0 B15R1.3565 C(CC1=CC=CC=C1)(NC(=O)C)C(=O)N MCULE-8359058396 [0,0,0,0,0,0|2,0,0]=2 1 B15R1.3565 CC(=O)N(CC(=O)O)CC1=CC=CC=C1 MCULE-2954153037 [0,0,0,0,0,0|4,0,0]=4 2 B15R1.3565 CC(=O)N/C(=C/C1=CC=CC=C1)/C(=O)O MCULE-6676210219 [0,0,0,0,0,0|1,0,2]=3 3 B15R1.3565 CC(=O)N/C(=C\C1=CC=CC=C1)/C(=O)O MCULE-8035335415 [0,0,0,0,0,0|1,0,2]=3 4 B15R1.3565 CC(=O)N/C(=C\C1=CN=CC=C1)/C(=O)O MCULE-5939622163 [0,0,0,0,0,0|2,0,2]=4 5 B15R1.3565 CC(=O)N=C(CC1=CC=CC=C1)C(=O)O MCULE-2563279561 [0,0,0,0,0,0|1,0,2]=3 6 B15R1.3565 CC(=O)NC(=CC1=CC=CC=C1)C(=O)O MCULE-9383114460 [0,0,0,0,0,0|1,0,2]=3 7 B15R1.3565 CC(=O)NC(=CC1=CN=CC=C1)C(=O)O MCULE-7225549666 [0,0,0,0,0,0|2,0,2]=4 8 B15R1.3565 CC(=O)NC(CC1=CC=CC=C1)C(=O)C MCULE-9665159049 [0,0,0,0,0,0|2,0,0]=2 9 B15R1.3565 CC(=O)NC(CC1=CC=CC=C1)C(=O)O MCULE-3015745479 [0,0,0,0,0,0|1,0,0]=1 10 B15R1.3565 CC(=O)NC(CC1=CC=CC=C1)C(=O)O MCULE-4519106346 [0,0,0,0,0,0|1,0,0]=1 11 B15R1.3565 CC(=O)NC(CC1=CC=CC=C1)C(=O)[O-] MCULE-3735592766 [0,0,0,0,0,0|1,0,1]=2 12 B15R1.3565 CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N MCULE-1772721505 [0,0,0,0,0,0|2,0,0]=2 13 B15R1.3565 CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N MCULE-2850585620 [0,0,0,0,0,0|2,0,0]=2 14 B15R1.3565 CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-1736282363 [0,0,0,0,0,0|1,0,0]=1 15 B15R1.3565 CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-7198989567 [0,0,0,0,0,0|1,0,0]=1 16 B15R1.3565 CC(=O)N[C@@H](CC1=NC=CC=C1)C(=O)O MCULE-9086623913 [0,0,0,0,0,0|2,0,0]=2 17 B15R1.3565 CC(=O)N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-5026728797 [0,0,0,0,0,0|1,0,0]=1 18 B15R1.3565 CC(=O)N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-6833489242 [0,0,0,0,0,0|1,0,0]=1 19 B15R1.3565 CC(=O)OC(CC1=CC=CC=C1)C(=O)O MCULE-9069065686 [0,0,0,0,0,0|2,0,0]=2 20 B15R1.3565 CC(=O)O[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-2682510340 [0,0,0,0,0,0|2,0,0]=2 21 B15R1.3565 CC(=O)O[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-6624411562 [0,0,0,0,0,0|2,0,0]=2 22 B15R1.3565 CC(=O)S[C@H](CC1=CC=CC=C1)C(=O)O MCULE-1977160569 [0,0,0,0,0,0|2,0,0]=2 23 B15R1.3565 CC(C)CC(CC1=CC=CC=C1)C(=O)O MCULE-6201563038 [0,0,0,0,0,0|3,0,1]=4 24 B15R1.3565 CC(C)NC(CC1=CC=CC=C1)C(=O)O MCULE-4307970938 [0,0,0,0,0,0|2,0,1]=3 25 B15R1.3565 CC(C)NC(CC1=CC=CC=C1)C(=O)O MCULE-5854878082 [0,0,0,0,0,0|2,0,1]=3 26 B15R1.3565 N=C(N)NC(CC1=CC=CC=C1)C(=O)O MCULE-7855175830 [0,0,0,0,0,0|1,0,0]=1 27 B15R1.3565 N=C(N)N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-9192601189 [0,0,0,0,0,0|1,0,0]=1 28 B15R1.3565 NC(=O)NC(CC1=CC=CC=C1)C(=O)O MCULE-8566868807 [0,0,0,0,0,0|0,0,0]=0 29 B15R1.3565 NC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-4234577728 [0,0,0,0,0,0|0,0,0]=0 30 B15R1.3565 NC(=S)NC(CC1=CC=CC=C1)C(=O)O MCULE-9663132720 [0,0,0,0,0,0|0,1,0]=1 31 B15R1.3565 O=C(O)C/C(=C/C1=CC=CC=C1)/C(=O)O MCULE-3951357685 [0,0,0,0,0,0|2,0,2]=4 32 B15R1.3565 O=C(O)C/C(=C\C1=CC=CC=C1)/C(=O)O MCULE-2076092236 [0,0,0,0,0,0|2,0,2]=4 33 B15R1.3565 O=C(O)C=C(SC1=CC=CC=C1)C(=O)O MCULE-5848631276 [0,0,0,0,0,0|3,0,1]=4 34 B15R1.3565 O=C(O)CC(=CC1=CC=CC=C1)C(=O)O MCULE-9301971355 [0,0,0,0,0,0|2,0,2]=4 35 B15R1.3565 O=C(O)CC(CC1=CC=CC=C1)C(=O)O MCULE-2903742079 [0,0,0,0,0,0|2,0,0]=2 36 B15R1.3565 O=C(O)CC(CC1=CC=CC=C1)C(=O)O MCULE-7998258381 [0,0,0,0,0,0|2,0,0]=2 37 B15R1.3565 O=C(O)C[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-5379915894 [0,0,0,0,0,0|2,0,0]=2 38 B15R1.3565 O=C(O)C[C@H](CC1=CC=CC=C1)C(=O)O MCULE-2870209733 [0,0,0,0,0,0|2,0,0]=2 39 B15R1.3565 O=C(O)C[C@H](CC1=CC=CC=C1)C(=O)O MCULE-5007075982 [0,0,0,0,0,0|2,0,0]=2 40 B15R1.3565 [C@H](CC(=O)O)(CC1=CC=CC=C1)C(=O)O MCULE-9882574781 [0,0,0,0,0,0|2,0,0]=2 41 B14R1.549 CC(=O)NC(CO)CC1=CC=CC=C1 MCULE-8689919153 [1,0,0,0,0,0|1,0,1]=3 42 B14R1.549 CC(=O)NC(CO)CC1=CC=CC=C1 MCULE-9377213028 [1,0,0,0,0,0|1,0,1]=3 43 B14R1.549 CC(=O)N[C@H](CO)CC1=CC=CC=C1 MCULE-5434360182 [1,0,0,0,0,0|1,0,1]=3 44 B14R1.549 CC(=O)N[C@H](CO)CC1=CC=CC=C1 MCULE-8716849486 [1,0,0,0,0,0|1,0,1]=3 45 B14R1.549 CCC(CC1=CC=CC=C1)NC(=O)C MCULE-8540697406 [1,0,0,0,0,0|2,0,1]=4 46 B14R1.549 CCC(CC1=CC=CC=C1)NC(=O)N MCULE-4451713562 [1,0,0,0,0,0|1,0,1]=3 47 B14R1.549 NC(=O)N[C@@H](CO)CC1=CC=CC=C1 MCULE-2504438071 [1,0,0,0,0,0|0,0,1]=2 48 B14R1.980 C=CCC(CC1=CC=CC=C1)C(=O)O MCULE-5920902000 [1,0,0,0,0,0|2,0,0]=3 49 B14R1.980 CCNC(CC1=CC=CC=C1)C(=O)O MCULE-6210909066 [1,0,0,0,0,0|1,0,1]=3 50 B14R1.980 CCN[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-5953638527 [1,0,0,0,0,0|1,0,1]=3 51 B14R1.980 CCN[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-6529136210 [1,0,0,0,0,0|1,0,1]=3 52 B14R1.980 CCN[C@H](CC1=CC=CC=C1)C(=O)O MCULE-8181047924 [1,0,0,0,0,0|1,0,1]=3 53 B14R1.980 CCN[C@H](CC1=CC=CC=C1)C(=O)O MCULE-9517589992 [1,0,0,0,0,0|1,0,1]=3 54 B14R1.980 N#CCC(CC1=CC=CC=C1)C(=O)O MCULE-8433832341 [1,0,0,0,0,0|1,0,2]=4 55 B14R1.980 NCCC(CC1=CC=CC=C1)C(=O)O MCULE-4428586654 [1,0,0,0,0,0|1,0,1]=3 56 B14R1.980 NCCC(CC1=CC=CC=C1)C(=O)O MCULE-9317682888 [1,0,0,0,0,0|1,0,1]=3 57 B14R1.980 O=CNC(CC1=CC=CC=C1)C(=O)O MCULE-1556848559 [1,0,0,0,0,0|0,0,0]=1 58 B14R1.980 O=CN[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-1503788310 [1,0,0,0,0,0|0,0,0]=1 59 B14R1.980 O=CN[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-2880988582 [1,0,0,0,0,0|0,0,0]=1 60 B14R1.980 O=CN[C@H](CC1=CC=CC=C1)C(=O)O MCULE-1759344415 [1,0,0,0,0,0|0,0,0]=1 61 B14R1.980 O=CN[C@H](CC1=CC=CC=C1)C(=O)O MCULE-8899759329 [1,0,0,0,0,0|0,0,0]=1 62 B14R1.980 [N-]=[N+]=N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-4631968549 [1,0,0,0,0,0|1,0,2]=4 63 B14R1.980 [N-]=[N+]=N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-6606109400 [1,0,0,0,0,0|1,0,2]=4 64 B14R1.980 [N-]=[N+]=N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-5240674940 [1,0,0,0,0,0|1,0,2]=4 65 B14R1.980 [N-]=[N+]=N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-9772056696 [1,0,0,0,0,0|1,0,2]=4 66 B16R1.3938 CC(=O)NC(CC1=CC=CC=C1)P(=O)(O)O MCULE-3946908527 [0,1,0,0,0,0|2,0,0]=3 67 B16R1.5825 CC(=O)NC(CC1=CC=CC=C1)C(=O)NN MCULE-9135926072 [0,1,0,0,0,0|2,0,0]=3 68 B16R1.5825 CNC(=O)C(CC1=CC=CC=C1)NC(=O)C MCULE-8271413847 [0,1,0,0,0,0|2,0,0]=3 69 B16R1.5825 CNC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C MCULE-3604154917 [0,1,0,0,0,0|2,0,0]=3 70 B16R1.5825 CNC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C MCULE-5231453444 [0,1,0,0,0,0|2,0,0]=3 71 B16R1.5825 COC(=O)/C(=C/C1=CC=CC=C1)/NC(=O)C MCULE-8811427885 [0,1,0,0,0,0|1,0,2]=4 72 B16R1.5825 COC(=O)C(=CC1=CC=CC=C1)NC(=O)C MCULE-3827295629 [0,1,0,0,0,0|1,0,2]=4 73 B16R1.5825 COC(=O)C(CC(=O)O)CC1=CC=CC=C1 MCULE-2251333559 [0,1,0,0,0,0|2,0,0]=3 74 B16R1.5825 COC(=O)C(CC1=CC=CC=C1)NC(=O)C MCULE-8834039866 [0,1,0,0,0,0|1,0,0]=2 75 B16R1.5825 COC(=O)C(CC1=CC=CC=C1)NC(=O)N MCULE-5120842155 [0,1,0,0,0,0|0,0,0]=1 76 B16R1.5825 COC(=O)C(CC1=CC=CN=C1)NC(=O)C MCULE-9464622027 [0,1,0,0,0,0|2,0,0]=3 77 B16R1.5825 COC(=O)C(CC1=CC=NC=C1)NC(=O)C MCULE-1328481335 [0,1,0,0,0,0|2,0,0]=3 78 B16R1.5825 COC(=O)N(CC(=O)O)CC1=CC=CC=C1 MCULE-3712117084 [0,1,0,0,0,0|3,0,0]=4 79 B16R1.5825 COC(=O)[C@@H](CC(=O)O)CC1=CC=CC=C1 MCULE-1071360960 [0,1,0,0,0,0|2,0,0]=3 80 B16R1.5825 COC(=O)[C@@H](CC(=O)O)CC1=CC=CC=C1 MCULE-5852172037 [0,1,0,0,0,0|2,0,0]=3 81 B16R1.5825 COC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)C MCULE-7389061722 [0,1,0,0,0,0|1,0,0]=2 82 B16R1.5825 COC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)C MCULE-9173519932 [0,1,0,0,0,0|1,0,0]=2 83 B16R1.5825 COC(=O)[C@H](CC(=O)O)CC1=CC=CC=C1 MCULE-3267806472 [0,1,0,0,0,0|2,0,0]=3 84 B16R1.5825 COC(=O)[C@H](CC(=O)O)CC1=CC=CC=C1 MCULE-3635276225 [0,1,0,0,0,0|2,0,0]=3 85 B16R1.5825 COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C MCULE-4223892017 [0,1,0,0,0,0|1,0,0]=2 86 B16R1.5825 COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C MCULE-5134205898 [0,1,0,0,0,0|1,0,0]=2 87 B16R1.5825 [C@@H](CC1=CC=CC=C1)(NC(=O)C)C(=O)NN MCULE-1207360945 [0,1,0,0,0,0|2,0,0]=3 88 B16R1.6729 CC(=O)C(CC1=CC=CC=C1)NC(=O)CCl MCULE-7822706860 [0,1,0,0,0,0|2,0,0]=3 89 B16R1.6729 COC(=O)NC(CC1=CC=CC=C1)C(=O)N MCULE-8544440951 [0,1,0,0,0,0|2,0,0]=3 90 B16R1.6729 COC(=O)NC(CC1=CC=CC=C1)C(=O)O MCULE-4943020961 [0,1,0,0,0,0|1,0,0]=2 91 B16R1.6729 COC(=O)NC(CC1=CC=CC=C1)C(=O)O MCULE-6508396673 [0,1,0,0,0,0|1,0,0]=2 92 B16R1.6729 COC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-3444582739 [0,1,0,0,0,0|1,0,0]=2 93 B16R1.6729 COC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-6037843909 [0,1,0,0,0,0|1,0,0]=2 94 B16R1.6729 COC(=O)N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-4492216945 [0,1,0,0,0,0|1,0,0]=2 95 B16R1.6729 COC(=O)N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-5221161339 [0,1,0,0,0,0|1,0,0]=2 96 B16R1.6729 NCC(=O)NC(CC1=CC=CC=C1)C(=O)O MCULE-3792651282 [0,1,0,0,0,0|0,0,0]=1 97 B16R1.6729 NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-1865746021 [0,1,0,0,0,0|0,0,0]=1 98 B16R1.6729 O=C(CCl)NC(CC1=CC=CC=C1)C(=O)O MCULE-4273763339 [0,1,0,0,0,0|1,0,0]=2 99 B16R1.6729 O=C(CCl)N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-2179824638 [0,1,0,0,0,0|1,0,0]=2 100 B16R1.6729 O=C(CCl)N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-5089412814 [0,1,0,0,0,0|1,0,0]=2 101 B16R1.6729 O=C(CCl)N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-3735985993 [0,1,0,0,0,0|1,0,0]=2 102 B16R1.6729 O=C(CCl)N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-5386800217 [0,1,0,0,0,0|1,0,0]=2 103 B16R1.6729 [C@@H](CC1=CC=CC=C1)(NC(=O)CN)C(=O)O MCULE-3602330243 [0,1,0,0,0,0|0,0,0]=1 104 B16R1.6927 CC(=O)N/C(=C\C1=CC=C(C=C1)Cl)/C(=O)O MCULE-9438358904 [0,1,0,0,0,0|1,0,2]=4 105 B16R1.6927 CC(=O)NC(=CC1=CC=C(C=C1)Br)C(=O)O MCULE-4445529718 [0,1,0,0,0,0|1,0,2]=4 106 B16R1.6927 CC(=O)NC(=CC1=CC=C(C=C1)C)C(=O)O MCULE-7350003526 [0,1,0,0,0,0|1,0,2]=4 107 B16R1.6927 CC(=O)NC(=CC1=CC=C(C=C1)Cl)C(=O)O MCULE-6987554613 [0,1,0,0,0,0|1,0,2]=4 108 B16R1.6927 CC(=O)NC(=CC1=CC=C(C=C1)F)C(=O)O MCULE-7217689865 [0,1,0,0,0,0|1,0,2]=4 109 B16R1.6927 CC(=O)NC(CC1=CC=C(C=C1)Br)C(=O)O MCULE-5216736769 [0,1,0,0,0,0|1,0,0]=2 110 B16R1.6927 CC(=O)NC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-2518070213 [0,1,0,0,0,0|1,0,0]=2 111 B16R1.6927 CC(=O)NC(CC1=CC=C(C=C1)F)C(=O)O MCULE-1596649664 [0,1,0,0,0,0|1,0,0]=2 112 B16R1.6927 CC(=O)NC(CC1=CC=C(C=C1)I)C(=O)O MCULE-8475341249 [0,1,0,0,0,0|1,0,0]=2 113 B16R1.6927 CC(=O)NC(CC1=CC=C(C=C1)O)C(=O)C MCULE-8845886523 [0,1,0,0,0,0|2,0,0]=3 114 B16R1.6927 CC(=O)NC(CC1=CC=C(C=C1)O)C(=O)N MCULE-7080407463 [0,1,0,0,0,0|2,0,0]=3 115 B16R1.6927 CC(=O)NC(CC1=CC=C(C=C1)O)C(=O)O MCULE-3253015023 [0,1,0,0,0,0|1,0,0]=2 116 B16R1.6927 CC(=O)N[C@@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-2362672524 [0,1,0,0,0,0|1,0,0]=2 117 B16R1.6927 CC(=O)N[C@@H](CC1=CC=C(C=C1)Br)C(=O)O MCULE-5006749935 [0,1,0,0,0,0|1,0,0]=2 118 B16R1.6927 CC(=O)N[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-6535308054 [0,1,0,0,0,0|1,0,0]=2 119 B16R1.6927 CC(=O)N[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-9517456648 [0,1,0,0,0,0|1,0,0]=2 120 B16R1.6927 CC(=O)N[C@@H](CC1=CC=C(C=C1)F)C(=O)O MCULE-5438320865 [0,1,0,0,0,0|1,0,0]=2 121 B16R1.6927 CC(=O)N[C@@H](CC1=CC=C(C=C1)N)C(=O)O MCULE-5111775698 [0,1,0,0,0,0|1,0,0]=2 122 B16R1.6927 CC(=O)N[C@@H](CC1=CC=C(C=C1)N)C(=O)O MCULE-7324042763 [0,1,0,0,0,0|1,0,0]=2 123 B16R1.6927 CC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N MCULE-3056014953 [0,1,0,0,0,0|2,0,0]=3 124 B16R1.6927 CC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N MCULE-4748033966 [0,1,0,0,0,0|2,0,0]=3 125 B16R1.6927 CC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-5263649721 [0,1,0,0,0,0|1,0,0]=2 126 B16R1.6927 CC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-5682450841 [0,1,0,0,0,0|1,0,0]=2 127 B16R1.6927 CC(=O)N[C@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-3605735817 [0,1,0,0,0,0|1,0,0]=2 128 B16R1.6927 CC(=O)N[C@H](CC1=CC=C(C=C1)Cl)C(=O)O MCULE-5734890580 [0,1,0,0,0,0|1,0,0]=2 129 B16R1.6927 CC(=O)N[C@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-2019559496 [0,1,0,0,0,0|1,0,0]=2 130 B16R1.6927 CC(=O)N[C@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-4489716775 [0,1,0,0,0,0|1,0,0]=2 131 B16R1.6927 CC(=O)N[C@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-4675268813 [0,1,0,0,0,0|1,0,0]=2 132 B16R1.6927 CC(=O)N[C@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-6575205127 [0,1,0,0,0,0|1,0,0]=2 133 B16R1.6927 CC(C)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-3016985444 [0,1,0,0,0,0|2,0,1]=4 134 B16R1.6927 CC1=CC=C(C=C1)CC(CC(=O)O)C(=O)O MCULE-7766497242 [0,1,0,0,0,0|2,0,0]=3 135 B16R1.6927 CC1=CC=C(C=C1)NC(CC(=O)O)C(=O)O MCULE-7682946345 [0,1,0,0,0,0|3,0,0]=4 136 B16R1.6927 NC(=O)NC(CC1=CC=C(C=C1)O)C(=O)O MCULE-5904856946 [0,1,0,0,0,0|0,0,0]=1 137 B16R1.6927 NC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-1964152581 [0,1,0,0,0,0|0,0,0]=1 138 B16R1.6927 O=C(O)CC(CC1=CC=C(C=C1)Br)C(=O)O MCULE-6159636257 [0,1,0,0,0,0|2,0,0]=3 139 B16R1.6927 O=C(O)CC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-7084831539 [0,1,0,0,0,0|2,0,0]=3 140 B16R1.6927 O=C(O)CC(CC1=CC=C(C=C1)F)C(=O)O MCULE-1896847321 [0,1,0,0,0,0|2,0,0]=3 141 B16R1.6927 O=C(O)CC(SC1=CC=C(C=C1)Cl)C(=O)O MCULE-7154497019 [0,1,0,0,0,0|3,0,0]=4 142 B16R1.6927 [C@H](CC1=CC=C(C=C1)O)(NC(=O)C)C(=O)N MCULE-3164881513 [0,1,0,0,0,0|2,0,0]=3 143 B16R1.7303 CC(=O)NC(=CC1=CC(=CC=C1)Br)C(=O)O MCULE-5222524844 [0,1,0,0,0,0|1,0,2]=4 144 B16R1.7303 CC(=O)NC(=CC1=CC=CC(=C1)O)C(=O)O MCULE-1204084833 [0,1,0,0,0,0|1,0,2]=4 145 B16R1.7303 CC(=O)NC(CC1=CC(=CC=C1)F)C(=O)O MCULE-3009746437 [0,1,0,0,0,0|1,0,0]=2 146 B16R1.7303 CC(=O)NC(CC1=CC=CC(=C1)O)C(=O)O MCULE-7450050047 [0,1,0,0,0,0|1,0,0]=2 147 B16R1.7303 CC(=O)N[C@@H](CC1=CC=CC(=C1)F)C(=O)O MCULE-1393930380 [0,1,0,0,0,0|1,0,0]=2 148 B16R1.7303 CC(=O)N[C@@H](CC1=CC=CC(=C1)O)C(=O)O MCULE-5163427337 [0,1,0,0,0,0|1,0,0]=2 149 B16R1.7303 CC(=O)N[C@H](CC1=CC=CC(=C1)O)C(=O)O MCULE-1777919960 [0,1,0,0,0,0|1,0,0]=2 150 B16R1.7303 CC1=CC=CC(=C1)CC(CC(=O)O)C(=O)O MCULE-1306288974 [0,1,0,0,0,0|2,0,0]=3 151 B16R1.7303 O=C(O)CC(CC1=CC=CC(=C1)F)C(=O)O MCULE-5660260041 [0,1,0,0,0,0|2,0,0]=3 152 B16R1.7303 O=C(O)CC(NC1=CC(=CC=C1)Cl)C(=O)O MCULE-8975975243 [0,1,0,0,0,0|3,0,0]=4 153 B16R1.7594 CS(=O)(=O)NC(CC1=CC=CC=C1)C(=O)O MCULE-4588565918 [0,1,0,0,0,0|2,0,0]=3 154 B16R1.7594 CS(=O)(=O)N[C@H](CC1=NC=CC=C1)C(=O)O MCULE-6599331530 [0,1,0,0,0,0|3,0,0]=4 155 B16R1.8814 CC(=O)NC(=CC1=C(C=CC=C1)Br)C(=O)O