-2140920241 [0,0,0,0,0,2|0,0,0]=2 2935 B15R1.111 O=C(O)CNC(=O)NC1=CC=C(C=C1)Br MCULE-2768595861 [0,0,0,0,0,2|2,0,0]=4 2936 B15R1.111 O=C(O)CNC(=O)NC1=CC=C(C=C1)Cl MCULE-1354527197 [0,0,0,0,0,2|2,0,0]=4