0 B9R1.35 C1(CCC(=O)C1)C(=O)O MCULE-7485965564 [0,0,0,0,0,0|1,0,2]=3 1 B9R1.35 C1(CCC(=O)O1)C(=O)O MCULE-6663255579 [0,0,0,0,0,0|2,0,2]=4 2 B9R1.35 C1(CCN(C1)C(=O)C)O MCULE-2995435877 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.35 C1(CCN(C1)C)C(=O)O MCULE-6561840637 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.35 C1(CCN(C1)C)C(=O)O MCULE-7766846765 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.35 C=C1CCC(C1)C(=O)O MCULE-7982355069 [0,0,0,0,0,0|2,0,1]=3 6 B9R1.35 CC(=O)C1CCN(C1)C MCULE-4293303594 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.35 CC(=O)N1CCC(C1)Br MCULE-8355936501 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.35 CC(=O)N1CCC(C1)Cl MCULE-6832350132 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.35 CC(=O)N1CCC(C1)I MCULE-8317311112 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.35 CC(=O)N1CCC(C1)N MCULE-4859899694 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.35 CC(=O)N1CCC(C1)N MCULE-5207016672 [0,0,0,0,0,0|4,0,0]=4 12 B9R1.35 CC(=O)N1CCC(C1)O MCULE-4508537142 [0,0,0,0,0,0|3,0,0]=3 13 B9R1.35 CC(=O)N1CC[C@@H](C1)Br MCULE-1322966275 [0,0,0,0,0,0|4,0,0]=4 14 B9R1.35 CC(=O)N1CC[C@@H](C1)Cl MCULE-2029967624 [0,0,0,0,0,0|4,0,0]=4 15 B9R1.35 CC(=O)N1CC[C@@H](C1)I MCULE-7320383470 [0,0,0,0,0,0|4,0,0]=4 16 B9R1.35 CC(=O)N1CC[C@@H](C1)N MCULE-2398948421 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.35 CC(=O)N1CC[C@@H](C1)N MCULE-5902852942 [0,0,0,0,0,0|4,0,0]=4 18 B9R1.35 CC(=O)N1CC[C@@H](C1)N MCULE-7792031754 [0,0,0,0,0,0|4,0,0]=4 19 B9R1.35 CC(=O)N1CC[C@@H](C1)N MCULE-9501815600 [0,0,0,0,0,0|4,0,0]=4 20 B9R1.35 CC(=O)N1CC[C@@H](C1)O MCULE-4145127323 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.35 CC(=O)N1CC[C@@H](C1)O MCULE-8205833952 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.35 CC(=O)N1CC[C@H](C1)Br MCULE-4315476515 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.35 CC(=O)N1CC[C@H](C1)Cl MCULE-4172580306 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.35 CC(=O)N1CC[C@H](C1)I MCULE-1825691667 [0,0,0,0,0,0|4,0,0]=4 25 B9R1.35 CC(=O)N1CC[C@H](C1)N MCULE-2775875761 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.35 CC(=O)N1CC[C@H](C1)N MCULE-3800389790 [0,0,0,0,0,0|4,0,0]=4 27 B9R1.35 CC(=O)N1CC[C@H](C1)N MCULE-5934390450 [0,0,0,0,0,0|4,0,0]=4 28 B9R1.35 CC(=O)N1CC[C@H](C1)N MCULE-6629805054 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.35 CC(=O)N1CC[C@H](C1)O MCULE-1031340554 [0,0,0,0,0,0|3,0,0]=3 30 B9R1.35 CC(=O)N1CC[C@H](C1)O MCULE-1348897751 [0,0,0,0,0,0|3,0,0]=3 31 B9R1.35 CC1=CC(SC1)C(=O)O MCULE-1599288333 [0,0,0,0,0,0|2,0,2]=4 32 B9R1.35 CC1=NC(CC1)C(=O)O MCULE-1278773172 [0,0,0,0,0,0|3,0,1]=4 33 B9R1.35 CC1=NC(CC1)C(=O)O MCULE-5768248357 [0,0,0,0,0,0|3,0,1]=4 34 B9R1.35 CC1=NOC(C1)C(=O)O MCULE-4730152545 [0,0,0,0,0,0|3,0,1]=4 35 B9R1.35 CC1=NO[C@@H](C1)C(=O)O MCULE-4081165004 [0,0,0,0,0,0|3,0,1]=4 36 B9R1.35 CC1CC(=NO1)C(=O)O MCULE-8733803647 [0,0,0,0,0,0|2,0,2]=4 37 B9R1.35 CC1CC(CO1)C(=O)O MCULE-6422706201 [0,0,0,0,0,0|3,0,0]=3 38 B9R1.35 CC1CCC(C1)C(=O)O MCULE-5009837194 [0,0,0,0,0,0|2,0,0]=2 39 B9R1.35 CC1CCC(N1)C(=O)O MCULE-7716142893 [0,0,0,0,0,0|3,0,0]=3 40 B9R1.35 CC1CCC(N1)C(=O)O MCULE-7805688291 [0,0,0,0,0,0|3,0,0]=3 41 B9R1.35 CC1CCC(O1)C(=O)O MCULE-7354058760 [0,0,0,0,0,0|3,0,0]=3 42 B9R1.35 CC1CCN(C1)C(=O)Cl MCULE-4918001156 [0,0,0,0,0,0|4,0,0]=4 43 B9R1.35 CC1CNC(C1)C(=O)O MCULE-5999128275 [0,0,0,0,0,0|1,0,0]=1 44 B9R1.35 CC1CNC(C1)C(=O)O MCULE-9035040660 [0,0,0,0,0,0|1,0,0]=1 45 B9R1.35 CC1COC(C1)C(=O)O MCULE-4317519603 [0,0,0,0,0,0|2,0,0]=2 46 B9R1.35 CC1NC(CS1)C(=O)O MCULE-3100233154 [0,0,0,0,0,0|4,0,0]=4 47 B9R1.35 CC1N[C@H](CS1)C(=O)O MCULE-6392464999 [0,0,0,0,0,0|4,0,0]=4 48 B9R1.35 CN1C=NC(C1)C(=O)O MCULE-4940976118 [0,0,0,0,0,0|2,0,2]=4 49 B9R1.35 CN1C=NC(C1)C(=O)O MCULE-8264815969 [0,0,0,0,0,0|2,0,2]=4 50 B9R1.35 CN1CCC(C1)C(=O)O MCULE-5724245212 [0,0,0,0,0,0|3,0,0]=3 51 B9R1.35 CN1CCC(C1)C(=O)O MCULE-6263233064 [0,0,0,0,0,0|3,0,0]=3 52 B9R1.35 CN1CC[C@@H](C1)C(=O)O MCULE-1382244459 [0,0,0,0,0,0|3,0,0]=3 53 B9R1.35 CN1CC[C@@H](C1)C(=O)O MCULE-1492032594 [0,0,0,0,0,0|3,0,0]=3 54 B9R1.35 CN1CC[C@H](C1)C(=O)O MCULE-1080921095 [0,0,0,0,0,0|3,0,0]=3 55 B9R1.35 CN1CC[C@H](C1)C(=O)O MCULE-5145674459 [0,0,0,0,0,0|3,0,0]=3 56 B9R1.35 CN1CC[C@H](C1)C(=O)O MCULE-5820812779 [0,0,0,0,0,0|3,0,0]=3 57 B9R1.35 CN1CC[C@H](C1)C(=O)O MCULE-7587726735 [0,0,0,0,0,0|3,0,0]=3 58 B9R1.35 CS(=O)C1CCC(C1)N MCULE-2472662986 [0,0,0,0,0,0|4,0,0]=4 59 B9R1.35 C[C@@H]1CC[C@@H](N1)C(=O)O MCULE-1712610304 [0,0,0,0,0,0|3,0,0]=3 60 B9R1.35 C[C@@H]1CC[C@@H](N1)C(=O)O MCULE-3564743814 [0,0,0,0,0,0|3,0,0]=3 61 B9R1.35 C[C@@H]1CC[C@@H](O1)C(=O)O MCULE-2451266259 [0,0,0,0,0,0|3,0,0]=3 62 B9R1.35 C[C@@H]1CC[C@@H](O1)C(=O)O MCULE-9559412763 [0,0,0,0,0,0|3,0,0]=3 63 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-1486502980 [0,0,0,0,0,0|3,0,0]=3 64 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-2728269167 [0,0,0,0,0,0|3,0,0]=3 65 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-4518040079 [0,0,0,0,0,0|3,0,0]=3 66 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-5687588737 [0,0,0,0,0,0|3,0,0]=3 67 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-5969663507 [0,0,0,0,0,0|3,0,0]=3 68 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-7325534692 [0,0,0,0,0,0|3,0,0]=3 69 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-1541572989 [0,0,0,0,0,0|1,0,0]=1 70 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-1821254522 [0,0,0,0,0,0|1,0,0]=1 71 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-7426280517 [0,0,0,0,0,0|1,0,0]=1 72 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-8599307960 [0,0,0,0,0,0|1,0,0]=1 73 B9R1.35 C[C@H]1CC[C@@H](N1)C(=O)O MCULE-3116688346 [0,0,0,0,0,0|3,0,0]=3 74 B9R1.35 C[C@H]1CC[C@@H](N1)C(=O)O MCULE-3630959366 [0,0,0,0,0,0|3,0,0]=3 75 B9R1.35 C[C@H]1CC[C@@H](N1)C(=O)O MCULE-9043504063 [0,0,0,0,0,0|3,0,0]=3 76 B9R1.35 C[C@H]1CC[C@@H](N1)C(=O)O MCULE-9322368857 [0,0,0,0,0,0|3,0,0]=3 77 B9R1.35 C[C@H]1CN[C@@H](C1)C(=O)O MCULE-2036600768 [0,0,0,0,0,0|1,0,0]=1 