MCULE-6111316180 [0,1,0,0,0,0|1,0,2]=4 156 B16R1.8814 CC(=O)NC(=CC1=CC=CC=C1C)C(=O)O MCULE-2707453964 [0,1,0,0,0,0|1,0,2]=4 157 B16R1.8814 CC(=O)NC(CC1=CC=CC=C1F)C(=O)O MCULE-5871984807 [0,1,0,0,0,0|1,0,0]=2 158 B16R1.8814 CC(=O)N[C@@H](CC1=CC=CC=C1F)C(=O)O MCULE-5578401888 [0,1,0,0,0,0|1,0,0]=2 159 B16R1.8814 CC1=C(C=CC=C1)CC(CC(=O)O)C(=O)O MCULE-9274771561 [0,1,0,0,0,0|2,0,0]=3 160 B16R1.8814 O=C(O)CC(CC1=C(C=CC=C1)F)C(=O)O MCULE-4167020285 [0,1,0,0,0,0|2,0,0]=3 161 B16R1.18045 CC(C1=CC=CC=C1)C(CC(=O)O)C(=O)O MCULE-8006828274 [0,1,0,0,0,0|2,0,0]=3 162 B16R1.18045 NC(=O)NC(C(=O)O)C(O)C1=CC=CC=C1 MCULE-3305324411 [0,1,0,0,0,0|0,0,0]=1 163 B16R1.18045 NC(=S)NC(C(=O)O)C(O)C1=CC=CC=C1 MCULE-2177614254 [0,1,0,0,0,0|0,1,0]=2 164 B16R1.18045 O=C(O)CC(C(=O)O)C(O)C1=CC=CC=C1 MCULE-6101360097 [0,1,0,0,0,0|2,0,0]=3 165 B16R2.317 O=C1C=CC(=O)N(N1)CC2=CC=CC=C2 MCULE-6380028719 [0,0,0,1,0,0|3,0,0]=4 166 B16R2.317 O=C1CNC(=O)C(N1)CC2=CC=CC=C2 MCULE-2729727331 [0,0,0,1,0,0|2,0,0]=3 167 B16R2.317 O=C1CNC(=O)[C@@H](N1)CC2=CC=CC=C2 MCULE-5170158680 [0,0,0,1,0,0|2,0,0]=3 168 B16R2.317 O=C1CNC(=O)[C@@H](N1)CC2=CC=CC=C2 MCULE-9644059663 [0,0,0,1,0,0|2,0,0]=3 169 B16R2.317 O=C1CNC(=O)[C@H](N1)CC2=CC=CC=C2 MCULE-9063446528 [0,0,0,1,0,0|2,0,0]=3 170 B16R2.2905 O=C1CC(C(C1)C2=CC=CC=C2)C(=O)O MCULE-7616444575 [0,0,0,1,0,0|2,0,0]=3 171 B16R2.2905 O=C1CC(C(N1)C(=O)O)C2=CC=CC=N2 MCULE-4342481188 [0,0,0,1,0,0|2,0,0]=3 172 B16R2.2905 O=C1CC(C(N1)C(=O)O)C2=CN=CC=C2 MCULE-1581017643 [0,0,0,1,0,0|2,0,0]=3 173 B16R2.2905 O=C1CC(C(O1)C2=CC=CC=C2)C(=O)O MCULE-5982535555 [0,0,0,1,0,0|2,0,0]=3 174 B16R2.2905 O=C1CC(N(N1)C2=CC=CC=C2)C(=O)O MCULE-3560929802 [0,0,0,1,0,0|2,0,0]=3 175 B16R2.2905 O=C1CC([C@H](N1)C(=O)O)C2=CC=CC=C2 MCULE-3329186357 [0,0,0,1,0,0|1,0,0]=2 176 B16R2.2905 O=C1NC(=C(N1)C2=CC=CC=C2)C(=O)O MCULE-1521886475 [0,0,0,1,0,0|0,0,2]=3 177 B16R2.3989 CC(=O)NC1=CC2=C(C=CC=C2)OC1=O MCULE-8239666346 [0,0,0,1,0,0|1,0,2]=4 178 B16R2.3989 NC(=O)CC1NC2=CC=CC=C2NC1=O MCULE-1945149910 [0,0,0,1,0,0|3,0,0]=4 179 B16R2.3989 NC(=O)CC1NC2=CC=CC=C2NC1=O MCULE-9340297586 [0,0,0,1,0,0|3,0,0]=4 180 B16R2.3989 NC(=O)CC1SC2=CC=CC=C2NC1=O MCULE-8252691129 [0,0,0,1,0,0|3,0,0]=4 181 B16R2.3989 NC(=O)CN1CC2=C(C=CC=C2)OC1=O MCULE-5438016839 [0,0,0,1,0,0|2,0,0]=3 182 B16R2.3989 NC(=O)C[C@@H]1NC2=CC=CC=C2N=C1O MCULE-6854733824 [0,0,0,1,0,0|3,0,0]=4 183 B16R2.3989 O=C(O)CC1CC2=CC=CC=C2NC1=O MCULE-5348834434 [0,0,0,1,0,0|3,0,0]=4 184 B16R2.3989 O=C(O)CN1CC2=C(C=CC=C2)OC1=O MCULE-1569463982 [0,0,0,1,0,0|3,0,0]=4 185 B16R2.4050 O=C1NC(C1CC2=CC=CC=C2)C(=O)O MCULE-3684935271 [0,0,0,1,0,0|3,0,0]=4 186 B16R2.27456 CC(=O)N1C(=CC2=C1C=CC=C2)C(=O)O MCULE-9892038404 [0,0,0,1,0,0|1,0,2]=4 187 B16R2.27456 CC(=O)N1C2=C(C=CC=C2)CC1C(=O)O MCULE-2500341213 [0,0,0,1,0,0|1,0,0]=2 188 B16R2.27456 CC(=O)N1C2=C(C=CC=C2)C[C@@H]1C(=O)O MCULE-8117576936 [0,0,0,1,0,0|1,0,0]=2 189 B16R2.27456 CC(=O)N1C2=C(C=CC=C2)C[C@H]1C(=O)O MCULE-7247898090 [0,0,0,1,0,0|1,0,0]=2 190 B16R2.27456 CC(=O)N1C2=C(C=CC=C2)C[C@H]1C(=O)O MCULE-7537804788 [0,0,0,1,0,0|1,0,0]=2 191 B16R2.85291 O=C(O)C(CC1=CC=CC=C1)NC2CC2 MCULE-1686263887 [0,0,0,1,0,0|2,0,1]=4 192 B16R2.145452 O=C(O)C1NC2=C(C=CC=C2)S(=O)(=O)N1 MCULE-6951084492 [0,0,0,1,0,0|3,0,0]=4 193 B14R1.3164 C(CC1=CNC=N1)(NC(=O)C)C(=O)O MCULE-9384945249 [0,0,0,0,1,0|3,0,0]=4 194 B14R1.3164 CC(=O)NC(CC1=CC=CS1)C(=O)O MCULE-2581035336 [0,0,0,0,1,0|2,0,0]=3 195 B14R1.3164 CC(=O)NC(CN1C=CN=C1)C(=O)O MCULE-6236621350 [0,0,0,0,1,0|3,0,0]=4 196 B14R1.3164 CC(=O)N[C@@H](CC1=CNC=N1)C(=O)O MCULE-3635162274 [0,0,0,0,1,0|3,0,0]=4 197 B14R1.3164 CC(=O)N[C@H](CC1=CNC=N1)C(=O)O MCULE-5709015092 [0,0,0,0,1,0|3,0,0]=4 198 B14R1.3164 O=C(O)CC(CC1=CC=CS1)C(=O)O MCULE-1331565867 [0,0,0,0,1,0|3,0,0]=4 199 B14R1.3164 [C@H](CC1=CN=CN1)(NC(=O)C)C(=O)O MCULE-1715764947 [0,0,0,0,1,0|3,0,0]=4 200 B14R1.4513 CC(=O)C(CC1=CC=CC=C1)C(=O)C MCULE-6158243786 [0,0,0,0,1,0|2,0,0]=3 201 B14R1.4513 CC(=O)C(OC1=CC=CC=C1)C(=O)C MCULE-9549906542 [0,0,0,0,1,0|3,0,0]=4 202 B14R1.4513 CC(C)C(CC1=CC=CC=C1)C(=O)O MCULE-2818886983 [0,0,0,0,1,0|2,0,1]=4 203 B14R1.4513 CN(C)C(CC1=CC=CC=C1)C(=O)O MCULE-1649556942 [0,0,0,0,1,0|3,0,0]=4 204 B14R1.4513 CN(C)[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-1861249144 [0,0,0,0,1,0|3,0,0]=4 205 B14R1.4513 CN(C)[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-6371176512 [0,0,0,0,1,0|3,0,0]=4 206 B14R1.4513 CN(C)[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-7039498012 [0,0,0,0,1,0|3,0,0]=4 207 B14R1.4513 CN(C)[C@H](CC1=CC=CC=C1)C(=O)O MCULE-2467855041 [0,0,0,0,1,0|3,0,0]=4 208 B14R1.4513 CN(C)[C@H](CC1=CC=CC=C1)C(=O)O MCULE-8528400236 [0,0,0,0,1,0|3,0,0]=4 209 B14R1.4513 CN(C)[C@H](CC1=CC=CC=C1)C(=O)O MCULE-9333471522 [0,0,0,0,1,0|3,0,0]=4 210 B14R1.4513 NC(=O)C(=CC1=CC=CC=C1)C(=O)N MCULE-9265100914 [0,0,0,0,1,0|1,0,2]=4 211 B14R1.4513 NC(=O)C(SC1=NC=CC=C1)C(=O)N MCULE-4023018819 [0,0,0,0,1,0|3,0,0]=4 212 B14R1.4513 O=C(O)C(CC1=CC=CC=C1)C(=O)O MCULE-2962798523 [0,0,0,0,1,0|1,0,0]=2 213 B14R1.4513 O=C([O-])C(CC1=CC=CC=C1)P(=O)[O-] MCULE-7645142682 [0,0,0,0,1,0|2,0,1]=4 214 B14R1.4513 O=C([O-])C(CC1=CC=CC=C1)P(=O)[O-] MCULE-9313493809 [0,0,0,0,1,0|2,0,1]=4 215 B14R1.6455 CC(=O)C(CC(=O)O)C1=CC=CC=C1 MCULE-9835275071 [0,0,0,0,1,0|3,0,0]=4 216 B14R1.6455 CC(=O)NC(C(=O)O)C1=CC=CC=C1 MCULE-5931177192 [0,0,0,0,1,0|1,0,0]=2 217 B14R1.6455 CC(=O)N[C@@H](C(=O)O)C1=CC=CC=C1 MCULE-6888215633 [0,0,0,0,1,0|1,0,0]=2 218 B14R1.6455 CC(=O)N[C@@H](C(=O)O)C1=CC=CC=C1 MCULE-9133897070 [0,0,0,0,1,0|1,0,0]=2 219 B14R1.6455 CC(=O)N[C@H](C(=O)O)C1=CC=CC=C1 MCULE-5016094912 [0,0,0,0,1,0|1,0,0]=2 220 B14R1.6455 CC(=O)N[C@H](C(=O)O)C1=CC=CC=C1 MCULE-7980993760 [0,0,0,0,1,0|1,0,0]=2 221 B14R1.6455 CC(=O)OC(C(=O)Cl)C1=CC=CC=C1 MCULE-4434309841 [0,0,0,0,1,0|3,0,0]=4 222 B14R1.6455 CC(=O)OC(C(=O)N)C1=CC=CC=C1 MCULE-6024939769 [0,0,0,0,1,0|3,0,0]=4 223 B14R1.6455 CC(=O)OC(C(=O)O)C1=CC=CC=C1 MCULE-2534932831 [0,0,0,0,1,0|2,0,0]=3 224 B14R1.6455 CC(=O)OC(C(=O)O)C1=CC=CC=C1 MCULE-3580280908 [0,0,0,0,1,0|2,0,0]=3 225 B14R1.6455 CC(=O)O[C@@H](C(=O)Cl)C1=CC=CC=C1 MCULE-1438394922 [0,0,0,0,1,0|3,0,0]=4 226 B14R1.6455 CC(=O)O[C@@H](C(=O)Cl)C1=CC=CC=C1 MCULE-7346937952 [0,0,0,0,1,0|3,0,0]=4 227 B14R1.6455 CC(=O)O[C@@H](C(=O)O)C1=CC=CC=C1 MCULE-3225936034 [0,0,0,0,1,0|2,0,0]=3 228 B14R1.6455 CC(=O)O[C@@H](C(=O)O)C1=CC=CC=C1 MCULE-5208671589 [0,0,0,0,1,0|2,0,0]=3 229 B14R1.6455 CC(=O)O[C@H](C(=O)O)C1=CC=CC=C1 MCULE-5858416811 [0,0,0,0,1,0|2,0,0]=3 230 B14R1.6455 CC(=O)O[C@H](C(=O)O)C1=CC=CC=C1 MCULE-6128602432 [0,0,0,0,1,0|2,0,0]=3 231 B14R1.6455 CC(C)C(NC(=O)N)C1=CC=CC=C1 MCULE-8943833512 [0,0,0,0,1,0|2,0,1]=4 232 B14R1.6455 NC(=O)NC(C(=O)N)C1=CC=NC=C1 MCULE-2555903106 [0,0,0,0,1,0|2,0,0]=3 233 B14R1.6455 NC(=O)NC(C(=O)O)C1=CC=CC=C1 MCULE-5316948095 [0,0,0,0,1,0|0,0,0]=1 234 B14R1.6455 O=C(O)/C=C(\C(=O)O)/C1=CC=CC=C1 MCULE-7829620956 [0,0,0,0,1,0|2,0,1]=4 235 B14R1.6455 O=C(O)C(C=C(Cl)Cl)C1=CC=CC=C1 MCULE-4741200733 [0,0,0,0,1,0|3,0,0]=4 236 B14R1.6455 O=C(O)C=C(C(=O)O)C1=CC=CC=C1 MCULE-1455917055 [0,0,0,0,1,0|2,0,1]=4 237 B14R1.6455 O=C(O)CC(C(=O)O)C1=CC=CC=C1 MCULE-9121324032 [0,0,0,0,1,0|2,0,0]=3 238 B14R1.6455 O=C(O)C[C@@H](C(=O)O)C1=CC=CC=C1 MCULE-8137361059 [0,0,0,0,1,0|2,0,0]=3 239 B14R1.6455 O=C(O)C[C@@H](C(=O)O)C1=CC=CC=C1 MCULE-9697932970 [0,0,0,0,1,0|2,0,0]=3 240 B14R1.6455 O=C(O)C[C@H](C(=O)O)C1=CC=CC=C1 MCULE-2990646480 [0,0,0,0,1,0|2,0,0]=3 241 B14R1.6455 O=C(O)C[C@H](C(=O)O)C1=CC=CC=C1 MCULE-5484738674 [0,0,0,0,1,0|2,0,0]=3 242 B16R1.3939 O=C(O)CC(CC(=O)O)CC1=CC=CC=C1 MCULE-7799259600 [0,0,0,0,0,1|2,0,0]=3 243 B16R1.3939 O=C(O)CN(CC(=O)O)CC1=CC=CC=C1 MCULE-3560979327 [0,0,0,0,0,1|3,0,0]=4 244 B16R1.12227 CC(=O)NC(CCC1=CC=CC=C1)C(=O)O MCULE-1069328294 [0,0,0,0,0,1|1,0,0]=2 245 B16R1.12227 CC(=O)NC(CSC1=CC=CC=C1)C(=O)O MCULE-3909091993 [0,0,0,0,0,1|1,0,0]=2 246 B16R1.12227 CC(=O)N[C@H](CCC1=CC=CC=C1)C(=O)O MCULE-9698860551 [0,0,0,0,0,1|1,0,0]=2 247 B16R1.12227 O=C(O)CC(NCC1=CC=CC=C1)C(=O)O MCULE-4576764538 [0,0,0,0,0,1|2,0,0]=3 248 B16R1.12227 O=C(O)C[C@@H](NCC1=CC=CC=C1)C(=O)O MCULE-4707366748 [0,0,0,0,0,1|2,0,0]=3 249 B16R1.12227 [C@@H](CSC1=CC=CC=C1)(NC(=O)C)C(=O)O MCULE-7044540916 [0,0,0,0,0,1|1,0,0]=2 250 B16R1.12227 [C@H](CCC1=CC=CC=C1)(NC(=O)C)C(=O)O MCULE-5801585929 [0,0,0,0,0,1|1,0,0]=2 251 B16R1.12306 CC(=O)OCC(CC1=CC=CC=C1)C(=O)O MCULE-3471908543 [0,0,0,0,0,1|2,0,0]=3 252 B16R1.12306 CC(=O)SCC(CC1=CC=CC=C1)C(=O)O MCULE-4621311860 [0,0,0,0,0,1|2,0,0]=3 253 B16R1.12306 O=C(O)CNC(CC1=CC=CC=C1)C(=O)O MCULE-4190549184 [0,0,0,0,0,1|1,0,0]=2 254 B13R1.348 CC(=O)NC(C)CC1=CC=CC=C1 MCULE-3059651521 [2,0,0,0,0,0|1,0,1]=4 255 B13R1.348 CC(CC1=CC=CC=C1)NC(=O)N MCULE-7406787630 [2,0,0,0,0,0|0,0,1]=3 256 B13R1.348 NC(=O)NC(=O)CC1=CC=CC=C1 MCULE-7359277785 [2,0,0,0,0,0|0,0,1]=3 257 B13R1.348 O=C(O)CC(O)CC1=CC=CC=C1 MCULE-8990071495 [2,0,0,0,0,0|2,0,0]=4 258 B13R1.418 CCC(CC1=CC=CC=C1)C(=O)O MCULE-7383023006 [2,0,0,0,0,0|1,0,1]=4 259 B13R1.418 CNC(CC1=CC=CC=C1)C(=O)O MCULE-3842005714 [2,0,0,0,0,0|0,0,1]=3 260 B13R1.418 CNC(CC1=CC=CC=C1)C(=O)O MCULE-7025734622 [2,0,0,0,0,0|0,0,1]=3 261 B13R1.418 CN[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-5892127646 [2,0,0,0,0,0|0,0,1]=3 262 B13R1.418 CN[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-6660510193 [2,0,0,0,0,0|0,0,1]=3 263 B13R1.418 CN[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-7617883459 [2,0,0,0,0,0|0,0,1]=3 264 B13R1.418 CN[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-9210211125 [2,0,0,0,0,0|0,0,1]=3 265 B13R1.418 CN[C@H](CC1=CC=CC=C1)C(=O)O MCULE-2038566174 [2,0,0,0,0,0|0,0,1]=3 266 B13R1.418 CN[C@H](CC1=CC=CC=C1)C(=O)O MCULE-8805615196 [2,0,0,0,0,0|0,0,1]=3 267 B13R1.418 CN[C@H](CC1=CC=CC=C1)C(=O)O MCULE-9690973894 [2,0,0,0,0,0|0,0,1]=3 268 B13R1.418 COC(CC1=CC=CC=C1)C(=O)O MCULE-9999723715 [2,0,0,0,0,0|1,0,1]=4 269 B13R1.418 CO[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-9906113693 [2,0,0,0,0,0|1,0,1]=4 270 B13R1.418 N#CC(CC1=CC=CC=C1)C(=O)O MCULE-2489113249 [2,0,0,0,0,0|0,0,2]=4 271 B13R1.418 NCC(CC1=CC=CC=C1)C(=O)O MCULE-3435928554 [2,0,0,0,0,0|0,0,1]=3 272 B13R1.418 NCC(CC1=CC=CC=C1)C(=O)O MCULE-4710137264 [2,0,0,0,0,0|0,0,1]=3 273 B13R1.418 NCC(CC1=CC=CC=C1)C(=O)O MCULE-5594566401 [2,0,0,0,0,0|0,0,1]=3 274 B13R1.418 NCC(CC1=CC=CC=C1)C(=O)O MCULE-7040954795 [2,0,0,0,0,0|0,0,1]=3 275 B13R1.418 NCC(CC1=CN=CC=C1)C(=O)O MCULE-4896890670 [2,0,0,0,0,0|1,0,1]=4 276 B13R1.418 NCC(CC1=CN=CC=C1)C(=O)O MCULE-7456176624 [2,0,0,0,0,0|1,0,1]=4 277 B13R1.418 NCC(CC1=NC=CC=C1)C(=O)O MCULE-1712969305 [2,0,0,0,0,0|1,0,1]=4 278 B13R1.418 NCC(CC1=NC=CC=C1)C(=O)O MCULE-4796581653 [2,0,0,0,0,0|1,0,1]=4 279 B13R1.418 NCC(OC1=CC=CC=C1)C(=O)O MCULE-4491410346 [2,0,0,0,0,0|1,0,1]=4 280 B13R1.418 NCC(OC1=CC=CC=C1)C(=O)O MCULE-6780268530 [2,0,0,0,0,0|1,0,1]=4 281 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-4543639508 [2,0,0,0,0,0|0,0,1]=3 282 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-6429844971 [2,0,0,0,0,0|0,0,1]=3 283 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-7718503080 [2,0,0,0,0,0|0,0,1]=3 284 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-9663366424 [2,0,0,0,0,0|0,0,1]=3 285 B13R1.418 NC[C@H](CC1=CC=CC=C1)C(=O)O MCULE-3343846707 [2,0,0,0,0,0|0,0,1]=3 286 B13R1.418 NC[C@H](CC1=CC=CC=C1)C(=O)O MCULE-4830325742 [2,0,0,0,0,0|0,0,1]=3 287 B13R1.418 NC[C@H](CC1=CC=CC=C1)C(=O)O MCULE-6363695814 [2,0,0,0,0,0|0,0,1]=3 288 B13R1.418 NC[C@H](CC1=CC=CC=C1)C(=O)O MCULE-8977991880 [2,0,0,0,0,0|0,0,1]=3 289 B13R1.418 NOC(CC1=CC=CC=C1)C(=O)O MCULE-2996535605 [2,0,0,0,0,0|1,0,0]=3 290 B13R1.418 NOC(CC1=CC=CC=C1)C(=O)O MCULE-3251573694 [2,0,0,0,0,0|1,0,0]=3 291 B13R1.418 NOC(CC1=CC=CC=C1)C(=O)O MCULE-5462822882 [2,0,0,0,0,0|1,0,0]=3 292 B13R1.418 NO[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-2535668835 [2,0,0,0,0,0|1,0,0]=3 293 B13R1.418 NO[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-6514153575 [2,0,0,0,0,0|1,0,0]=3 294 B13R1.418 O=C(O)C(CO)CC1=CC=CC=C1 MCULE-8227526589 [2,0,0,0,0,0|0,0,2]=4 295 B13R1.418 O=C(O)[C@@H](CO)CC1=CC=CC=C1 MCULE-6466727593 [2,0,0,0,0,0|0,0,2]=4 296 B13R1.418 O=C(O)[C@@H](CO)CC1=CC=CC=C1 MCULE-9405740406 [2,0,0,0,0,0|0,0,2]=4 297 B13R1.418 O=C(O)[C@H](CO)CC1=CC=CC=C1 MCULE-2746275491 [2,0,0,0,0,0|0,0,2]=4 298 B15R1.966 COC(=O)N[C@H](CO)CC1=CC=CC=C1 MCULE-9236510003 [1,1,0,0,0,0|1,0,1]=4 299 B15R1.1310 COCC(CC1=CC=CC=C1)NC(=O)C MCULE-5519095632 [1,1,0,0,0,0|1,0,1]=4 300 B15R1.1310 COC[C@H](CC1=CC=CC=C1)NC(=O)C MCULE-1645082228 [1,1,0,0,0,0|1,0,1]=4 301 B15R1.1310 COC[C@H](CC1=CC=CC=C1)NC(=O)C MCULE-4709709848 [1,1,0,0,0,0|1,0,1]=4 302 B15R1.1295 C=CCC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-8055327958 [1,1,0,0,0,0|2,0,0]=4 303 B15R1.1295 O=CNC(CC1=CC=C(C=C1)I)C(=O)O MCULE-2685509238 [1,1,0,0,0,0|0,0,0]=2 304 B15R1.1295 O=CNC(CC1=CC=C(C=C1)O)C(=O)O MCULE-1101349598 [1,1,0,0,0,0|0,0,0]=2 305 B15R1.1295 O=CN[C@@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-7482714239 [1,1,0,0,0,0|0,0,0]=2 306 B15R1.1295 O=CN[C@@H](CC1=CC=C(C=C1)I)C(=O)O MCULE-8750794144 [1,1,0,0,0,0|0,0,0]=2 307 B15R1.1295 O=CN[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-4274998340 [1,1,0,0,0,0|0,0,0]=2 308 B15R1.1295 O=CN[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-5381941789 [1,1,0,0,0,0|0,0,0]=2 309 B15R1.1308 COC(=O)C(CC1=CC=CC=C1)N=C=O MCULE-8289853170 [1,1,0,0,0,0|0,0,2]=4 310 B15R1.1308 COC(=O)[C@H](CC1=CC=CC=C1)N=C=O MCULE-1459978083 [1,1,0,0,0,0|0,0,2]=4 311 B15R1.1308 COC(=O)[C@H](CC1=CC=CC=C1)N=C=O MCULE-8067957702 [1,1,0,0,0,0|0,0,2]=4 312 B15R1.1308 COC(=O)[C@H](CC1=CC=CC=C1)NC=O MCULE-5310385567 [1,1,0,0,0,0|0,0,0]=2 313 B15R1.3922 C=CCNC(CC1=CC=CC=C1)C(=O)O MCULE-7770706874 [1,1,0,0,0,0|1,0,0]=3 314 B15R1.3922 NCCCC(CC1=CC=CC=C1)C(=O)O MCULE-2663141103 [1,1,0,0,0,0|1,0,1]=4 315 B15R1.3922 NCCCC(CC1=CC=CC=C1)C(=O)O MCULE-5076292787 [1,1,0,0,0,0|1,0,1]=4 316 B15R1.4689 COC(=O)C(CC1=CSC=C1)NC(=O)C MCULE-8043789209 [0,1,0,0,1,0|2,0,0]=4 317 B15R1.5390 NCC(=O)NC(CC1=CN=CN1)C(=O)O MCULE-6717568372 [0,1,0,0,1,0|2,0,0]=4 318 B15R1.5390 NCC(=O)NC(CC1=CNC=N1)C(=O)O MCULE-9824153492 [0,1,0,0,1,0|2,0,0]=4 319 B15R1.5390 NCC(=O)N[C@@H](CC1=CNC=N1)C(=O)O MCULE-4346760160 [0,1,0,0,1,0|2,0,0]=4 320 B15R1.5904 CS(=O)(=O)C(CC1=CC=CC=C1)C(=O)O MCULE-7996891051 [0,1,0,0,1,0|2,0,0]=4 321 B15R1.8148 O=C(O)C(CC1=CC=CC=C1O)C(=O)O MCULE-8232938811 [0,1,0,0,1,0|1,0,0]=3 322 B15R1.8870 CC(C1=CC=CC=C1)C(C(=O)O)C(=O)O MCULE-4226488974 [0,1,0,0,1,0|1,0,0]=3 323 B15R1.11335 CC(=O)C(CC1=CC=C(C=C1)O)C(=O)C