78 B9R1.35 C[C@H]1CN[C@@H](C1)C(=O)O MCULE-4646350445 [0,0,0,0,0,0|1,0,0]=1 79 B9R1.35 C[C@H]1CN[C@H](C1)C(=O)O MCULE-2974063836 [0,0,0,0,0,0|1,0,0]=1 80 B9R1.35 C[C@H]1CN[C@H](C1)C(=O)O MCULE-7564386283 [0,0,0,0,0,0|1,0,0]=1 81 B9R1.35 N=C(N)N1CCC(C1)O MCULE-4691653250 [0,0,0,0,0,0|4,0,0]=4 82 B9R1.35 N=C(N)N1CCC(C1)O MCULE-6578584286 [0,0,0,0,0,0|4,0,0]=4 83 B9R1.35 NC(=O)C1CC(CN1)F MCULE-8271084148 [0,0,0,0,0,0|2,0,0]=2 84 B9R1.35 NC(=O)C1CC(CN1)F MCULE-9864087367 [0,0,0,0,0,0|2,0,0]=2 85 B9R1.35 NC(=O)C1CC(CN1)O MCULE-8628888959 [0,0,0,0,0,0|1,0,0]=1 86 B9R1.35 NC(=O)C1CC(CN1)O MCULE-9327040437 [0,0,0,0,0,0|1,0,0]=1 87 B9R1.35 NC(=O)N1CCC(C1)N MCULE-1767398338 [0,0,0,0,0,0|4,0,0]=4 88 B9R1.35 NC(=O)N1CCC(C1)N MCULE-2883297977 [0,0,0,0,0,0|4,0,0]=4 89 B9R1.35 NC(=O)[C@@H]1CC[C@@H](C1)N MCULE-7570889128 [0,0,0,0,0,0|3,0,0]=3 90 B9R1.35 NC(=O)[C@@H]1CC[C@@H](C1)N MCULE-8629602486 [0,0,0,0,0,0|3,0,0]=3 91 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)F MCULE-1115995515 [0,0,0,0,0,0|2,0,0]=2 92 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)F MCULE-3958905536 [0,0,0,0,0,0|2,0,0]=2 93 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)F MCULE-5421731805 [0,0,0,0,0,0|2,0,0]=2 94 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)F MCULE-9864372515 [0,0,0,0,0,0|2,0,0]=2 95 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)O MCULE-1506534259 [0,0,0,0,0,0|1,0,0]=1 96 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)O MCULE-4335155413 [0,0,0,0,0,0|1,0,0]=1 97 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)F MCULE-2111867079 [0,0,0,0,0,0|2,0,0]=2 98 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)F MCULE-2486268743 [0,0,0,0,0,0|2,0,0]=2 99 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)F MCULE-8625619596 [0,0,0,0,0,0|2,0,0]=2 100 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-1442980635 [0,0,0,0,0,0|1,0,0]=1 101 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-4854132547 [0,0,0,0,0,0|1,0,0]=1 102 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-8175631848 [0,0,0,0,0,0|1,0,0]=1 103 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-9092665787 [0,0,0,0,0,0|1,0,0]=1 104 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-1212665796 [0,0,0,0,0,0|1,0,0]=1 105 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-2172080185 [0,0,0,0,0,0|1,0,0]=1 106 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-2463066874 [0,0,0,0,0,0|1,0,0]=1 107 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-7245012102 [0,0,0,0,0,0|1,0,0]=1 108 B9R1.35 NC1=NNC(N1)C(=O)O MCULE-8622860614 [0,0,0,0,0,0|3,0,1]=4 109 B9R1.35 NC1C=CC(C1)C(=O)O MCULE-7513224290 [0,0,0,0,0,0|2,0,1]=3 110 B9R1.35 NC1C=CC(C1)C(=O)O MCULE-8369262706 [0,0,0,0,0,0|2,0,1]=3 111 B9R1.35 NC1CC=C(C1)C(=O)O MCULE-7944190057 [0,0,0,0,0,0|2,0,1]=3 112 B9R1.35 NC1CC=C(C1)C(=O)O MCULE-9202589777 [0,0,0,0,0,0|2,0,1]=3 113 B9R1.35 NC1CCC(C1)C(=O)O MCULE-1740452568 [0,0,0,0,0,0|2,0,0]=2 114 B9R1.35 NC1CCC(C1)C(=O)O MCULE-4067702279 [0,0,0,0,0,0|2,0,0]=2 115 B9R1.35 NC1CNC(C1)C(=O)O MCULE-1416144501 [0,0,0,0,0,0|1,0,0]=1 116 B9R1.35 NC1CNC(C1)C(=O)O MCULE-4706388278 [0,0,0,0,0,0|1,0,0]=1 117 B9R1.35 N[C@@H]1C=C[C@@H](C1)C(=O)O MCULE-2058033578 [0,0,0,0,0,0|2,0,1]=3 118 B9R1.35 N[C@@H]1C=C[C@@H](C1)C(=O)O MCULE-3535904120 [0,0,0,0,0,0|2,0,1]=3 119 B9R1.35 N[C@@H]1C=C[C@@H](C1)C(=O)O MCULE-7864688668 [0,0,0,0,0,0|2,0,1]=3 120 B9R1.35 N[C@@H]1C=C[C@@H](C1)C(=O)O MCULE-9488093105 [0,0,0,0,0,0|2,0,1]=3 121 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O MCULE-1729778339 [0,0,0,0,0,0|2,0,0]=2 122 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O MCULE-2964730214 [0,0,0,0,0,0|2,0,0]=2 123 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O MCULE-6758665117 [0,0,0,0,0,0|2,0,0]=2 124 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O MCULE-8002401712 [0,0,0,0,0,0|2,0,0]=2 125 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O MCULE-1941635524 [0,0,0,0,0,0|2,0,0]=2 126 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O MCULE-3306995596 [0,0,0,0,0,0|2,0,0]=2 127 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O MCULE-5728201062 [0,0,0,0,0,0|2,0,0]=2 128 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O MCULE-8515718052 [0,0,0,0,0,0|2,0,0]=2 129 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-4990800122 [0,0,0,0,0,0|1,0,0]=1 130 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-5172267597 [0,0,0,0,0,0|1,0,0]=1 131 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-7010431429 [0,0,0,0,0,0|1,0,0]=1 132 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-8754522437 [0,0,0,0,0,0|1,0,0]=1 133 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-4906071490 [0,0,0,0,0,0|1,0,0]=1 134 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-7656739611 [0,0,0,0,0,0|1,0,0]=1 135 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-8732136397 [0,0,0,0,0,0|1,0,0]=1 136 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-9871023526 [0,0,0,0,0,0|1,0,0]=1 137 B9R1.35 N[C@H]1C=C[C@@H](C1)C(=O)O MCULE-1866924065 [0,0,0,0,0,0|2,0,1]=3 138 B9R1.35 N[C@H]1C=C[C@@H](C1)C(=O)O MCULE-5420586850 [0,0,0,0,0,0|2,0,1]=3 139 B9R1.35 N[C@H]1C=C[C@@H](C1)C(=O)O MCULE-6933168017 [0,0,0,0,0,0|2,0,1]=3 140 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-1923367161 [0,0,0,0,0,0|2,0,1]=3 141 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-2558762790 [0,0,0,0,0,0|2,0,1]=3 142 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-2767032719 [0,0,0,0,0,0|2,0,1]=3 143 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-3230012761 [0,0,0,0,0,0|2,0,1]=3 144 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-5898455500 [0,0,0,0,0,0|2,0,1]=3 145 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-8841082803 [0,0,0,0,0,0|2,0,1]=3 146 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O MCULE-3382663689 [0,0,0,0,0,0|2,0,0]=2 147 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O MCULE-7889100863 [0,0,0,0,0,0|2,0,0]=2 148 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O MCULE-9213747671 [0,0,0,0,0,0|2,0,0]=2 149 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O MCULE-9781594017 [0,0,0,0,0,0|2,0,0]=2 150 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-1569946940 [0,0,0,0,0,0|2,0,0]=2 151 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-1675680486 [0,0,0,0,0,0|2,0,0]=2 152 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-1903292573 [0,0,0,0,0,0|2,0,0]=2 153 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-6695566760 [0,0,0,0,0,0|2,0,0]=2 154 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-6999679319 [0,0,0,0,0,0|2,0,0]=2 155 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-8009804408 [0,0,0,0,0,0|2,0,0]=2 156 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-1698400731 [0,0,0,0,0,0|1,0,0]=1 157 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-1983861108 [0,0,0,0,0,0|1,0,0]=1 158 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-2838978471 [0,0,0,0,0,0|1,0,0]=1 159 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-5103662767 [0,0,0,0,0,0|1,0,0]=1 160 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-5299594489 [0,0,0,0,0,0|1,0,0]=1 161 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-6235136925 [0,0,0,0,0,0|1,0,0]=1 162 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-8629641721 [0,0,0,0,0,0|1,0,0]=1 163 B9R1.35 N[C@H]1CN[C@H](C1)C(=O)O MCULE-2973551231 [0,0,0,0,0,0|1,0,0]=1 164 B9R1.35 N[C@H]1CN[C@H](C1)C(=O)O MCULE-3190600485 [0,0,0,0,0,0|1,0,0]=1 165 B9R1.35 O=C(O)C1=CC(CC1)O MCULE-6046983646 [0,0,0,0,0,0|1,0,2]=3 166 B9R1.35 O=C(O)C1CC(=NO1)Br MCULE-8217813426 [0,0,0,0,0,0|3,0,1]=4 167 B9R1.35 O=C(O)C1CC(CN1)Br MCULE-3420644560 [0,0,0,0,0,0|1,0,0]=1 168 B9R1.35 O=C(O)C1CC(CN1)F MCULE-1909829604 [0,0,0,0,0,0|1,0,0]=1 169 B9R1.35 O=C(O)C1CC(CN1)F MCULE-4908563055 [0,0,0,0,0,0|1,0,0]=1 170 B9R1.35 O=C(O)C1CC(CN1)O MCULE-3129945874 [0,0,0,0,0,0|0,0,0]=0 171 B9R1.35 O=C(O)C1CC(CN1)O MCULE-5090896550 [0,0,0,0,0,0|0,0,0]=0 172 B9R1.35 O=C(O)C1CC(CN1)S MCULE-3928449068 [0,0,0,0,0,0|0,1,0]=1 173 B9R1.35 O=C(O)C1CC(CN1)S MCULE-7523385510 [0,0,0,0,0,0|0,1,0]=1 174 B9R1.35 O=C(O)C1CCC(C1)Br MCULE-3893521468 [0,0,0,0,0,0|2,0,0]=2 175 B9R1.35 O=C(O)C1CCC(C1)F MCULE-5981771251 [0,0,0,0,0,0|2,0,0]=2 176 B9R1.35 O=C(O)C1CCC(C1)O MCULE-3301759971 [0,0,0,0,0,0|1,0,0]=1 177 B9R1.35 O=C(O)C1OC(CS1)O MCULE-2827262093 [0,0,0,0,0,0|2,0,0]=2 178 B9R1.35 O=C(O)[C@@H]1CC(CN1)O MCULE-9602889253 [0,0,0,0,0,0|0,0,0]=0 179 B9R1.35 O=C(O)[C@@H]1CC(CN1)S MCULE-6078892837 [0,0,0,0,0,0|0,1,0]=1 180 B9R1.35 O=C(O)[C@@H]1CC(CN1)S MCULE-6607761456 [0,0,0,0,0,0|0,1,0]=1 181 B9R1.35 O=C(O)[C@@H]1CC[C@@H](C1)O MCULE-2017780821 [0,0,0,0,0,0|1,0,0]=1 182 B9R1.35 O=C(O)[C@@H]1CC[C@@H](C1)O MCULE-8789755356 [0,0,0,0,0,0|1,0,0]=1 183 B9R1.35 O=C(O)[C@@H]1CC[C@H](C1)O MCULE-6133795580 [0,0,0,0,0,0|1,0,0]=1 184 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)Br MCULE-2600938020 [0,0,0,0,0,0|1,0,0]=1 185 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)Br MCULE-3945615781 [0,0,0,0,0,0|1,0,0]=1 186 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-2626475344 [0,0,0,0,0,0|1,0,0]=1 187 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-4367319835 [0,0,0,0,0,0|1,0,0]=1 188 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-9011373659 [0,0,0,0,0,0|1,0,0]=1 189 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-9484602400 [0,0,0,0,0,0|1,0,0]=1 190 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-2778155463 [0,0,0,0,0,0|0,0,0]=0 191 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-3005368457 [0,0,0,0,0,0|0,0,0]=0 192 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-3510440810 [0,0,0,0,0,0|0,0,0]=0 193 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-6982589556 [0,0,0,0,0,0|0,0,0]=0 194 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-8797295826 [0,0,0,0,0,0|0,0,0]=0 195 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-5195240463 [0,0,0,0,0,0|0,1,0]=1 196 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-6442187313 [0,0,0,0,0,0|0,1,0]=1 197 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-6472004515 [0,0,0,0,0,0|0,1,0]=1 198 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-8668690351 [0,0,0,0,0,0|0,1,0]=1 199 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-2784186920 [0,0,0,0,0,0|1,0,0]=1 200 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-5745425542 [0,0,0,0,0,0|1,0,0]=1 201 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-9253930917 [0,0,0,0,0,0|1,0,0]=1 202 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-9892414269 [0,0,0,0,0,0|1,0,0]=1 203 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-4157512603 [0,0,0,0,0,0|0,0,0]=0 204 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-5389747201 [0,0,0,0,0,0|0,0,0]=0 205 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-6465399562 [0,0,0,0,0,0|0,0,0]=0 206 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-7830616263 [0,0,0,0,0,0|0,0,0]=0 207 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-1140594774 [0,0,0,0,0,0|0,1,0]=1 208 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-2383846785 [0,0,0,0,0,0|0,1,0]=1 209 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-2747224270 [0,0,0,0,0,0|0,1,0]=1 210 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-5598470577 [0,0,0,0,0,0|0,1,0]=1 211 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-7268471922 [0,0,0,0,0,0|0,1,0]=1 212 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-9896850390 [0,0,0,0,0,0|0,1,0]=1 213 B9R1.35 O=C(O)[C@H]1CC[C@@H](C1)O MCULE-3061487094 [0,0,0,0,0,0|1,0,0]=1 214 B9R1.35 O=C(O)[C@H]1CC[C@@H](C1)O MCULE-8079944181 [0,0,0,0,0,0|1,0,0]=1 215 B9R1.35 O=C(O)[C@H]1CC[C@H](C1)O MCULE-2713143734 [0,0,0,0,0,0|1,0,0]=1 216 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)F MCULE-1499004749 [0,0,0,0,0,0|1,0,0]=1 217 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)F MCULE-4961028667 [0,0,0,0,0,0|1,0,0]=1 218 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)F MCULE-9323854334 [0,0,0,0,0,0|1,0,0]=1 219 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-1222229718 [0,0,0,0,0,0|0,0,0]=0 220 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-1998693022 [0,0,0,0,0,0|0,0,0]=0 221 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-3836053642 [0,0,0,0,0,0|0,0,0]=0 222 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-4545441904 [0,0,0,0,0,0|0,0,0]=0 223 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-8358409700 [0,0,0,0,0,0|0,0,0]=0 224 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-1326882154 [0,0,0,0,0,0|1,0,0]=1 225 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-4409765623 [0,0,0,0,0,0|1,0,0]=1 226 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-5169579313 [0,0,0,0,0,0|1,0,0]=1 227 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-8834390438 [0,0,0,0,0,0|1,0,0]=1 228 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-3080568728 [0,0,0,0,0,0|0,0,0]=0 229 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-4521316626 [0,0,0,0,0,0|0,0,0]=0 230 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-5972935636 [0,0,0,0,0,0|0,0,0]=0 231 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-7908625938 [0,0,0,0,0,0|0,0,0]=0 232 B9R1.35 O=C1CC(CN1)C(=O)O MCULE-2190630193 [0,0,0,0,0,0|2,0,2]=4 233 B9R1.35 O=C1CC(CO1)C(=O)O MCULE-4876585769 [0,0,0,0,0,0|2,0,2]=4 234 B9R1.35 O=C1CC(CS1)C(=O)O MCULE-5763665475 [0,0,0,0,0,0|2,0,2]=4 235 B9R1.35 O=C1CC(NN1)C(=O)O MCULE-3197471189 [0,0,0,0,0,0|1,0,2]=3 236 B9R1.35 O=C1CCC(C1)C(=O)O MCULE-8715651663 [0,0,0,0,0,0|1,0,2]=3 237 B9R1.35 O=C1CCC(N1)C(=O)O MCULE-4175874303 [0,0,0,0,0,0|2,0,2]=4 238 B9R1.35 O=C1CCC(N1)C(=O)O MCULE-9028773140 [0,0,0,0,0,0|2,0,2]=4 239 B9R1.35 O=C1CCC(O1)C(=O)O MCULE-1992756541 [0,0,0,0,0,0|2,0,2]=4 240 B9R1.35 O=C1CCC(S1)C(=O)O MCULE-8929436839 [0,0,0,0,0,0|2,0,2]=4 241 B9R1.35 O=C1CC[C@@H](C1)C(=O)O MCULE-1554776363 [0,0,0,0,0,0|1,0,2]=3 242 B9R1.35 O=C1CC[C@@H](C1)C(=O)O MCULE-4649943680 [0,0,0,0,0,0|1,0,2]=3 243 B9R1.35 O=C1CC[C@@H](N1)C(=O)O MCULE-5900221010 [0,0,0,0,0,0|2,0,2]=4 244 B9R1.35 O=C1CC[C@@H](N1)C(=O)O MCULE-8170238114 [0,0,0,0,0,0|2,0,2]=4 245 B9R1.35 O=C1CC[C@@H](O1)C(=O)O MCULE-1446049605 [0,0,0,0,0,0|2,0,2]=4 246 B9R1.35 O=C1CC[C@@H](O1)C(=O)O MCULE-6745317325 [0,0,0,0,0,0|2,0,2]=4 247 B9R1.35 O=C1CC[C@H](C1)C(=O)O MCULE-6597072682 [0,0,0,0,0,0|1,0,2]=3 248 B9R1.35 O=C1CC[C@H](C1)C(=O)O MCULE-7880064966 [0,0,0,0,0,0|1,0,2]=3 249 B9R1.35 O=C1CC[C@H](N1)C(=O)O MCULE-4204877494 [0,0,0,0,0,0|2,0,2]=4 250 B9R1.35 O=C1CC[C@H](N1)C(=O)O MCULE-4908547112 [0,0,0,0,0,0|2,0,2]=4 251 B9R1.35 O=C1CC[C@H](N1)C(=O)O MCULE-6422141688 [0,0,0,0,0,0|2,0,2]=4 252 B9R1.35 O=C1CC[C@H](O1)C(=O)O MCULE-5669975621 [0,0,0,0,0,0|2,0,2]=4 253 B9R1.35 O=C1CC[C@H](O1)C(=O)O MCULE-7113736527 [0,0,0,0,0,0|2,0,2]=4 254 B9R1.35 O=C1CC[C@H](S1)C(=O)O MCULE-4843749267 [0,0,0,0,0,0|2,0,2]=4 255 B9R1.35 O=C1CNC(C1)C(=O)O MCULE-7418065190 [0,0,0,0,0,0|0,0,2]=2 256 B9R1.35 O=C1CNC(C1)C(=O)O MCULE-7697956784 [0,0,0,0,0,0|0,0,2]=2 257 B9R1.35 O=C1CNC(C1)C(=O)O MCULE-9520720032 [0,0,0,0,0,0|0,0,2]=2 258 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-2573903934 [0,0,0,0,0,0|0,0,2]=2 259 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-3585746586 [0,0,0,0,0,0|0,0,2]=2 260 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-4771747932 [0,0,0,0,0,0|0,0,2]=2 261 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-4795592072 [0,0,0,0,0,0|0,0,2]=2 262 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-6928857625 [0,0,0,0,0,0|0,0,2]=2 263 B9R1.35 O=C1COC(C1)C(=O)O MCULE-4720798204 [0,0,0,0,0,0|1,0,2]=3 264 B9R1.35 O=C1CSC(C1)C(=O)O MCULE-3309649635 [0,0,0,0,0,0|1,0,2]=3 265 B9R1.35 O=C1C[C@@H](CN1)C(=O)O MCULE-5673992530 [0,0,0,0,0,0|2,0,2]=4 266 B9R1.35 O=C1C[C@@H](CN1)C(=O)O MCULE-8443757903 [0,0,0,0,0,0|2,0,2]=4 267 B9R1.35 O=C1C[C@H](CN1)C(=O)O MCULE-1024601569 [0,0,0,0,0,0|2,0,2]=4 268 B9R1.35 O=C1C[C@H](CN1)C(=O)O MCULE-4280238532 [0,0,0,0,0,0|2,0,2]=4 269 B9R1.35 [C@@H]1(CN[C@H](C1)C(=O)O)O MCULE-3075663401 [0,0,0,0,0,0|0,0,0]=0 270 B9R1.35 [C@H]1(CC[C@H](C1)C(=O)O)N MCULE-1734860042 [0,0,0,0,0,0|2,0,0]=2 271 B9R1.35 [C@H]1(CC[C@H](C1)C(=O)O)N MCULE-3698574567 [0,0,0,0,0,0|2,0,0]=2 272 B9R1.35 [C@H]1(CN[C@@H](C1)C(=O)N)F MCULE-2355223336 [0,0,0,0,0,0|2,0,0]=2 273 B9R1.35 [C@H]1(CN[C@@H](C1)C(=O)N)F MCULE-2483830451 [0,0,0,0,0,0|2,0,0]=2 274 B9R1.35 [C@H]1(CN[C@@H](C1)C(=O)O)F MCULE-1784559931 [0,0,0,0,0,0|1,0,0]=1 275 B9R1.35 [C@H]1(CN[C@@H](C1)C(=O)O)F MCULE-8392302309 [0,0,0,0,0,0|1,0,0]=1 276 B9R1.35 [C@H]1(CN[C@@H](C1)C(=O)O)S MCULE-7662717521 [0,0,0,0,0,0|0,1,0]=1 277 B9R1.35 [C@H]1(CN[C@H](C1)C(=O)O)F MCULE-2026019561 [0,0,0,0,0,0|1,0,0]=1 278 B9R1.35 [C@H]1(CN[C@H](C1)C(=O)O)F MCULE-8023038198 [0,0,0,0,0,0|1,0,0]=1 279 B9R1.35 [C@H]1(C[C@H](CN1)O)C(=O)O MCULE-3462627258 [0,0,0,0,0,0|0,0,0]=0 280 B8R1.1 C=C1CN[C@@H](C1)CO MCULE-2356105510 [1,0,0,0,0,0|1,0,2]=4 281 B8R1.1 C=C1CN[C@@H](C1)CO MCULE-8856338816 [1,0,0,0,0,0|1,0,2]=4 282 B8R1.1 CC1CCC(C1)C=O MCULE-9381232427 [1,0,0,0,0,0|2,0,0]=3 283 B8R1.1 CC1CCC(C1)CO MCULE-3130047677 [1,0,0,0,0,0|2,0,1]=4 284 B8R1.1 CC1CNC(C1)CF MCULE-6699916370 [1,0,0,0,0,0|2,0,1]=4 285 B8R1.1 CC1CNC(C1)CF MCULE-9019063440 [1,0,0,0,0,0|2,0,1]=4 286 B8R1.1 CC1CNC(C1)CO MCULE-2461186712 [1,0,0,0,0,0|1,0,1]=3 287 B8R1.1 CC1CNC(C1)CO MCULE-5209280647 [1,0,0,0,0,0|1,0,1]=3 288 B8R1.1 CC1COC(C1)CO MCULE-4511313299 [1,0,0,0,0,0|2,0,1]=4 289 B8R1.1 CCC1CC(CN1)C MCULE-1050977557 [1,0,0,0,0,0|2,0,1]=4 290 B8R1.1 CNC1CCC(C1)O MCULE-1177292585 [1,0,0,0,0,0|3,0,0]=4 291 B8R1.1 CNC1CCC(C1)O MCULE-5259471149 [1,0,0,0,0,0|3,0,0]=4 292 B8R1.1 CN[C@@H]1CC[C@@H](C1)O MCULE-3921744037 [1,0,0,0,0,0|3,0,0]=4 293 B8R1.1 COC1CCC(C1)O MCULE-3531007988 [1,0,0,0,0,0|3,0,0]=4 294 B8R1.1 CO[C@@H]1CC[C@@H](C1)O MCULE-5232016028 [1,0,0,0,0,0|3,0,0]=4 295 B8R1.1 C[C@@H]1CN[C@@H](C1)CF MCULE-2959715955 [1,0,0,0,0,0|2,0,1]=4 296 B8R1.1 C[C@@H]1CN[C@@H](C1)CF MCULE-8576921377 [1,0,0,0,0,0|2,0,1]=4 297 B8R1.1 C[C@@H]1CN[C@@H](C1)CO MCULE-1057201942 [1,0,0,0,0,0|1,0,1]=3 298 B8R1.1 C[C@@H]1CN[C@@H](C1)CO MCULE-5251520971 [1,0,0,0,0,0|1,0,1]=3 299 B8R1.1 C[C@H]1CN[C@@H](C1)CO