MCULE-7932523086 [0,1,0,0,1,0|2,0,0]=4 324 B15R1.11335 O=C(O)C(CC1=CC=C(C=C1)Br)C(=O)O MCULE-6363357139 [0,1,0,0,1,0|1,0,0]=3 325 B15R1.11335 O=C(O)C(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-3208860243 [0,1,0,0,1,0|1,0,0]=3 326 B15R1.11335 O=C(O)C(CC1=CC=C(C=C1)O)C(=O)O MCULE-5923382507 [0,1,0,0,1,0|1,0,0]=3 327 B15R1.349 CC(=O)NC(C(=O)C)C1=C(C=CC=C1)F MCULE-1737263422 [0,1,0,0,1,0|2,0,0]=4 328 B15R1.349 CC(=O)NC(C(=O)O)C1=C(C=CC=C1)F MCULE-4260273365 [0,1,0,0,1,0|1,0,0]=3 329 B15R1.349 CC1=C(C=CC=C1)C(CC(=O)O)C(=O)O MCULE-1677041266 [0,1,0,0,1,0|2,0,0]=4 330 B15R1.349 O=C(O)CC(C(=O)O)C1=C(C=CC=C1)Cl MCULE-6700276384 [0,1,0,0,1,0|2,0,0]=4 331 B15R1.349 O=C(O)CC(C(=O)O)C1=C(C=CC=C1)F MCULE-8173663917 [0,1,0,0,1,0|2,0,0]=4 332 B15R1.349 O=C(O)CC(C(=O)O)C1=CC=CC=C1Br MCULE-6863274666 [0,1,0,0,1,0|2,0,0]=4 333 B15R1.349 O=C(O)CC(C(=O)O)C1=CC=CC=C1O MCULE-4868269421 [0,1,0,0,1,0|2,0,0]=4 334 B15R1.922 CC(=O)NC(C(=O)O)C1=CC=C(C=C1)F MCULE-5652370857 [0,1,0,0,1,0|1,0,0]=3 335 B15R1.922 CC(=O)NC(C(=O)O)C1=CC=C(C=C1)O MCULE-4977031558 [0,1,0,0,1,0|1,0,0]=3 336 B15R1.922 CC(=O)N[C@@H](C(=O)O)C1=CC=C(C=C1)F MCULE-2385998955 [0,1,0,0,1,0|1,0,0]=3 337 B15R1.922 CC(=O)N[C@@H](C(=O)O)C1=CC=C(C=C1)F MCULE-6332508966 [0,1,0,0,1,0|1,0,0]=3 338 B15R1.922 CC(=O)N[C@H](C(=O)O)C1=CC=C(C=C1)F MCULE-4958843201 [0,1,0,0,1,0|1,0,0]=3 339 B15R1.922 CC(=O)N[C@H](C(=O)O)C1=CC=C(C=C1)F MCULE-9520599949 [0,1,0,0,1,0|1,0,0]=3 340 B15R1.922 CC(=O)OC(C(=O)O)C1=CC=C(C=C1)Cl MCULE-2208396091 [0,1,0,0,1,0|2,0,0]=4 341 B15R1.922 CC1=CC=C(C=C1)C(CC(=O)O)C(=O)O MCULE-6105802876 [0,1,0,0,1,0|2,0,0]=4 342 B15R1.922 NC1=CC=C(C=C1)C(CC(=O)O)C(=O)O MCULE-2760603838 [0,1,0,0,1,0|2,0,0]=4 343 B15R1.922 O=C(O)CC(C(=O)O)C1=CC=C(C=C1)Br MCULE-4737346751 [0,1,0,0,1,0|2,0,0]=4 344 B15R1.922 O=C(O)CC(C(=O)O)C1=CC=C(C=C1)Cl MCULE-5150081413 [0,1,0,0,1,0|2,0,0]=4 345 B15R1.922 O=C(O)CC(C(=O)O)C1=CC=C(C=C1)F MCULE-5128419700 [0,1,0,0,1,0|2,0,0]=4 346 B15R1.3197 COC(=O)C(NC(=O)C)C1=CC=CC=C1 MCULE-7032838449 [0,1,0,0,1,0|1,0,0]=3 347 B15R1.3197 COC(=O)C(OC(=O)C)C1=CC=CC=C1 MCULE-4064010475 [0,1,0,0,1,0|2,0,0]=4 348 B15R1.3197 COC(=O)[C@@H](NC(=O)C)C1=CC=CC=C1 MCULE-4258640798 [0,1,0,0,1,0|1,0,0]=3 349 B15R1.5903 CS(=O)(=O)NC(C(=O)O)C1=CC=CC=C1 MCULE-6173098690 [0,1,0,0,1,0|2,0,0]=4 350 B15R1.8317 CC(=O)NC(C(=O)O)C1=CC(=CC=C1)Br MCULE-2383776949 [0,1,0,0,1,0|1,0,0]=3 351 B15R1.8317 CC(=O)NC(C(=O)O)C1=CC(=CC=C1)Cl MCULE-4480399241 [0,1,0,0,1,0|1,0,0]=3 352 B15R1.8317 CC(=O)N[C@@H](C(=O)O)C1=CC=CC(=C1)Cl MCULE-2741796093 [0,1,0,0,1,0|1,0,0]=3 353 B15R1.8317 CC(=O)N[C@H](C(=O)O)C1=CC=CC(=C1)Cl MCULE-1695096523 [0,1,0,0,1,0|1,0,0]=3 354 B15R1.8317 CC1=CC=CC(=C1)C(CC(=O)O)C(=O)O MCULE-3735525527 [0,1,0,0,1,0|2,0,0]=4 355 B15R1.8317 O=C(O)CC(C(=O)O)C1=CC(=CC=C1)Br MCULE-7820458603 [0,1,0,0,1,0|2,0,0]=4 356 B15R1.8317 O=C(O)CC(C(=O)O)C1=CC(=CC=C1)Cl MCULE-3928930222 [0,1,0,0,1,0|2,0,0]=4 357 B15R1.8317 O=C(O)CC(C(=O)O)C1=CC(=CC=C1)F MCULE-8611781260 [0,1,0,0,1,0|2,0,0]=4 358 B15R1.11817 CCC(=O)NC(C(=O)O)C1=CC=CC=C1 MCULE-6106074292 [0,1,0,0,1,0|1,0,0]=3 359 B15R1.11817 CNC(=O)C=C(C(=O)O)C1=CC=CC=C1 MCULE-9455710574 [0,1,0,0,1,0|1,0,1]=4 360 B15R1.11817 COC(=O)NC(C(=O)O)C1=CC=CC=C1 MCULE-1670354720 [0,1,0,0,1,0|1,0,0]=3 361 B15R1.11817 COC(=O)NC(C(=O)O)C1=CC=CC=C1 MCULE-4196482002 [0,1,0,0,1,0|1,0,0]=3 362 B15R1.11817 COC(=O)N[C@@H](C(=O)O)C1=CC=CC=C1 MCULE-7663772984 [0,1,0,0,1,0|1,0,0]=3 363 B15R1.11817 COC(=O)N[C@@H](C(=O)O)C1=CC=CC=C1 MCULE-8979024790 [0,1,0,0,1,0|1,0,0]=3 364 B15R1.11817 COC(=O)N[C@H](C(=O)O)C1=CC=CC=C1 MCULE-2736172379 [0,1,0,0,1,0|1,0,0]=3 365 B15R1.11817 COC(=O)N[C@H](C(=O)O)C1=CC=CC=C1 MCULE-8919054720 [0,1,0,0,1,0|1,0,0]=3 366 B15R1.11817 O=C(CCl)NC(C(=O)O)C1=CC=CC=C1 MCULE-4430276075 [0,1,0,0,1,0|1,0,0]=3 367 B15R1.11817 O=C(CCl)N[C@H](C(=O)O)C1=CC=CC=C1 MCULE-8967929714 [0,1,0,0,1,0|1,0,0]=3 368 B15R1.12241 CC(=O)NC(C)(C(=O)O)C1=CC=CC=C1 MCULE-7800493061 [0,1,0,0,1,0|1,0,0]=3 369 B15R1.12241 CC(=O)N[C@](C)(C(=O)O)C1=CC=CC=C1 MCULE-1493317362 [0,1,0,0,1,0|1,0,0]=3 370 B15R1.12241 CC(CC(=O)O)(C(=O)O)C1=CC=CC=C1 MCULE-2427015918 [0,1,0,0,1,0|2,0,0]=4 371 B15R1.31796 CC(C(=O)O)C(C(=O)O)C1=CC=CC=C1 MCULE-2830437797 [0,1,0,0,1,0|2,0,0]=4 372 B15R1.31796 NC(C(=O)O)C(C(=O)O)C1=CC=CC=C1 MCULE-8637556059 [0,1,0,0,1,0|2,0,0]=4 373 B17R1.7968 COC(=O)N[C@H](CC(=O)O)CC1=NC=CC=C1 MCULE-7320449848 [0,1,0,0,0,1|2,0,0]=4 374 B17R1.7987 COC(=O)C(CC(=O)N)NCC1=CC=CC=C1 MCULE-3554434802 [0,1,0,0,0,1|1,0,0]=3 375 B17R1.7987 COC(=O)C(CC(=O)N)NCC1=CC=CC=C1 MCULE-9566332024 [0,1,0,0,0,1|1,0,0]=3 376 B17R1.7987 COC(=O)C(CC(=O)O)NCC1=CC=CC=C1 MCULE-4371780097 [0,1,0,0,0,1|2,0,0]=4 377 B17R1.7987 COC(=O)[C@H](CC(=O)N)NCC1=CC=CC=C1 MCULE-3144753975 [0,1,0,0,0,1|1,0,0]=3 378 B17R1.7987 COC(=O)[C@H](CC(=O)N)NCC1=CC=CC=C1 MCULE-6201076409 [0,1,0,0,0,1|1,0,0]=3 379 B17R1.7987 COC(=O)[C@H](CC(=O)N)NCC1=CC=CC=C1 MCULE-8327150806 [0,1,0,0,0,1|1,0,0]=3 380 B17R1.7987 COC(=O)[C@H](CC(=O)N)NCC1=CC=CC=C1 MCULE-9502113206 [0,1,0,0,0,1|1,0,0]=3 381 B17R1.23553 CC(=O)NC(CSC1=CC=C(C=C1)Br)C(=O)O MCULE-1280747732 [0,1,0,0,0,1|1,0,0]=3 382 B17R1.23553 CC(=O)NC(CSC1=CC=C(C=C1)Cl)C(=O)O MCULE-1783218093 [0,1,0,0,0,1|1,0,0]=3 383 B17R1.23553 CC1=CC=C(C=C1)CSC(CC(=O)O)C(=O)O MCULE-9818923547 [0,1,0,0,0,1|2,0,0]=4 384 B17R1.23826 COC(=O)NC(CCC1=CC=CC=C1)C(=O)O MCULE-5865923241 [0,1,0,0,0,1|1,0,0]=3 385 B17R1.26184 NC(=O)CC(NC(=O)C1=CC=CC=C1)C(=O)O MCULE-1966140305 [0,1,0,0,0,1|1,0,1]=4 386 B17R1.36462 NC(C(=O)O)C(OCC1=CC=CC=C1)C(=O)O MCULE-8839205510 [0,1,0,0,0,1|2,0,0]=4 387 B17R1.36462 N[C@@H](C(=O)O)[C@@H](OCC1=CC=CC=C1)C(=O)O MCULE-6135011329 [0,1,0,0,0,1|2,0,0]=4 388 B17R1.36462 N[C@H](C(=O)O)[C@H](OCC1=CC=CC=C1)C(=O)O MCULE-3365317268 [0,1,0,0,0,1|2,0,0]=4 389 B17R1.36462 N[C@H](C(=O)O)[C@H](OCC1=CC=CC=C1)C(=O)O MCULE-8020411572 [0,1,0,0,0,1|2,0,0]=4 390 B17R1.23536 O=C(O)CCC(CC1=CC=C(C=C1)Cl)C(=O)O MCULE-9202061433 [0,1,0,0,0,1|2,0,0]=4 391 B17R1.36429 CC(N)C(=O)NC(CC1=CC=CC=C1)C(=O)O MCULE-6186580574 [0,1,0,0,0,1|1,0,1]=4 392 B17R1.36429 C[C@@H](N)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-2304095533 [0,1,0,0,0,1|1,0,1]=4 393 B17R1.36429 C[C@@H](N)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-6183682368 [0,1,0,0,0,1|1,0,1]=4 394 B17R1.36429 C[C@H](N)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-3186024561 [0,1,0,0,0,1|1,0,1]=4 395 B17R1.36429 C[C@H](N)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-8864814338 [0,1,0,0,0,1|1,0,1]=4 396 B17R1.36429 C[C@H](N)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-5859953995 [0,1,0,0,0,1|1,0,1]=4 397 B17R1.36429 NC(CC(CC1=CC=CC=C1)C(=O)O)C(=O)O MCULE-8971526598 [0,1,0,0,0,1|2,0,0]=4 398 B17R1.36429 NC(CC(CC1=CC=CC=C1)C(=O)O)C(=O)O MCULE-9390085519 [0,1,0,0,0,1|2,0,0]=4 399 B17R1.36429 N[C@@H](C[C@H](CC1=CC=CC=C1)C(=O)O)C(=O)O MCULE-1206274486 [0,1,0,0,0,1|2,0,0]=4 400 B17R1.36429 N[C@@H](C[C@H](CC1=CC=CC=C1)C(=O)O)C(=O)O MCULE-2633137247 [0,1,0,0,0,1|2,0,0]=4 401 B17R1.36429 N[C@@H](C[C@H](CC1=CC=CC=C1)C(=O)O)C(=O)O MCULE-7436417496 [0,1,0,0,0,1|2,0,0]=4 402 B17R1.36429 N[C@@H](C[C@H](CC1=CC=CC=C1)C(=O)O)C(=O)O MCULE-9017746445 [0,1,0,0,0,1|2,0,0]=4 403 B17R1.36429 N[C@H](C[C@@H](CC1=CC=CC=C1)C(=O)O)C(=O)O MCULE-1517774073 [0,1,0,0,0,1|2,0,0]=4 404 B17R1.36429 N[C@H](C[C@@H](CC1=CC=CC=C1)C(=O)O)C(=O)O MCULE-7591027350 [0,1,0,0,0,1|2,0,0]=4 405 B17R1.36429 N[C@H](C[C@@H](CC1=CC=CC=C1)C(=O)O)C(=O)O MCULE-9350480490 [0,1,0,0,0,1|2,0,0]=4 406 B17R1.36429 N[C@H](C[C@@H](CC1=CC=CC=C1)C(=O)O)C(=O)O MCULE-9505161019 [0,1,0,0,0,1|2,0,0]=4 407 B17R1.36429 O=C(O)C(=O)NC(CC1=CC=CC=C1)C(=O)O MCULE-9730119787 [0,1,0,0,0,1|1,0,0]=3 408 B17R1.36429 [C@@H](C)(N)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-6213421613 [0,1,0,0,0,1|1,0,1]=4 409 B17R1.412630 NC(CCC(=O)O)(CC1=CC=CC=C1)C(=O)O MCULE-6952871416 [0,1,0,0,0,1|2,0,0]=4 410 B17R1.6931 COC(=O)C(CC1=CC=CC(=C1)N)NC(=O)C MCULE-2543508811 [0,2,0,0,0,0|1,0,0]=3 411 B17R1.7966 CCC(=O)NC(CC1=CC=CC=C1)C(=O)NN MCULE-7763261101 [0,2,0,0,0,0|2,0,0]=4 412 B17R1.7966 COC(=O)C(CC1=CC=CC=C1)NC(=O)CCl MCULE-6369774088 [0,2,0,0,0,0|1,0,0]=3 413 B17R1.7966 COC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)OC MCULE-9112725270 [0,2,0,0,0,0|1,0,0]=3 414 B17R1.7966 COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CCl MCULE-2903162342 [0,2,0,0,0,0|1,0,0]=3 415 B17R1.18492 CCOC(=O)C(CC1=CC=CC=C1)NC(=O)C MCULE-5134665395 [0,2,0,0,0,0|1,0,0]=3 416 B17R1.18492 CCOC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C MCULE-2254253156 [0,2,0,0,0,0|1,0,0]=3 417 B17R1.18492 CCOC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C MCULE-9383762777 [0,2,0,0,0,0|1,0,0]=3 418 B17R1.23809 CC(=O)NC(CC1=CC=C(C=C1)O)C(=O)NN MCULE-9231164432 [0,2,0,0,0,0|2,0,0]=4 419 B17R1.23809 CC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)NN MCULE-2287188057 [0,2,0,0,0,0|2,0,0]=4 420 B17R1.23809 CC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)NN MCULE-9379557362 [0,2,0,0,0,0|2,0,0]=4 421 B17R1.23809 CNC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C MCULE-8164204599 [0,2,0,0,0,0|2,0,0]=4 422 B17R1.23809 CNC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)C MCULE-1582840447 [0,2,0,0,0,0|2,0,0]=4 423 B17R1.23809 CNC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)C MCULE-2044390724 [0,2,0,0,0,0|2,0,0]=4 424 B17R1.23809 COC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C MCULE-2636294772 [0,2,0,0,0,0|1,0,0]=3 425 B17R1.23809 COC(=O)[C@@H](CC1=CC=C(C=C1)O)NC(=O)C MCULE-3506672244 [0,2,0,0,0,0|1,0,0]=3 426 B17R1.23809 COC(=O)[C@@H](CC1=CC=C(C=C1)O)NC(=O)C MCULE-5307815180 [0,2,0,0,0,0|1,0,0]=3 427 B17R1.23809 COC(=O)[C@H](CC1=CC=C(C=C1)N)NC(=O)C MCULE-2928128386 [0,2,0,0,0,0|1,0,0]=3 428 B17R1.23809 COC(=O)[C@H](CC1=CC=C(C=C1)N)NC(=O)C MCULE-4148632893 [0,2,0,0,0,0|1,0,0]=3 429 B17R1.23809 COC(=O)[C@H](CC1=CC=C(C=C1)N)NC(=O)C MCULE-5523065662 [0,2,0,0,0,0|1,0,0]=3 430 B17R1.23809 COC(=O)[C@H](CC1=CC=C(C=C1)N)NC(=O)C MCULE-9217171407 [0,2,0,0,0,0|1,0,0]=3 431 B17R1.23809 COC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)C MCULE-3011069516 [0,2,0,0,0,0|1,0,0]=3 432 B17R1.23809 COC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)C MCULE-7697558792 [0,2,0,0,0,0|1,0,0]=3 433 B17R1.5389 C(CC1=CC=CC=C1)(NC(=O)OCC)C(=O)O MCULE-4881906194 [0,2,0,0,0,0|1,0,0]=3 434 B17R1.5389 CCOC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O MCULE-2018360017 [0,2,0,0,0,0|1,0,0]=3 435 B17R1.5389 CCOC(=O)N[C@H](CC1=CC=CC=C1)C(=O)O MCULE-1071593042 [0,2,0,0,0,0|1,0,0]=3 436 B17R1.5389 [C@@H](CC1=CC=CC=C1)(NC(=O)OCC)C(=O)O MCULE-1640476510 [0,2,0,0,0,0|1,0,0]=3 437 B17R1.7954 NCC(=O)NC(CC1=CC=C(C=C1)O)C(=O)O MCULE-6628542658 [0,2,0,0,0,0|0,0,0]=2 438 B17R1.7954 NCC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-6329282595 [0,2,0,0,0,0|0,0,0]=2 439 B17R1.7954 NCC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-8379516554 [0,2,0,0,0,0|0,0,0]=2 440 B17R1.7954 O=C(CCl)NC(CC1=CC=C(C=C1)O)C(=O)O MCULE-6074252538 [0,2,0,0,0,0|1,0,0]=3 441 B17R1.7954 O=C(CCl)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-3371076085 [0,2,0,0,0,0|1,0,0]=3 442 B17R1.7954 O=C(CCl)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O MCULE-7374982427 [0,2,0,0,0,0|1,0,0]=3 443 B17R1.25004 CCC(=O)NC(C(=O)O)C(O)C1=CC=CC=C1 MCULE-5115218416 [0,2,0,0,0,0|1,0,0]=3 444 B17R1.268 CC(=O)NC(CC1=CC=C(C=C1)C#N)C(=O)O MCULE-1832196553 [0,2,0,0,0,0|1,0,0]=3 445 B17R1.268 COC1=CC=C(C=C1)CC(CC(=O)O)C(=O)O MCULE-3627564279 [0,2,0,0,0,0|2,0,0]=4 446 B17R1.268 COC1=CC=C(C=C1)CC(NC(=O)C)C(=O)O MCULE-4309352441 [0,2,0,0,0,0|1,0,0]=3 447 B17R1.268 COC1=CC=C(C=C1)C[C@H](NC(=O)C)C(=O)O MCULE-3276180237 [0,2,0,0,0,0|1,0,0]=3 448 B17R1.268 COC1=CC=C(C=C1)C[C@H](NC(=O)C)C(=O)O MCULE-6719665060 [0,2,0,0,0,0|1,0,0]=3 449 B17R1.23636 CC(=O)NC(CC1=CC(=C(C=C1)F)F)C(=O)O MCULE-2635856924 [0,2,0,0,0,0|1,0,0]=3 450 B17R1.23636 CC(=O)NC(CC1=CC(=C(C=C1)O)I)C(=O)N MCULE-2655068574 [0,2,0,0,0,0|2,0,0]=4 451 B17R1.23636 CC(=O)NC(CC1=CC=C(C(=C1)C)C)C(=O)O MCULE-7801069925 [0,2,0,0,0,0|1,0,0]=3 452 B17R1.23636 CC(=O)NC(CC1=CC=C(C(=C1)F)O)C(=O)O MCULE-2159892212 [0,2,0,0,0,0|1,0,0]=3 453 B17R1.23636 CC(=O)N[C@@H](CC1=CC=C(C(=C1)F)O)C(=O)O MCULE-8012445661 [0,2,0,0,0,0|1,0,0]=3 454 B17R1.23636 CC(=O)N[C@@H](CC1=CC=C(C(=C1)I)O)C(=O)N MCULE-5350072621 [0,2,0,0,0,0|2,0,0]=4 455 B17R1.23636 NC(=O)NC(CC1=CC=C(C(=C1)O)O)C(=O)O MCULE-7003161482 [0,2,0,0,0,0|0,0,0]=2 456 B17R1.23636 NC(=S)NC(CC1=CC=C(C(=C1)O)O)C(=O)O MCULE-3859619342 [0,2,0,0,0,0|0,1,0]=3 457 B17R1.6272 CC(=O)NC(CC1=CC(=CC=C1)C#N)C(=O)O MCULE-6332938007 [0,2,0,0,0,0|1,0,0]=3 458 B17R1.6272 CC(=O)N[C@@H](CC1=CC(=CC=C1)C#N)C(=O)O MCULE-9781808438 [0,2,0,0,0,0|1,0,0]=3 459 B17R1.6272 CC(=O)N[C@@H](CC1=CC=CC(=C1)C#N)C(=O)O MCULE-5837423168 [0,2,0,0,0,0|1,0,0]=3 460 B17R1.6272 COC1=CC(=CC=C1)CC(NC(=O)C)C(=O)O MCULE-9954046916 [0,2,0,0,0,0|1,0,0]=3 461 B17R1.6272 COC1=CC=CC(=C1)CC(CC(=O)O)C(=O)O MCULE-6711297644 [0,2,0,0,0,0|2,0,0]=4 462 B17R1.8849 CS(=O)(=O)N[C@@H](CC1=CC=CC(=C1)F)C(=O)O MCULE-6504583762 [0,2,0,0,0,0|2,0,0]=4 463 B17R1.61667 CC(=O)N[C@H](CC1=CC(=CC(=C1)F)F)C(=O)O MCULE-7383815336 [0,2,0,0,0,0|1,0,0]=3 464 B17R1.61667 CC1=CC(=CC(=C1)CC(CC(=O)O)C(=O)O)C MCULE-8653947047 [0,2,0,0,0,0|2,0,0]=4 465 B17R1.95704 CC1=CC=CC(=C1)CC(C(=O)O)C(C)C(=O)O MCULE-3080810594 [0,2,0,0,0,0|2,0,0]=4 466 B17R1.96778 CC(=O)NC(CC1=CC(=CC=C1F)F)C(=O)O MCULE-1819170236 [0,2,0,0,0,0|1,0,0]=3 467 B17R1.96778 CC(=O)N[C@@H](CC1=C(C=CC(=C1)F)F)C(=O)O MCULE-8366448862 [0,2,0,0,0,0|1,0,0]=3 468 B17R1.96778 CC(=O)N[C@@H](CC1=CC(=CC=C1F)F)C(=O)O MCULE-2015465866 [0,2,0,0,0,0|1,0,0]=3 469 B17R1.96778 CC(=O)N[C@H](CC1=CC(=CC=C1F)F)C(=O)O MCULE-6732852472 [0,2,0,0,0,0|1,0,0]=3 470 B17R1.96778 CC(=O)N[C@H](CC1=CC(=CC=C1F)F)C(=O)O MCULE-7144478054 [0,2,0,0,0,0|1,0,0]=3 471 B17R1.27791 COC1=C(C=CC=C1)CC(CC(=O)O)C(=O)O MCULE-5410489682 [0,2,0,0,0,0|2,0,0]=4 472 B17R1.76675 CC(=O)NC(CC1=C(C=CC=C1F)F)C(=O)O MCULE-4740831258 [0,2,0,0,0,0|1,0,0]=3 473 B17R1.76675 CC(=O)N[C@H](CC1=C(C=CC=C1F)F)C(=O)O MCULE-4962796073 [0,2,0,0,0,0|1,0,0]=3 474 B17R1.76675 CC(=O)N[C@H](CC1=C(C=CC=C1F)F)C(=O)O MCULE-9158651387 [0,2,0,0,0,0|1,0,0]=3 475 B17R1.36388 CC(C(=O)O)C(C(=O)O)C(C)C1=CC=CC=C1 MCULE-3460960360 [0,2,0,0,0,0|2,0,0]=4 476 B15R2.16 O=CC1=C(NC(=O)N1)C2=CC=CC=C2 MCULE-9767182383 [1,0,0,1,0,0|0,0,2]=4 477 B15R2.31 O=C1COCC(N1)CC2=CC=CC=C2 MCULE-3725101748 [1,0,0,1,0,0|1,0,1]=4 478 B15R2.31 O=C1COC[C@@H](N1)CC2=CC=CC=C2 MCULE-2781568519 [1,0,0,1,0,0|1,0,1]=4 479 B15R2.31 O=C1COC[C@@H](N1)CC2=CC=CC=C2 MCULE-7768411797 [1,0,0,1,0,0|1,0,1]=4 480 B15R2.31 O=C1COC[C@H](N1)CC2=CC=CC=C2 MCULE-1117043509 [1,0,0,1,0,0|1,0,1]=4 481 B15R2.31 O=C1COC[C@H](N1)CC2=CC=CC=C2 MCULE-1360065838 [1,0,0,1,0,0|1,0,1]=4 482 B15R2.325 N=C1NC(=O)C(S1)CC2=CC=CC=C2 MCULE-7499318771 [1,0,0,1,0,0|2,0,0]=4 483 B15R2.325 N=C1NC(=O)C([Se]1)CC2=CC=CC=C2 MCULE-3281103702 [1,0,0,1,0,0|2,0,0]=4 484 B15R2.325 O=C1CC(C(=O)N1)CC2=CC=CC=C2 MCULE-1795003444 [1,0,0,1,0,0|1,0,0]=3 485 B15R2.325 O=C1CC(C(=O)O1)CC2=CC=CC=C2 MCULE-1240467659 [1,0,0,1,0,0|2,0,0]=4 486 B15R2.325 O=C1CN(C(=O)N1)CC2=CC=CC=C2 MCULE-6656636388 [1,0,0,1,0,0|2,0,0]=4 487 B15R2.325 O=C1NC(=O)/C(=C/C2=CC=CC=C2)/N1 MCULE-3140020604 [1,0,0,1,0,0|0,0,2]=4 488 B15R2.325 O=C1NC(=O)/C(=C\C2=CC=CC=C2)/N1 MCULE-9960386229 [1,0,0,1,0,0|0,0,2]=4 489 B15R2.325 O=C1NC(=O)C(=CC2=CC=CC=C2)N1 MCULE-2817503421 [1,0,0,1,0,0|0,0,2]=4 490 B15R2.325 O=C1NC(=O)C(N1)CC2=CC=CC=C2 MCULE-9538592787 [1,0,0,1,0,0|0,0,0]=2 491 B15R2.325 O=C1NC(=O)C(S1)CC2=CC=CC=C2 MCULE-8237425754 [1,0,0,1,0,0|1,0,0]=3 492 B15R2.325 O=C1NC(=O)C(S1)CC2=CC=NC=C2 MCULE-9912238551 [1,0,0,1,0,0|2,0,0]=4 493 B15R2.325 O=C1NC(=O)C(S1)NC2=CC=CC=C2 MCULE-3125752532 [1,0,0,1,0,0|2,0,0]=4 494 B15R2.325 O=C1NC(C(=O)O1)CC2=CC=CC=C2 MCULE-1223889879 [1,0,0,1,0,0|1,0,0]=3 495 B15R2.325 O=C1NC(C(=O)O1)CC2=CC=CC=C2 MCULE-3374656421 [1,0,0,1,0,0|1,0,0]=3 496 B15R2.325 O=C1N[C@@H](C(=O)O1)CC2=CC=CC=C2 MCULE-1712998197 [1,0,0,1,0,0|1,0,0]=3 497 B15R2.325 O=C1N[C@@H](C(=O)O1)CC2=CC=CC=C2 MCULE-6907669002 [1,0,0,1,0,0|1,0,0]=3 498 B15R2.325 O=C1N[C@H](C(=O)O1)CC2=CC=CC=C2 MCULE-2410241714 [1,0,0,1,0,0|1,0,0]=3 499 B15R2.325 O=C1N[C@H](C(=O)O1)CC2=CC=CC=C2 MCULE-2729161489 [1,0,0,1,0,0|1,0,0]=3 500 B15R2.325 O=C1OC(=O)C(O1)CC2=CC=CC=C2 MCULE-3642964341 [1,0,0,1,0,0|2,0,0]=4 501 B15R2.325 O=C1[N-]C(=O)C(S1)CC2=CC=CC=C2 MCULE-8586754531 [1,0,0,1,0,0|1,0,1]=4 502 B15R2.629 O=C(O)CC1CC2=C(C1=O)C=CC=C2 MCULE-1402715967 [1,0,0,1,0,0|2,0,0]=4 503 B15R2.1853 CC(=O)N1C2=C(C=CC=C2)CC1CO MCULE-1040406068 [1,0,0,1,0,0|1,0,1]=4 504 B15R2.63 O=C(O)C1CCNC1C2=CC=CC=C2 MCULE-7751335543 [1,0,0,1,0,0|1,0,1]=4 505 B15R2.63 O=C(O)C1CCNC1C2=CC=CC=C2 MCULE-7761413616 [1,0,0,1,0,0|1,0,1]=4 506 B15R2.63 O=C(O)C1NCCC1C2=CC=CC=C2 MCULE-1529042202 [1,0,0,1,0,0|1,0,1]=4 507 B15R2.63 O=C(O)C1NCCC1C2=CC=CC=C2 MCULE-5474087449 [1,0,0,1,0,0|1,0,1]=4 508 B15R2.63 O=C(O)[C@@H]1CCN[C@@H]1C2=CC=CC=C2 MCULE-7005543602 [1,0,0,1,0,0|1,0,1]=4 509 B15R2.63 O=C(O)[C@@H]1CCN[C@@H]1C2=CC=CC=C2 MCULE-7491540325 [1,0,0,1,0,0|1,0,1]=4 510 B15R2.63 O=C(O)[C@@H]1CCN[C@H]1C2=CC=CC=C2 MCULE-2540425485 [1,0,0,1,0,0|1,0,1]=4 511 B15R2.63 O=C(O)[C@@H]1CCN[C@H]1C2=CC=CC=C2 MCULE-6398237626 [1,0,0,1,0,0|1,0,1]=4 512 B15R2.63 O=C(O)[C@@H]1CCN[C@H]1C2=CC=CC=C2 MCULE-8975564470 [1,0,0,1,0,0|1,0,1]=4 513 B15R2.63 O=C(O)[C@H]1CCN[C@@H]1C2=CC=CC=C2 MCULE-1699039165 [1,0,0,1,0,0|1,0,1]=4 514 B15R2.63 O=C(O)[C@H]1CCN[C@@H]1C2=CC=CC=C2 MCULE-2154401526 [1,0,0,1,0,0|1,0,1]=4 515 B15R2.63 O=C(O)[C@H]1CCN[C@H]1C2=CC=CC=C2 MCULE-1846282354 [1,0,0,1,0,0|1,0,1]=4 516 B15R2.63 O=C(O)[C@H]1CCN[C@H]1C2=CC=CC=C2 MCULE-3178249774 [1,0,0,1,0,0|1,0,1]=4 517 B15R2.63 O=C(O)[C@H]1CCN[C@H]1C2=CC=CC=C2 MCULE-6606917087 [1,0,0,1,0,0|1,0,1]=4 518 B15R2.63 O=C(O)[C@H]1CCN[C@H]1C2=CC=CC=C2 MCULE-7315882666 [1,0,0,1,0,0|1,0,1]=4 519 B15R2.63 O=C(O)[C@H]1NCCC1C2=CC=CC=C2 MCULE-2778567897 [1,0,0,1,0,0|1,0,1]=4 520 B15R2.63 O=C(O)[C@H]1NCCC1C2=CC=CC=C2 MCULE-3897934064 [1,0,0,1,0,0|1,0,1]=4 521 B15R2.63 O=C(O)[C@H]1NCC[C@@H]1C2=CC=CC=C2 MCULE-2413326049 [1,0,0,1,0,0|1,0,1]=4 522 B15R2.63 O=C(O)[C@H]1NCC[C@@H]1C2=CC=CC=C2 MCULE-4215021062 [1,0,0,1,0,0|1,0,1]=4 523 B15R2.63 O=C(O)[C@H]1NCC[C@@H]1C2=CC=CC=C2 MCULE-7627251214 [1,0,0,1,0,0|1,0,1]=4 524 B15R2.63 O=C(O)[C@H]1NCC[C@@H]1C2=CC=CC=C2 MCULE-9372747261 [1,0,0,1,0,0|1,0,1]=4 525 B15R2.1237 O=C(O)C1CC2=C(C=CC=C2)CCN1 MCULE-4916810268 [1,0,0,1,0,0|1,0,1]=4 526 B15R2.1237 O=C(O)C1CC2=C(C=CC=C2)CCN1 MCULE-9946579383 [1,0,0,1,0,0|1,0,1]=4 527 B15R2.14951 CC(=O)C1CC2=C(C=CC=C2)C(=O)O1 MCULE-8798283850 [1,0,0,1,0,0|2,0,0]=4 528 B15R2.14951 O=C(O)C1=CC2=C(C=CC=C2)C(=O)N1 MCULE-8575275090 [1,0,0,1,0,0|0,0,2]=4 529 B15R2.14951 O=C(O)C1=NC2=C(C=CC=C2)C(=O)N1 MCULE-7255562861 [1,0,0,1,0,0|1,0,1]=4 530 B15R2.14951 O=C1CC(CC2=CC=CC=C12)C(=O)O MCULE-9167871622 [1,0,0,1,0,0|1,0,0]=3 531 B15R2.14951 O=C1CC(NC2=C1C=CC=C2)C(=O)O MCULE-4668772511 [1,0,0,1,0,0|2,0,0]=4 532 B15R2.14951 O=C1CC(OC2=CC=CC=C12)C(=O)O MCULE-4926347738 [1,0,0,1,0,0|2,0,0]=4 533 B15R2.14951 O=C1CC(SC2=CC=CC=C12)C(=O)O MCULE-1467187532 [1,0,0,1,0,0|2,0,0]=4 534 B15R2.14951 O=C1C[C@H](CC2=C1C=CC=C2)C(=O)O MCULE-4882614324 [1,0,0,1,0,0|1,0,0]=3 535 B15R2.14951 O=C1NC(CC2=CC=CC=C12)C(=O)O MCULE-8729946381 [1,0,0,1,0,0|0,0,0]=2 536 B15R2.14951 O=C1OC(CC2=C1C=CC=C2)C(=O)O MCULE-6471951001 [1,0,0,1,0,0|1,0,0]=3 537 B15R2.328 O=C1CC(C(N1)C(=O)O)C2=CC=CS2 MCULE-3766213550 [0,0,0,1,1,0|2,0,0]=4 538 B15R2.355 CC1=NNC(=O)C1CC2=CC=CC=C2 MCULE-6663956173 [0,0,0,1,1,0|2,0,0]=4 539 B15R2.355 O=C1CNC(=O)N1CC2=CC=CC=C2 MCULE-7874276113 [0,0,0,1,1,0|2,0,0]=4 540 B15R2.984 NC(=O)C1=CC2=C(C=CC=C2)OC1=O MCULE-2494960118 [0,0,0,1,1,0|0,0,2]=4 541 B15R2.984 NC(=O)C1CC2=CC=CC=C2NC1=O MCULE-5967401690 [0,0,0,1,1,0|1,0,0]=3 542 B15R2.984 O=C(O)C1=CC2=C(C=CC=C2)NC1=O MCULE-6896806628 [0,0,0,1,1,0|0,0,2]=4 543 B15R2.984 O=C(O)C1CC2=C(C=CC=C2)NC1=O MCULE-4652437669 [0,0,0,1,1,0|0,0,0]=2 544 B15R2.984 O=C(O)C1OC2=CC=CC=C2NC1=O MCULE-1140670269 [0,0,0,1,1,0|1,0,0]=3 545 B15R2.16281 O=C(O)C1CC2=C(S1(=O)=O)C=CC=C2 MCULE-9017340555 [0,0,0,1,1,0|2,0,0]=4 546 B15R2.988 O=C1CC(C2=C(N1)N=CC=C2)C(=O)O MCULE-7897986602 [0,0,0,1,1,0|2,0,0]=4 547 B15R2.988 O=C1N=C(C2=CC=CC=C2N1)C(=O)O MCULE-7494873902 [0,0,0,1,1,0|0,0,2]=4 548 B15R2.993 NC(=O)CN1C(=O)OC2=C1C=CC=C2 MCULE-9179622725 [0,0,0,1,1,0|2,0,0]=4 549 B15R2.993 NC(=O)N[C@H]1C2=C(C=CC=C2)C[C@H]1O MCULE-4159958515 [0,0,0,1,1,0|1,0,1]=4 550 B15R2.9435 O=C1CC(C1)(C(=O)O)C2=CC=CC=C2 MCULE-9489666009 [0,0,0,1,1,0|2,0,0]=4 551 B17R2.3221 O=C1NC(=CC(N1)C2=CC=CC=C2)C(=O)O MCULE-5873583864 [0,0,0,1,0,1|0,0,1]=3 552 B17R2.374606 O=C(O)CC1(CCC2=CC=CC=C12)C(=O)O MCULE-3665246444 [0,0,0,1,0,1|2,0,0]=4 553 B17R2.3479 CC(=O)C1=CNC(=O)NC1C2=CC=CC=C2 MCULE-4680317955 [0,0,0,1,0,1|1,0,1]=4 554 B17R2.3479 O=C1COC(C(N1)C2=CC=CC=C2)C(=O)O MCULE-8555867778 [0,0,0,1,0,1|1,0,0]=3 555 B17R2.3479 O=C1CO[C@@H]([C@H](N1)C2=CC=CC=C2)C(=O)O MCULE-3410252720 [0,0,0,1,0,1|1,0,0]=3 556 B17R2.3479 O=C1CO[C@@H]([C@H](N1)C2=CN=CC=C2)C(=O)O MCULE-7081833329 [0,0,0,1,0,1|2,0,0]=4 557 B17R2.3479 O=C1CO[C@H]([C@@H](N1)C2=CC=CC=C2)C(=O)O MCULE-2551775731 [0,0,0,1,0,1|1,0,0]=3 558 B17R2.45129 CC(=O)N1CC(OC2=C1C=CC=C2)C(=O)O MCULE-5238319687 [0,0,0,1,0,1|2,0,0]=4 559 B17R2.44581 CC(=O)N1C2=C(C=CC=C2)CC1S(=O)(=O)O MCULE-8526654303 [0,1,0,1,0,0|2,0,0]=4 560 B17R2.226 COC(=O)C1CC(=O)OC1C2=CC=CC=C2 MCULE-6661594827 [0,1,0,1,0,0|2,0,0]=4 561 B17R2.19832 CC(=O)NC1C(=O)NNC1C2=CC=CC=C2 MCULE-8767072398 [0,1,0,1,0,0|2,0,0]=4 562 B17R2.23434 CN1CC(=O)N[C@@H](C1=O)CC2=CC=CC=C2 MCULE-5219417118 [0,1,0,1,0,0|2,0,0]=4 563 B17R2.23434 CN1CC(=O)N[C@H](C1=O)CC2=CC=CC=C2 MCULE-1884359829 [0,1,0,1,0,0|2,0,0]=4 564 B17R2.23434 CN1CC(=O)N[C@H](C1=O)CC2=CC=CC=C2 