MCULE-3784655204 [1,0,0,0,0,0|1,0,1]=3 300 B8R1.1 C[C@H]1CN[C@@H](C1)CO MCULE-3927798393 [1,0,0,0,0,0|1,0,1]=3 301 B8R1.1 FCC1CC(CN1)F MCULE-2675667218 [1,0,0,0,0,0|2,0,1]=4 302 B8R1.1 FCC1CC(CN1)F MCULE-9263946341 [1,0,0,0,0,0|2,0,1]=4 303 B8R1.1 FC[C@@H]1C[C@@H](CN1)F MCULE-6952912871 [1,0,0,0,0,0|2,0,1]=4 304 B8R1.1 FC[C@@H]1C[C@@H](CN1)F MCULE-9220587585 [1,0,0,0,0,0|2,0,1]=4 305 B8R1.1 FC[C@H]1C[C@H](CN1)F MCULE-1208494188 [1,0,0,0,0,0|2,0,1]=4 306 B8R1.1 FC[C@H]1C[C@H](CN1)F MCULE-2034962585 [1,0,0,0,0,0|2,0,1]=4 307 B8R1.1 N#CC1CC(CN1)F MCULE-2122766646 [1,0,0,0,0,0|2,0,1]=4 308 B8R1.1 N#CC1CC(CN1)F MCULE-2876487698 [1,0,0,0,0,0|2,0,1]=4 309 B8R1.1 N#CC1CCC(C1)O MCULE-5905406850 [1,0,0,0,0,0|2,0,1]=4 310 B8R1.1 N#C[C@@H]1CC[C@@H](C1)O MCULE-8121411873 [1,0,0,0,0,0|2,0,1]=4 311 B8R1.1 N#C[C@@H]1CC[C@H](C1)O MCULE-3581437653 [1,0,0,0,0,0|2,0,1]=4 312 B8R1.1 N#C[C@@H]1CC[C@H](C1)O MCULE-5514135227 [1,0,0,0,0,0|2,0,1]=4 313 B8R1.1 N#C[C@@H]1C[C@@H](CN1)F MCULE-1585643522 [1,0,0,0,0,0|2,0,1]=4 314 B8R1.1 N#C[C@@H]1C[C@@H](CN1)F MCULE-1793285797 [1,0,0,0,0,0|2,0,1]=4 315 B8R1.1 N#C[C@@H]1C[C@@H](CN1)F MCULE-3644076831 [1,0,0,0,0,0|2,0,1]=4 316 B8R1.1 N#C[C@@H]1C[C@@H](CN1)F MCULE-3832555558 [1,0,0,0,0,0|2,0,1]=4 317 B8R1.1 N#C[C@@H]1C[C@@H](CN1)F MCULE-6569939407 [1,0,0,0,0,0|2,0,1]=4 318 B8R1.1 N#C[C@@H]1C[C@@H](CN1)F MCULE-9967603029 [1,0,0,0,0,0|2,0,1]=4 319 B8R1.1 N#C[C@H]1CC[C@H](C1)O MCULE-5018154932 [1,0,0,0,0,0|2,0,1]=4 320 B8R1.1 N#C[C@H]1CC[C@H](C1)O MCULE-9804475995 [1,0,0,0,0,0|2,0,1]=4 321 B8R1.1 N#C[C@H]1C[C@@H](CN1)F MCULE-1819506724 [1,0,0,0,0,0|2,0,1]=4 322 B8R1.1 N#C[C@H]1C[C@@H](CN1)F MCULE-6331837178 [1,0,0,0,0,0|2,0,1]=4 323 B8R1.1 N#C[C@H]1C[C@@H](CN1)F MCULE-8016266496 [1,0,0,0,0,0|2,0,1]=4 324 B8R1.1 N#C[C@H]1C[C@@H](CN1)F MCULE-9440252626 [1,0,0,0,0,0|2,0,1]=4 325 B8R1.1 N#C[C@H]1C[C@H](CN1)F MCULE-5256715640 [1,0,0,0,0,0|2,0,1]=4 326 B8R1.1 N#C[C@H]1C[C@H](CN1)F MCULE-7513524025 [1,0,0,0,0,0|2,0,1]=4 327 B8R1.1 NCC1CCC(C1)O MCULE-1780130995 [1,0,0,0,0,0|2,0,1]=4 328 B8R1.1 NCC1CCC(C1)O MCULE-5002398342 [1,0,0,0,0,0|2,0,1]=4 329 B8R1.1 NCC1C[C@H](CN1)O MCULE-1428185082 [1,0,0,0,0,0|1,0,1]=3 330 B8R1.1 NC[C@@H]1CC[C@@H](C1)O MCULE-2662561877 [1,0,0,0,0,0|2,0,1]=4 331 B8R1.1 NC[C@@H]1CC[C@H](C1)O MCULE-9258933196 [1,0,0,0,0,0|2,0,1]=4 332 B8R1.1 NC[C@H]1CC[C@@H](C1)O MCULE-1995293557 [1,0,0,0,0,0|2,0,1]=4 333 B8R1.1 NC[C@H]1CC[C@@H](C1)O MCULE-9517253792 [1,0,0,0,0,0|2,0,1]=4 334 B8R1.1 NC[C@H]1CC[C@H](C1)O MCULE-5659749587 [1,0,0,0,0,0|2,0,1]=4 335 B8R1.1 NC[C@H]1CC[C@H](C1)O MCULE-9056303043 [1,0,0,0,0,0|2,0,1]=4 336 B8R1.1 N[C@@H]1CN[C@H](C1)CO MCULE-7916347231 [1,0,0,0,0,0|1,0,1]=3 337 B8R1.1 N[C@@H]1CN[C@H](C1)CO MCULE-8825406157 [1,0,0,0,0,0|1,0,1]=3 338 B8R1.1 N[C@H]1CN[C@@H](C1)CO MCULE-3649010281 [1,0,0,0,0,0|1,0,1]=3 339 B8R1.1 N[C@H]1CN[C@@H](C1)CO MCULE-5102365319 [1,0,0,0,0,0|1,0,1]=3 340 B8R1.1 N[C@H]1CN[C@@H](C1)CO MCULE-8268517033 [1,0,0,0,0,0|1,0,1]=3 341 B8R1.1 O=C[C@@H]1CC(CN1)F MCULE-5331901113 [1,0,0,0,0,0|1,0,0]=2 342 B8R1.1 O=C[C@@H]1CC(CN1)F MCULE-6102557843 [1,0,0,0,0,0|1,0,0]=2 343 B8R1.1 OC1COC(C1)CI MCULE-9241971646 [1,0,0,0,0,0|2,0,1]=4 344 B8R1.1 OCC1CC(CN1)F MCULE-6111724005 [1,0,0,0,0,0|1,0,1]=3 345 B8R1.1 OCC1CC(CN1)F MCULE-9466287708 [1,0,0,0,0,0|1,0,1]=3 346 B8R1.1 OCC1CC(CN1)O MCULE-1017614151 [1,0,0,0,0,0|0,0,1]=2 347 B8R1.1 OCC1CC(CN1)O MCULE-5049675085 [1,0,0,0,0,0|0,0,1]=2 348 B8R1.1 OCC1CC(CO1)O MCULE-4648895678 [1,0,0,0,0,0|1,0,1]=3 349 B8R1.1 OCC1CCC(C1)F MCULE-4786923020 [1,0,0,0,0,0|2,0,1]=4 350 B8R1.1 OCC1CCC(C1)O MCULE-5225292788 [1,0,0,0,0,0|1,0,1]=3 351 B8R1.1 OC[C@@H]1CC[C@@H](C1)O MCULE-7117159358 [1,0,0,0,0,0|1,0,1]=3 352 B8R1.1 OC[C@@H]1CC[C@H](C1)F MCULE-4252726732 [1,0,0,0,0,0|2,0,1]=4 353 B8R1.1 OC[C@@H]1C[C@@H](CN1)F MCULE-2619594606 [1,0,0,0,0,0|1,0,1]=3 354 B8R1.1 OC[C@@H]1C[C@@H](CN1)F MCULE-3940168858 [1,0,0,0,0,0|1,0,1]=3 355 B8R1.1 OC[C@@H]1C[C@@H](CN1)F MCULE-6567372757 [1,0,0,0,0,0|1,0,1]=3 356 B8R1.1 OC[C@@H]1C[C@@H](CN1)O MCULE-2521610955 [1,0,0,0,0,0|0,0,1]=2 357 B8R1.1 OC[C@@H]1C[C@@H](CN1)O MCULE-3659134136 [1,0,0,0,0,0|0,0,1]=2 358 B8R1.1 OC[C@@H]1C[C@@H](CN1)O MCULE-8149895498 [1,0,0,0,0,0|0,0,1]=2 359 B8R1.1 OC[C@@H]1C[C@@H](CN1)O MCULE-9582350102 [1,0,0,0,0,0|0,0,1]=2 360 B8R1.1 OC[C@@H]1C[C@@H](CO1)O MCULE-7875239623 [1,0,0,0,0,0|1,0,1]=3 361 B8R1.1 OC[C@@H]1C[C@H](CN1)F MCULE-4754863670 [1,0,0,0,0,0|1,0,1]=3 362 B8R1.1 OC[C@@H]1C[C@H](CN1)F MCULE-4823692987 [1,0,0,0,0,0|1,0,1]=3 363 B8R1.1 OC[C@@H]1C[C@H](CN1)O MCULE-4908761192 [1,0,0,0,0,0|0,0,1]=2 364 B8R1.1 OC[C@@H]1C[C@H](CN1)O MCULE-5510339033 [1,0,0,0,0,0|0,0,1]=2 365 B8R1.1 OC[C@@H]1C[C@H](CN1)O MCULE-7612890329 [1,0,0,0,0,0|0,0,1]=2 366 B8R1.1 OC[C@@H]1C[C@H](CN1)O MCULE-8424913442 [1,0,0,0,0,0|0,0,1]=2 367 B8R1.1 OC[C@H]1CC[C@@H](C1)O MCULE-7760122854 [1,0,0,0,0,0|1,0,1]=3 368 B8R1.1 OC[C@H]1CC[C@@H](C1)O MCULE-9132554470 [1,0,0,0,0,0|1,0,1]=3 369 B8R1.1 OC[C@H]1C[C@@H](CN1)F MCULE-2106727383 [1,0,0,0,0,0|1,0,1]=3 370 B8R1.1 OC[C@H]1C[C@@H](CN1)F MCULE-3167425320 [1,0,0,0,0,0|1,0,1]=3 371 B8R1.1 OC[C@H]1C[C@@H](CN1)F MCULE-5656834651 [1,0,0,0,0,0|1,0,1]=3 372 B8R1.1 OC[C@H]1C[C@@H](CN1)F MCULE-9413584553 [1,0,0,0,0,0|1,0,1]=3 373 B8R1.1 OC[C@H]1C[C@@H](CN1)O MCULE-2855908983 [1,0,0,0,0,0|0,0,1]=2 374 B8R1.1 OC[C@H]1C[C@@H](CN1)O MCULE-5564885819 [1,0,0,0,0,0|0,0,1]=2 375 B8R1.1 OC[C@H]1C[C@@H](CN1)O MCULE-9276468823 [1,0,0,0,0,0|0,0,1]=2 376 B8R1.1 OC[C@H]1C[C@@H](CN1)O MCULE-9585503921 [1,0,0,0,0,0|0,0,1]=2 377 B8R1.1 OC[C@H]1C[C@@H](CO1)O MCULE-5801561749 [1,0,0,0,0,0|1,0,1]=3 378 B8R1.1 OC[C@H]1C[C@H](CN1)F MCULE-3583754715 [1,0,0,0,0,0|1,0,1]=3 379 B8R1.1 OC[C@H]1C[C@H](CN1)F MCULE-3654392017 [1,0,0,0,0,0|1,0,1]=3 380 B8R1.1 OC[C@H]1C[C@H](CN1)F MCULE-3959005096 [1,0,0,0,0,0|1,0,1]=3 381 B8R1.1 OC[C@H]1C[C@H](CN1)F MCULE-9542838904 [1,0,0,0,0,0|1,0,1]=3 382 B8R1.1 OC[C@H]1C[C@H](CN1)O MCULE-2099905531 [1,0,0,0,0,0|0,0,1]=2 383 B8R1.1 OC[C@H]1C[C@H](CN1)O MCULE-5693059049 [1,0,0,0,0,0|0,0,1]=2 384 B8R1.1 OC[C@H]1C[C@H](CN1)O MCULE-6004929736 [1,0,0,0,0,0|0,0,1]=2 385 