MCULE-3810834498 [0,1,0,1,0,0|2,0,0]=4 565 B17R2.58278 COC(=O)C1CC2=C(N1C(=O)C)C=CC=C2 MCULE-8619942971 [0,1,0,1,0,0|1,0,0]=3 566 B17R2.5352 CC1NC(=O)C(NC1=O)CC2=CC=CC=C2 MCULE-4521818975 [0,1,0,1,0,0|2,0,0]=4 567 B17R2.19368 CN1C(=O)CC(C1C2=CC=CC=C2)C(=O)O MCULE-9634939428 [0,1,0,1,0,0|1,0,0]=3 568 B17R2.19368 CN1C(=O)CC(C1C2=CN=CC=C2)C(=O)O MCULE-2985349854 [0,1,0,1,0,0|2,0,0]=4 569 B17R2.19368 CN1C(=O)C[C@H]([C@@H]1C2=CC=CN=C2)C(=O)O MCULE-6290550469 [0,1,0,1,0,0|2,0,0]=4 570 B17R2.19368 CN1C(=O)C[C@H]([C@@H]1C2=CC=CN=C2)C(=O)O MCULE-6938274912 [0,1,0,1,0,0|2,0,0]=4 571 B17R2.19368 [C@@H]1(CC(=O)N([C@@H]1C2=CN=CC=C2)C)C(=O)O MCULE-3895723368 [0,1,0,1,0,0|2,0,0]=4 572 B17R2.467 O=C1CNC(=O)C(N1)CC2=CC=C(C=C2)O MCULE-3428896162 [0,1,0,1,0,0|2,0,0]=4 573 B17R2.467 O=C1CNC(=O)[C@@H](N1)CC2=CC=C(C=C2)O MCULE-4294748073 [0,1,0,1,0,0|2,0,0]=4 574 B17R2.3280 CC1=CC=C(C=C1)C2=C(NC(=O)N2)C(=O)O MCULE-2031889745 [0,1,0,1,0,0|0,0,2]=4 575 B17R2.3280 O=C1CC(C(C1)C2=CC=C(C=C2)F)C(=O)O MCULE-3455444364 [0,1,0,1,0,0|2,0,0]=4 576 B17R2.3280 O=C1CC(C(N1)C(=O)O)C2=CC=C(C=C2)Cl MCULE-2342831978 [0,1,0,1,0,0|1,0,0]=3 577 B17R2.3280 O=C1CC(C(N1)C(=O)O)C2=CC=C(C=C2)F MCULE-6953781677 [0,1,0,1,0,0|1,0,0]=3 578 B17R2.3280 O=C1C[C@H]([C@@H](C1)C2=CC=C(C=C2)F)C(=O)O MCULE-4928987944 [0,1,0,1,0,0|2,0,0]=4 579 B17R2.3280 O=C1C[C@H]([C@@H](C1)C2=CC=C(C=C2)F)C(=O)O MCULE-7346219294 [0,1,0,1,0,0|2,0,0]=4 580 B17R2.3280 O=C1C[C@H]([C@@H](C1)C2=CC=C(C=C2)F)C(=O)O MCULE-9405620612 [0,1,0,1,0,0|2,0,0]=4 581 B17R2.3375 O=C1CC(C(N1)C(=O)O)C2=CC(=CC=C2)F MCULE-4597378612 [0,1,0,1,0,0|1,0,0]=3 582 B17R2.3375 O=C1CC(C(N1)C(=O)O)C2=CC=CC(=C2)Cl MCULE-8652681150 [0,1,0,1,0,0|1,0,0]=3 583 B17R2.3375 O=C1NC(=C(N1)C2=CC(=CC=C2)Cl)C(=O)O MCULE-7566276611 [0,1,0,1,0,0|0,0,2]=4 584 B17R2.3375 O=C1NC(=C(N1)C2=CC(=CC=C2)F)C(=O)O MCULE-6453023449 [0,1,0,1,0,0|0,0,2]=4 585 B17R2.253378 CC(=O)NC1CC2=CC=CC(=C2NC1=O)N MCULE-1586926080 [0,1,0,1,0,0|2,0,0]=4 586 B17R2.3947 CC1=C(C=CC=C1)[C@@H]2CC(=O)C[C@H]2C(=O)O MCULE-8264466161 [0,1,0,1,0,0|2,0,0]=4 587 B17R2.45126 CC(=O)N1CC2=CC=CC=C2CC1C(=O)O MCULE-2656577984 [0,1,0,1,0,0|1,0,0]=3 588 B17R2.60770 O=C(O)CC1(CC2=C(C1)C=CC=C2)C(=O)O MCULE-6465045151 [0,1,0,1,0,0|2,0,0]=4 589 B17R2.19465 CN1C(=O)CC(C1C(=O)O)C2=CC=CC=C2 MCULE-6556527158 [0,1,0,1,0,0|1,0,0]=3 590 B17R2.19465 CN1C(=O)CC([C@H]1C(=O)O)C2=CC=CC=C2 MCULE-3777751294 [0,1,0,1,0,0|1,0,0]=3 591 B13R1.713 CC(=O)NC(CO)C1=CC=CC=C1 MCULE-5408454034 [1,0,0,0,1,0|1,0,1]=4 592 B13R1.713 CC(=O)N[C@@H](CO)C1=CC=CC=C1 MCULE-3906807957 [1,0,0,0,1,0|1,0,1]=4 593 B13R1.713 CC(=O)N[C@@H](CO)C1=CC=CC=C1 MCULE-9415047708 [1,0,0,0,1,0|1,0,1]=4 594 B13R1.713 N#CC(NC(=O)N)C1=CC=CC=C1 MCULE-5488835904 [1,0,0,0,1,0|1,0,1]=4 595 B13R1.405 C=CCC(C(=O)O)C1=CC=CC=C1 MCULE-5764532423 [1,0,0,0,1,0|2,0,0]=4 596 B13R1.405 CCNC(C(=O)O)C1=CC=CC=C1 MCULE-4841598548 [1,0,0,0,1,0|1,0,1]=4 597 B13R1.405 CCNC(C(=O)O)C1=CC=CC=C1 MCULE-7820566343 [1,0,0,0,1,0|1,0,1]=4 598 B13R1.405 NCCC(C(=O)O)C1=CC=CC=C1 MCULE-2637834583 [1,0,0,0,1,0|1,0,1]=4 599 B13R1.405 NCCC(C(=O)O)C1=CC=CC=C1 MCULE-6673863203 [1,0,0,0,1,0|1,0,1]=4 600 B13R1.405 O=CN[C@@H](C(=O)O)C1=CC=CC=C1 MCULE-4354784784 [1,0,0,0,1,0|0,0,0]=2 601 B13R1.405 O=CN[C@@H](C(=O)O)C1=CC=CC=C1 MCULE-7287925237 [1,0,0,0,1,0|0,0,0]=2 602 B13R1.405 O=COC(C(=O)Cl)C1=CC=CC=C1 MCULE-9691244380 [1,0,0,0,1,0|2,0,0]=4 603 B13R1.405 O=CO[C@@H](C(=O)Cl)C1=CC=CC=C1 MCULE-2574519995 [1,0,0,0,1,0|2,0,0]=4 604 B13R1.405 [C@H](OC=O)(C(=O)Cl)C1=CC=CC=C1 MCULE-6121454180 [1,0,0,0,1,0|2,0,0]=4 605 B13R1.695 O=CNC(CC1=CNC=N1)C(=O)O MCULE-4799476247 [1,0,0,0,1,0|2,0,0]=4 606 B13R1.695 O=CN[C@@H](CC1=CNC=N1)C(=O)O MCULE-2584720723 [1,0,0,0,1,0|2,0,0]=4 607 B13R1.695 O=CN[C@@H](CC1=CNC=N1)C(=O)O MCULE-9092036879 [1,0,0,0,1,0|2,0,0]=4 608 B13R1.1113 CC(=O)NC(C(=O)O)C1=CC=CS1 MCULE-7821333448 [0,0,0,0,2,0|2,0,0]=4 609 B13R1.3571 O=C(O)C(CC1=CSC=C1)C(=O)O MCULE-7613010015 [0,0,0,0,2,0|2,0,0]=4 610 B13R1.1111 CC(=O)C(C(=O)C)C1=CC=CC=C1 MCULE-9854228693 [0,0,0,0,2,0|2,0,0]=4 611 B13R1.1111 CC(=O)C(C(=O)O)C1=CC=CC=C1 MCULE-2556931273 [0,0,0,0,2,0|1,0,0]=3 612 B13R1.1111 NC(=O)C(C(=O)N)C1=CC=CC=C1 MCULE-3370987080 [0,0,0,0,2,0|1,0,0]=3 613 B13R1.1111 O=C(O)C(C(=O)O)C1=CC=CC=C1 MCULE-3483592840 [0,0,0,0,2,0|1,0,0]=3 614 B13R1.1111 O=C(O)C(C1=CC=CC=C1)N(=O)=O MCULE-1263930412 [0,0,0,0,2,0|2,0,0]=4 615 B15R1.3984 C=CCC(CCC1=CC=CC=C1)C(=O)O MCULE-6045850509 [1,0,0,0,0,1|2,0,0]=4 616 B15R1.3569 CC(=O)C(SCC1=CC=CC=C1)C(=O)C MCULE-1872317101 [0,0,0,0,1,1|2,0,0]=4 617 B15R1.3569 O=C(O)C(CCC1=CC=CC=C1)C(=O)O MCULE-5275763163 [0,0,0,0,1,1|1,0,0]=3 618 B15R1.3569 O=C(O)C(CCC1=CC=CC=N1)C(=O)O MCULE-9952147281 [0,0,0,0,1,1|2,0,0]=4 619 B15R1.9083 CC(=O)CC(CC(=O)O)C1=CC=CC=C1 MCULE-2508977319 [0,0,0,0,1,1|2,0,0]=4 620 B15R1.9083 CC(=O)NC(=CC(=O)O)C1=CC=CC=C1 MCULE-9079753851 [0,0,0,0,1,1|1,0,1]=4 621 B15R1.9083 CC(=O)NC(CC(=O)O)C1=CC=CC=C1 MCULE-1544186638 [0,0,0,0,1,1|1,0,0]=3 622 B15R1.9083 CC(=O)NC(NC(=O)C)C1=CC=CC=C1 MCULE-3565632962 [0,0,0,0,1,1|2,0,0]=4 623 B15R1.9083 CC(=O)N[C@@H](CC(=O)O)C1=CC=CC=C1 MCULE-5293632993 [0,0,0,0,1,1|1,0,0]=3 624 B15R1.9083 CC(=O)SC(CC(=O)O)C1=CC=CC=C1 MCULE-4316146760 [0,0,0,0,1,1|2,0,0]=4 625 B15R1.9083 NC(=O)NC(CC(=O)O)C1=CC=CC=C1 MCULE-5507358217 [0,0,0,0,1,1|0,0,0]=2 626 B15R1.9083 O=C(O)CC(CC(=O)O)C1=CC=CC=C1 MCULE-3094062101 [0,0,0,0,1,1|2,0,0]=4 627 B15R1.12293 CC(=O)C(CCC(=O)N)C1=CC=CC=C1 MCULE-1479666811 [0,0,0,0,1,1|2,0,0]=4 628 B15R1.12293 CC(=O)N/N=C(/C(=O)O)\C1=CC=CC=C1 MCULE-8962049933 [0,0,0,0,1,1|1,0,1]=4 629 B15R1.12293 CC(=O)NN=C(C(=O)O)C1=CC=CC=C1 MCULE-1032405808 [0,0,0,0,1,1|1,0,1]=4 630 B15R1.12293 CC(=O)OCC(C(=O)O)C1=CC=CC=C1 MCULE-7325465917 [0,0,0,0,1,1|2,0,0]=4 631 B15R1.12293 NC(=S)NN=C(C(=O)O)C1=CC=CC=C1 MCULE-2733229262 [0,0,0,0,1,1|0,1,1]=4 632 B17R1.16148 O=C(O)CC(CCC1=CC=CC=C1)CC(=O)O MCULE-5663706772 [0,0,0,0,0,2|2,0,0]=4 633 B17R1.16148 O=C(O)CC(COC1=CC=CC=C1)CC(=O)O MCULE-2179126482 [0,0,0,0,0,2|2,0,0]=4 634 B17R1.16250 NC(=O)N[C@@H](COC(=O)N)CC1=CC=CC=C1 MCULE-3064034103 [0,0,0,0,0,2|1,0,0]=3 635 B17R1.26150 O=C(O)CCC(NCC1=CC=CC=C1)C(=O)O MCULE-7855206153 [0,0,0,0,0,2|2,0,0]=4 636 B17R1.26150 O=C(O)CC[C@@H](NCC1=CC=CC=C1)C(=O)O MCULE-3304550464 [0,0,0,0,0,2|2,0,0]=4 637 B17R1.26150 O=C(O)CC[C@@H](NCC1=CC=CC=C1)C(=O)O MCULE-5844714494 [0,0,0,0,0,2|2,0,0]=4 638 B17R1.26150 O=C(O)CC[C@H](NCC1=CC=CC=C1)C(=O)O MCULE-1073491311 [0,0,0,0,0,2|2,0,0]=4 639 B17R1.26150 O=C(O)CC[C@H](NCC1=CC=CC=C1)C(=O)O MCULE-3740745649 [0,0,0,0,0,2|2,0,0]=4 640 B17R1.149904 CC(=O)NC(COCC1=CC=CC=C1)C(=O)O MCULE-2316821869 [0,0,0,0,0,2|1,0,0]=3 641 B17R1.149904 CC(=O)NC(CSCC1=CC=CC=C1)C(=O)O MCULE-6185310035 [0,0,0,0,0,2|1,0,0]=3 642 B17R1.149904 CC(=O)N[C@@H](COCC1=CC=CC=C1)C(=O)O MCULE-2756475873 [0,0,0,0,0,2|1,0,0]=3 643 B17R1.149904 CC(=O)N[C@@H](COCC1=CC=CC=C1)C(=O)O MCULE-2946337779 [0,0,0,0,0,2|1,0,0]=3 644 B17R1.149904 CC(=O)N[C@@H](CSCC1=CC=CC=C1)C(=O)O MCULE-5075248193 [0,0,0,0,0,2|1,0,0]=3 645 B17R1.149904 CC(=O)N[C@@H](CSCC1=CC=CC=C1)C(=O)O MCULE-7069608761 [0,0,0,0,0,2|1,0,0]=3 646 B17R1.149904 CC(=O)N[C@H](CSCC1=CC=CC=C1)C(=O)O MCULE-2741425255 [0,0,0,0,0,2|1,0,0]=3 647 B17R1.149904 CC(=O)N[C@H](CSCC1=CC=CC=C1)C(=O)O MCULE-9020473849 [0,0,0,0,0,2|1,0,0]=3