B8R1.1 OC[C@H]1C[C@H](CN1)O MCULE-8607282785 [1,0,0,0,0,0|0,0,1]=2 386 B8R1.1 OC[C@H]1C[C@H](CO1)O MCULE-4197376814 [1,0,0,0,0,0|1,0,1]=3 387 B8R1.1 OC[C@H]1C[C@H](CO1)O MCULE-4573543387 [1,0,0,0,0,0|1,0,1]=3 388 B8R1.1 [C@H]1(CN[C@@H](C1)CF)F MCULE-2056395387 [1,0,0,0,0,0|2,0,1]=4 389 B8R1.1 [C@H]1(CN[C@@H](C1)CF)F MCULE-9578613289 [1,0,0,0,0,0|2,0,1]=4 390 B8R1.1 [C@H]1(CN[C@@H](C1)CO)C MCULE-1910074067 [1,0,0,0,0,0|1,0,1]=3 391 B8R1.1 [C@H]1(CN[C@@H](C1)CO)C MCULE-9340203932 [1,0,0,0,0,0|1,0,1]=3 392 B8R1.1 [C@H]1(CN[C@@H](C1)CO)F MCULE-7089143816 [1,0,0,0,0,0|1,0,1]=3 393 B8R1.1 [C@H]1(C[C@H](CN1)F)CO MCULE-2231031404 [1,0,0,0,0,0|1,0,1]=3 394 B8R1.1 [C@H]1(C[C@H](CN1)F)CO MCULE-6096542902 [1,0,0,0,0,0|1,0,1]=3 395 B8R1.1 [C@H]1(C[C@H](CN1)N)CO MCULE-6496782896 [1,0,0,0,0,0|1,0,1]=3 396 B8R1.1 [C@H]1(C[C@H](CN1)O)CO MCULE-4041584401 [1,0,0,0,0,0|0,0,1]=2 397 B8R1.1 [C@H]1(C[C@H](CN1)O)CO MCULE-9607072956 [1,0,0,0,0,0|0,0,1]=2 398 B8R1.7 C1(CCCN1)C(=O)N MCULE-2539007211 [1,0,0,0,0,0|1,0,0]=2 399 B8R1.7 C1(CCCN1)C(=O)N MCULE-7289713183 [1,0,0,0,0,0|1,0,0]=2 400 B8R1.7 C1(CCCN1)C(C)C MCULE-1193597619 [1,0,0,0,0,0|2,0,1]=4 401 B8R1.7 C1(CCCN1)C(C)C MCULE-5005043134 [1,0,0,0,0,0|2,0,1]=4 402 B8R1.7 C1(CCCN1)C(F)F MCULE-5617460277 [1,0,0,0,0,0|2,0,1]=4 403 B8R1.7 C1(CCCN1)C(F)F MCULE-7529295267 [1,0,0,0,0,0|2,0,1]=4 404 B8R1.7 C1(CCNC1)C(=O)N MCULE-4476688014 [1,0,0,0,0,0|3,0,0]=4 405 B8R1.7 C1(CCNC1)C(=O)N MCULE-8592806332 [1,0,0,0,0,0|3,0,0]=4 406 B8R1.7 C1(CCNC1)C(=O)O MCULE-3210241958 [1,0,0,0,0,0|2,0,0]=3 407 B8R1.7 C1(CCNC1)C(=O)O MCULE-6517290754 [1,0,0,0,0,0|2,0,0]=3 408 B8R1.7 C1(CCOC1)C(=O)O MCULE-4859263225 [1,0,0,0,0,0|2,0,0]=3 409 B8R1.7 CC(=O)C1=CCCC1 MCULE-9623046872 [1,0,0,0,0,0|2,0,1]=4 410 B8R1.7 CC(=O)C1CCC=N1 MCULE-5434976735 [1,0,0,0,0,0|1,0,2]=4 411 B8R1.7 CC(=O)C1CCCC1 MCULE-7952211819 [1,0,0,0,0,0|2,0,0]=3 412 B8R1.7 CC(=O)C1CCCN1 MCULE-2528977871 [1,0,0,0,0,0|1,0,0]=2 413 B8R1.7 CC(=O)C1CCCN1 MCULE-9222880225 [1,0,0,0,0,0|1,0,0]=2 414 B8R1.7 CC(=O)C1CCCO1 MCULE-7518147693 [1,0,0,0,0,0|2,0,0]=3 415 B8R1.7 CC(=O)C1CCNC1 MCULE-2147779518 [1,0,0,0,0,0|3,0,0]=4 416 B8R1.7 CC(=O)C1CCNC1 MCULE-2964372059 [1,0,0,0,0,0|3,0,0]=4 417 B8R1.7 CC(=O)C1CCOC1 MCULE-2105633909 [1,0,0,0,0,0|3,0,0]=4 418 B8R1.7 CC(=O)C1NCCS1 MCULE-4092674646 [1,0,0,0,0,0|2,0,0]=3 419 B8R1.7 CC(=O)C1NCCS1 MCULE-8660367055 [1,0,0,0,0,0|2,0,0]=3 420 B8R1.7 CC(=O)N1CCCC1 MCULE-6839528034 [1,0,0,0,0,0|3,0,0]=4 421 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-1290635339 [1,0,0,0,0,0|1,0,0]=2 422 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-2855198659 [1,0,0,0,0,0|1,0,0]=2 423 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-2944662012 [1,0,0,0,0,0|1,0,0]=2 424 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-4806473466 [1,0,0,0,0,0|1,0,0]=2 425 B8R1.7 CC(=O)[C@@H]1CCCO1 MCULE-2015960170 [1,0,0,0,0,0|2,0,0]=3 426 B8R1.7 CC(=O)[C@@H]1CCCO1 MCULE-3381319090 [1,0,0,0,0,0|2,0,0]=3 427 B8R1.7 CC(=O)[C@H]1CCCN1 MCULE-2095368644 [1,0,0,0,0,0|1,0,0]=2 428 B8R1.7 CC(=O)[C@H]1CCCN1 MCULE-5460066005 [1,0,0,0,0,0|1,0,0]=2 429 B8R1.7 CC(=O)[C@H]1CCCO1 MCULE-5637204370 [1,0,0,0,0,0|2,0,0]=3 430 B8R1.7 CC(C)C1CCCN1 MCULE-2880698089 [1,0,0,0,0,0|2,0,1]=4 431 B8R1.7 CC(C)C1CCCN1 MCULE-8748321913 [1,0,0,0,0,0|2,0,1]=4 432 B8R1.7 CC(C)[C@@H]1CCCN1 MCULE-1080192326 [1,0,0,0,0,0|2,0,1]=4 433 B8R1.7 CC(C)[C@@H]1CCCN1 MCULE-7041423474 [1,0,0,0,0,0|2,0,1]=4 434 B8R1.7 CC(C)[C@@H]1CCCN1 MCULE-8923460014 [1,0,0,0,0,0|2,0,1]=4 435 B8R1.7 CC(C)[C@@H]1CCCN1 MCULE-9332303275 [1,0,0,0,0,0|2,0,1]=4 436 B8R1.7 CC(C)[C@H]1CCCN1 MCULE-2217061634 [1,0,0,0,0,0|2,0,1]=4 437 B8R1.7 CC(C)[C@H]1CCCN1 MCULE-7316037645 [1,0,0,0,0,0|2,0,1]=4 438 B8R1.7 CC(C)[C@H]1CCCN1 MCULE-7382792334 [1,0,0,0,0,0|2,0,1]=4 439 B8R1.7 CC(C)[C@H]1CCCN1 MCULE-9823510614 [1,0,0,0,0,0|2,0,1]=4 440 B8R1.7 CC(O)C1CCCC1 MCULE-6730583511 [1,0,0,0,0,0|2,0,1]=4 441 B8R1.7 CC(O)C1CCCO1 MCULE-2804362263 [1,0,0,0,0,0|2,0,1]=4 442 B8R1.7 C[C@@H](O)C1CCCC1 MCULE-2530250478 [1,0,0,0,0,0|2,0,1]=4 443 B8R1.7 C[C@@H](O)[C@H]1CCCO1 MCULE-6393902221 [1,0,0,0,0,0|2,0,1]=4 444 B8R1.7 C[C@H](O)C1CCCC1 MCULE-9054245488 [1,0,0,0,0,0|2,0,1]=4 445 B8R1.7 C[C@H](O)C1CCCO1 MCULE-5402066981 [1,0,0,0,0,0|2,0,1]=4 446 B8R1.7 C[C@H](O)[C@@H]1CCCN1 MCULE-5014228849 [1,0,0,0,0,0|1,0,1]=3 447 B8R1.7 C[C@H](O)[C@@H]1CCCN1 MCULE-5063876687 [1,0,0,0,0,0|1,0,1]=3 448 B8R1.7 C[C@H](O)[C@@H]1CCCO1 MCULE-3917713920 [1,0,0,0,0,0|2,0,1]=4 449 B8R1.7 FC(F)C1CCCN1 MCULE-2679624104 [1,0,0,0,0,0|2,0,1]=4 450 B8R1.7 FC(F)C1CCCN1 MCULE-6665318434 [1,0,0,0,0,0|2,0,1]=4 451 B8R1.7 FC(F)[C@@H]1CCCN1 MCULE-4550665710 [1,0,0,0,0,0|2,0,1]=4 452 B8R1.7 FC(F)[C@@H]1CCCN1 MCULE-5404733637 [1,0,0,0,0,0|2,0,1]=4 453 B8R1.7 FC(F)[C@@H]1CCCN1 MCULE-5465380229 [1,0,0,0,0,0|2,0,1]=4 454 B8R1.7 FC(F)[C@@H]1CCCN1 MCULE-6799321789 [1,0,0,0,0,0|2,0,1]=4 455 B8R1.7 FC(F)[C@H]1CCCN1 MCULE-5217394450 [1,0,0,0,0,0|2,0,1]=4 456 B8R1.7 FC(F)[C@H]1CCCN1 MCULE-9580378678 [1,0,0,0,0,0|2,0,1]=4 457 B8R1.7 N=C(N)C1CCCC1 MCULE-3526902612 [1,0,0,0,0,0|3,0,0]=4 458 B8R1.7 N=C(N)C1CCCC1 MCULE-7613986881 [1,0,0,0,0,0|3,0,0]=4 459 B8R1.7 N=C(N)C1CCCN1 MCULE-3357684433 [1,0,0,0,0,0|2,0,0]=3 460 B8R1.7 N=C(N)C1CCCN1 MCULE-7506606085 [1,0,0,0,0,0|2,0,0]=3 461 B8R1.7 N=C(N)C1CCCO1 MCULE-1348627071 [1,0,0,0,0,0|3,0,0]=4 462 B8R1.7 N=C(N)C1CCCO1 MCULE-4359589378 [1,0,0,0,0,0|3,0,0]=4 463 B8R1.7 NC(=O)C1=NCCN1 MCULE-8784849906 [1,0,0,0,0,0|2,0,1]=4 464 B8R1.7 NC(=O)C1CCCC1 MCULE-3900666396 [1,0,0,0,0,0|2,0,0]=3 465 B8R1.7 NC(=O)C1CCCN1 MCULE-4159463416 [1,0,0,0,0,0|1,0,0]=2 466 B8R1.7 NC(=O)C1CCCN1 MCULE-4804910089 [1,0,0,0,0,0|1,0,0]=2 467 B8R1.7 NC(=O)C1CCCO1 MCULE-9101921416 [1,0,0,0,0,0|2,0,0]=3 468 B8R1.7 NC(=O)C1CCNC1 MCULE-6035608651 [1,0,0,0,0,0|3,0,0]=4 469 B8R1.7 NC(=O)C1CCNC1 MCULE-8602888952 [1,0,0,0,0,0|3,0,0]=4 470 B8R1.7 NC(=O)C1CCOC1 MCULE-7120435380 [1,0,0,0,0,0|3,0,0]=4 471 B8R1.7 NC(=O)C1CSCN1 MCULE-7557874523 [1,0,0,0,0,0|2,0,0]=3 472 B8R1.7 NC(=O)N1CCCC1 MCULE-2282948234 [1,0,0,0,0,0|3,0,0]=4 473 B8R1.7 NC(=O)[C@@H]1C=CCN1 MCULE-2894820708 [1,0,0,0,0,0|1,0,2]=4 474 B8R1.7 NC(=O)[C@@H]1C=CCN1 MCULE-3478764941 [1,0,0,0,0,0|1,0,2]=4 475 B8R1.7 NC(=O)[C@@H]1C=CCN1 MCULE-6696620969 [1,0,0,0,0,0|1,0,2]=4 476 B8R1.7 NC(=O)[C@@H]1C=CCN1 MCULE-7629009072 [1,0,0,0,0,0|1,0,2]=4 477 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-2635874022 [1,0,0,0,0,0|1,0,0]=2 478 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-2652734118 [1,0,0,0,0,0|1,0,0]=2 479 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-4692992308 [1,0,0,0,0,0|1,0,0]=2 480 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-6463625531 [1,0,0,0,0,0|1,0,0]=2 481 B8R1.7 NC(=O)[C@@H]1CCCO1 MCULE-3181755658 [1,0,0,0,0,0|2,0,0]=3 482 B8R1.7 NC(=O)[C@@H]1CCCO1 MCULE-9348376356 [1,0,0,0,0,0|2,0,0]=3 483 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-1320057579 [1,0,0,0,0,0|3,0,0]=4 484 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-1678228480 [1,0,0,0,0,0|3,0,0]=4 485 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-3340066069 [1,0,0,0,0,0|3,0,0]=4 486 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-8833406496 [1,0,0,0,0,0|3,0,0]=4 487 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-1391877694 [1,0,0,0,0,0|1,0,0]=2 488 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-2636422628 [1,0,0,0,0,0|1,0,0]=2 489 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-3135852117 [1,0,0,0,0,0|1,0,0]=2 490 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-9661392945 [1,0,0,0,0,0|1,0,0]=2 491 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-1673594093 [1,0,0,0,0,0|3,0,0]=4 492 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-6725123306 [1,0,0,0,0,0|3,0,0]=4 493 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-7222756259 [1,0,0,0,0,0|3,0,0]=4 494 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-8100234071 [1,0,0,0,0,0|3,0,0]=4 495 B8R1.7 NC(=O)[C@H]1CCOC1 MCULE-1231475693 [1,0,0,0,0,0|3,0,0]=4 496 B8R1.7 NC(=S)C1CCCC1 MCULE-8081902896 [1,0,0,0,0,0|2,1,0]=4 497 B8R1.7 NC(=S)C1CCCO1 MCULE-7906949480 [1,0,0,0,0,0|2,1,0]=4 498 B8R1.7 O=C(Cl)C1CCCC1 MCULE-1337538941 [1,0,0,0,0,0|2,0,0]=3 499 B8R1.7 O=C(Cl)C1CCCO1 MCULE-9691919934 [1,0,0,0,0,0|2,0,0]=3 500 B8R1.7 O=C(Cl)C1CCOC1 MCULE-9071234830 [1,0,0,0,0,0|3,0,0]=4 501 B8R1.7 O=C(Cl)N1CCCC1 MCULE-2201729080 [1,0,0,0,0,0|3,0,0]=4 502 B8R1.7 O=C(O)C1=CCCC1 MCULE-2928571993 [1,0,0,0,0,0|1,0,1]=3 503 B8R1.7 O=C(O)C1=CCCO1 MCULE-8380391200 [1,0,0,0,0,0|1,0,2]=4 504 B8R1.7 O=C(O)C1=CCCS1 MCULE-9231409703 [1,0,0,0,0,0|1,0,2]=4 505 B8R1.7 O=C(O)C1=CCNC1 MCULE-2391284266 [1,0,0,0,0,0|2,0,1]=4 506 B8R1.7 O=C(O)C1=CCNC1 MCULE-5725335930 [1,0,0,0,0,0|2,0,1]=4 507 B8R1.7 O=C(O)C1=CCOC1 MCULE-3209603870 [1,0,0,0,0,0|2,0,1]=4 508 B8R1.7 O=C(O)C1=CCSC1 MCULE-3187835692 [1,0,0,0,0,0|2,0,1]=4 509 B8R1.7 O=C(O)C1=COCC1 MCULE-7263072561 [1,0,0,0,0,0|2,0,1]=4 510 B8R1.7 O=C(O)C1=NCCC1 MCULE-2664768755 [1,0,0,0,0,0|0,0,2]=3 511 B8R1.7 O=C(O)C1=NOCC1 MCULE-3126584315 [1,0,0,0,0,0|1,0,2]=4 512 B8R1.7 O=C(O)C1C=CCC1 MCULE-8870546284 [1,0,0,0,0,0|1,0,1]=3 513 B8R1.7 O=C(O)C1C=CCN1 MCULE-2141949922 [1,0,0,0,0,0|0,0,2]=3 514 B8R1.7 O=C(O)C1C=CCN1 MCULE-3068035697 [1,0,0,0,0,0|0,0,2]=3 515 B8R1.7 O=C(O)C1C=CCN1 MCULE-4825351403 [1,0,0,0,0,0|0,0,2]=3 516 B8R1.7 O=C(O)C1C=CCN1 MCULE-9928071710 [1,0,0,0,0,0|0,0,2]=3 517 B8R1.7 O=C(O)C1C=CCO1 MCULE-7417068170 [1,0,0,0,0,0|1,0,2]=4 518 B8R1.7 O=C(O)C1CC=CC1 MCULE-7876630177 [1,0,0,0,0,0|1,0,2]=4 519 B8R1.7 O=C(O)C1CCC=N1 MCULE-1792151957 [1,0,0,0,0,0|0,0,2]=3 520 B8R1.7 O=C(O)C1CCCC1 MCULE-6415159340 [1,0,0,0,0,0|1,0,0]=2 521 B8R1.7 O=C(O)C1CCCN1 MCULE-2229401513 [1,0,0,0,0,0|0,0,0]=1 522 B8R1.7 O=C(O)C1CCCN1 MCULE-6305507014 [1,0,0,0,0,0|0,0,0]=1 523 B8R1.7 O=C(O)C1CCCN1 MCULE-8387491590 [1,0,0,0,0,0|0,0,0]=1 524 B8R1.7 O=C(O)C1CCCN1 MCULE-8611160929 [1,0,0,0,0,0|0,0,0]=1 525 B8R1.7 O=C(O)C1CCCO1 MCULE-1952289090 [1,0,0,0,0,0|1,0,0]=2 526 B8R1.7 O=C(O)C1CCCO1 MCULE-5387481824 [1,0,0,0,0,0|1,0,0]=2 527 B8R1.7 O=C(O)C1CCCS1 MCULE-7760686042 [1,0,0,0,0,0|1,0,0]=2 528 B8R1.7 O=C(O)C1CCNC1 MCULE-4976520029 [1,0,0,0,0,0|2,0,0]=3 529 B8R1.7 O=C(O)C1CCNC1 MCULE-5937045785 [1,0,0,0,0,0|2,0,0]=3 530 B8R1.7 O=C(O)C1CCNC1 MCULE-6983695276 [1,0,0,0,0,0|2,0,0]=3 531 B8R1.7 O=C(O)C1CCOC1 MCULE-3567941338 [1,0,0,0,0,0|2,0,0]=3 532 B8R1.7 O=C(O)C1CCSC1 MCULE-7898686734 [1,0,0,0,0,0|2,0,0]=3 533 B8R1.7 O=C(O)C1COCN1 MCULE-4997392610 [1,0,0,0,0,0|1,0,0]=2 534 B8R1.7 O=C(O)C1COCN1 MCULE-7001651226 [1,0,0,0,0,0|1,0,0]=2 535 B8R1.7 O=C(O)C1CSCN1 MCULE-2391637686 [1,0,0,0,0,0|1,0,0]=2 536 B8R1.7 O=C(O)C1CSCN1 MCULE-9622331370 [1,0,0,0,0,0|1,0,0]=2 537 B8R1.7 O=C(O)C1CSSC1 MCULE-8231952386 [1,0,0,0,0,0|3,0,0]=4 538 B8R1.7 O=C(O)C1NCCS1 MCULE-2504435743 [1,0,0,0,0,0|1,0,0]=2 539 B8R1.7 O=C(O)C1SCCS1 MCULE-4466563646 [1,0,0,0,0,0|2,0,0]=3 540 B8R1.7 O=C(O)N1CCCC1 MCULE-7984061130 [1,0,0,0,0,0|2,0,0]=3 541 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-2515045579 [1,0,0,0,0,0|0,0,2]=3 542 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-3589058117 [1,0,0,0,0,0|0,0,2]=3 543 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-7995918745 [1,0,0,0,0,0|0,0,2]=3 544 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-8155212892 [1,0,0,0,0,0|0,0,2]=3 545 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-1020921088 [1,0,0,0,0,0|0,0,0]=1 546 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6398060480 [1,0,0,0,0,0|0,0,0]=1 547 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6772131264 [1,0,0,0,0,0|0,0,0]=1 548 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-8415049837 [1,0,0,0,0,0|0,0,0]=1 549 B8R1.7 O=C(O)[C@@H]1CCCO1 MCULE-5193388500 [1,0,0,0,0,0|1,0,0]=2 550 B8R1.7 O=C(O)[C@@H]1CCCO1 MCULE-8181760406 [1,0,0,0,0,0|1,0,0]=2 551 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-3068007507 [1,0,0,0,0,0|2,0,0]=3 552 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4477578687 [1,0,0,0,0,0|2,0,0]=3 553 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4524201006 [1,0,0,0,0,0|2,0,0]=3 554 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4868292658 [1,0,0,0,0,0|2,0,0]=3 555 B8R1.7 O=C(O)[C@@H]1CCOC1 MCULE-4807765276 [1,0,0,0,0,0|2,0,0]=3 556 B8R1.7 O=C(O)[C@@H]1CCOC1 MCULE-7912413581 [1,0,0,0,0,0|2,0,0]=3 557 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1547472283 [1,0,0,0,0,0|1,0,0]=2 558 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1876089066 [1,0,0,0,0,0|1,0,0]=2 559 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1926856350 [1,0,0,0,0,0|1,0,0]=2 560 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-9876695932 [1,0,0,0,0,0|1,0,0]=2 561 B8R1.7 O=C(O)[C@@H]1CSCN1 MCULE-4243406881 [1,0,0,0,0,0|1,0,0]=2 562 B8R1.7 O=C(O)[C@@H]1CSCN1 MCULE-6343154165 [1,0,0,0,0,0|1,0,0]=2 563 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-2145380755 [1,0,0,0,0,0|0,0,2]=3 564 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-5768283844 [1,0,0,0,0,0|0,0,2]=3 565 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-8522372891 [1,0,0,0,0,0|0,0,2]=3 566 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-5856142508 [1,0,0,0,0,0|0,0,0]=1 567 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-7748032436 [1,0,0,0,0,0|0,0,0]=1 568 B8R1.7 O=C(O)[C@H]1CCCO1 MCULE-2258024439 [1,0,0,0,0,0|1,0,0]=2 569 B8R1.7 O=C(O)[C@H]1CCCO1 MCULE-5143953192 [1,0,0,0,0,0|1,0,0]=2 570 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-2003400674 [1,0,0,0,0,0|2,0,0]=3 571 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-2851087395 [1,0,0,0,0,0|2,0,0]=3 572 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-7223432888 [1,0,0,0,0,0|2,0,0]=3 573 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-7610384670 [1,0,0,0,0,0|2,0,0]=3 574 B8R1.7 O=C(O)[C@H]1CCOC1 MCULE-3213766488 [1,0,0,0,0,0|2,0,0]=3 575 B8R1.7 O=C(O)[C@H]1CCOC1 MCULE-9627397250 [1,0,0,0,0,0|2,0,0]=3 576 B8R1.7 O=C(O)[C@H]1CSCN1 MCULE-6095527710 [1,0,0,0,0,0|1,0,0]=2 577 B8R1.7 O=C(O)[C@H]1CSCN1 MCULE-9117444908 [1,0,0,0,0,0|1,0,0]=2 578 B8R1.7 O=C([O-])C1CCC=N1 MCULE-3235635441 [1,0,0,0,0,0|0,0,3]=4 579 B8R1.7 O=C([O-])C1CCCN1 MCULE-9155494525 [1,0,0,0,0,0|0,0,1]=2 580 B8R1.7 O=C([O-])C1CSCN1 MCULE-9836043803 [1,0,0,0,0,0|1,0,1]=3 581 B8R1.7 O=C([O-])[C@@H]1CCCN1 MCULE-2694821396 [1,0,0,0,0,0|0,0,1]=2 582 B8R1.7 O=C([O-])[C@@H]1CCCN1 MCULE-8353601451 [1,0,0,0,0,0|0,0,1]=2 583 B8R1.7 O=N(=O)C1CCCC1 MCULE-6499665829 [1,0,0,0,0,0|2,0,1]=4 584 B8R1.7 O=S([O-])C1CCCC1 MCULE-4973639131 [1,0,0,0,0,0|2,0,1]=4 585 B8R1.7 O=S([O-])C1CCCC1 MCULE-9227389818 [1,0,0,0,0,0|2,0,1]=4 586 B8R1.7 OB(O)C1CCCC1 MCULE-7101191940 [1,0,0,0,0,0|2,0,1]=4 587 B8R1.7 OB(O)C1CCCN1 MCULE-5123578937 [1,0,0,0,0,0|1,0,1]=3 588 B8R1.7 OB(O)C1CCCN1 MCULE-6072524963 [1,0,0,0,0,0|1,0,1]=3 589 B8R1.7 [C@@H]1(CSCN1)C(=O)[O-] MCULE-3895380806 [1,0,0,0,0,0|1,0,1]=3 590 B10R1.14 C1(CCC(=O)C1)C(=O)OC MCULE-8334918383 [0,1,0,0,0,0|1,0,2]=4 591 B10R1.14 C=C1CNC(C1)C(=O)OC MCULE-4635683717 [0,1,0,0,0,0|1,0,1]=3 592 B10R1.14 C=C1CNC(C1)C(=O)OC MCULE-9917502383 [0,1,0,0,0,0|1,0,1]=3 593 B10R1.14 C=C1CN[C@@H](C1)C(=O)OC MCULE-2960661877 [0,1,0,0,0,0|1,0,1]=3 594 B10R1.14 C=C1CN[C@@H](C1)C(=O)OC MCULE-3356870567 [0,1,0,0,0,0|1,0,1]=3 595 B10R1.14 C=C1CN[C@@H](C1)C(=O)OC MCULE-5709460460 [0,1,0,0,0,0|1,0,1]=3 596 B10R1.14 C=C1CN[C@@H](C1)C(=O)OC MCULE-5969395974 [0,1,0,0,0,0|1,0,1]=3 597 B10R1.14 CCC(=O)N1CCC(C1)O MCULE-3828339489 [0,1,0,0,0,0|3,0,0]=4 598 B10R1.14 CCC(=O)N1CC[C@@H](C1)O MCULE-9598960659 [0,1,0,0,0,0|3,0,0]=4 599 B10R1.14 CNC(=O)[C@@H]1CC[C@@H](C1)N MCULE-2223613184 [0,1,0,0,0,0|3,0,0]=4 600 B10R1.14 CNC(=O)[C@@H]1CC[C@@H](C1)N MCULE-6627777957 [0,1,0,0,0,0|3,0,0]=4 601 B10R1.14 CNC(=O)[C@@H]1CC[C@H](C1)N MCULE-1661578120 [0,1,0,0,0,0|3,0,0]=4 602 B10R1.14 CNC(=O)[C@@H]1CC[C@H](C1)N MCULE-3597072221 [0,1,0,0,0,0|3,0,0]=4 603 B10R1.14 CNC(=O)[C@@H]1CC[C@H](C1)N MCULE-3658690331 [0,1,0,0,0,0|3,0,0]=4 604 B10R1.14 CNC(=O)[C@@H]1CC[C@H](C1)N MCULE-3781359466 [0,1,0,0,0,0|3,0,0]=4 605 B10R1.14 COC(=O)C1=CC(NN1)O MCULE-5673611742 [0,1,0,0,0,0|1,0,2]=4 606 B10R1.14 COC(=O)C1=CCC(C1)N MCULE-4586199794 [0,1,0,0,0,0|2,0,1]=4 607 B10R1.14 COC(=O)C1=CCC(C1)N MCULE-7071775065 [0,1,0,0,0,0|2,0,1]=4 608 B10R1.14 COC(=O)C1C=CC(C1)N MCULE-8756402825 [0,1,0,0,0,0|2,0,1]=4 609 B10R1.14 COC(=O)C1C=CC(C1)N MCULE-9562522468 [0,1,0,0,0,0|2,0,1]=4 610 B10R1.14 COC(=O)C1CC(=O)CO1 MCULE-2471814999 [0,1,0,0,0,0|1,0,2]=4 611 B10R1.14 COC(=O)C1CC(CN1)F MCULE-4224631815 [0,1,0,0,0,0|1,0,0]=2 612 B10R1.14 COC(=O)C1CC(CN1)F MCULE-4763890845 [0,1,0,0,0,0|1,0,0]=2 613 B10R1.14 COC(=O)C1CC(CN1)O MCULE-7417308251 [0,1,0,0,0,0|0,0,0]=1 614 B10R1.14 COC(=O)C1CC(CN1)O MCULE-8127150549 [0,1,0,0,0,0|0,0,0]=1 615 B10R1.14 COC(=O)C1CC(CN1)S MCULE-6804443263 [0,1,0,0,0,0|0,1,0]=2 616 B10R1.14 COC(=O)C1CC(CN1)S MCULE-7952444114 [0,1,0,0,0,0|0,1,0]=2 617 B10R1.14 COC(=O)C1CCC(=O)C1 MCULE-5952382453 [0,1,0,0,0,0|1,0,2]=4 618 B10R1.14 COC(=O)C1CCC(C1)Br MCULE-4292905898 [0,1,0,0,0,0|2,0,0]=3 619 B10R1.14 COC(=O)C1CCC(C1)N MCULE-2002050883 [0,1,0,0,0,0|2,0,0]=3 620 B10R1.14 COC(=O)C1CCC(C1)N MCULE-6014010462 [0,1,0,0,0,0|2,0,0]=3 621 B10R1.14 COC(=O)C1CCC(C1)O MCULE-3475456621 [0,1,0,0,0,0|1,0,0]=2 622 B10R1.14 COC(=O)C1CCN(C1)C MCULE-5692618208 [0,1,0,0,0,0|3,0,0]=4 623 B10R1.14 COC(=O)N1CCC(C1)N MCULE-1748944608 [0,1,0,0,0,0|3,0,0]=4 624 B10R1.14 COC(=O)N1CCC(C1)N MCULE-9370919534 [0,1,0,0,0,0|3,0,0]=4 625 B10R1.14 COC(=O)N1CCC(C1)O MCULE-8351013000 [0,1,0,0,0,0|2,0,0]=3 626 B10R1.14 COC(=O)[C@@H]1C=C[C@@H](C1)N MCULE-1557955760 [0,1,0,0,0,0|2,0,1]=4 627 B10R1.14 COC(=O)[C@@H]1C=C[C@@H](C1)N MCULE-2633681768 [0,1,0,0,0,0|2,0,1]=4 628 B10R1.14 COC(=O)[C@@H]1C=C[C@@H](C1)N MCULE-2703106736 [0,1,0,0,0,0|2,0,1]=4 629 B10R1.14 COC(=O)[C@@H]1C=C[C@@H](C1)N MCULE-3357403391 [0,1,0,0,0,0|2,0,1]=4 630 B10R1.14 COC(=O)[C@@H]1C=C[C@@H](C1)N MCULE-3901735991 [0,1,0,0,0,0|2,0,1]=4 631 B10R1.14 COC(=O)[C@@H]1C=C[C@@H](C1)N MCULE-4745884762 [0,1,0,0,0,0|2,0,1]=4 632 B10R1.14 COC(=O)[C@@H]1C=C[C@@H](C1)N MCULE-8470117371 [0,1,0,0,0,0|2,0,1]=4 633 B10R1.14 COC(=O)[C@@H]1CC(CN1)O MCULE-1283857272 [0,1,0,0,0,0|0,0,0]=1 634 B10R1.14 COC(=O)[C@@H]1CC(CN1)O MCULE-1946068889 [0,1,0,0,0,0|0,0,0]=1 635 B10R1.14 COC(=O)[C@@H]1CCC(=O)C1 MCULE-7952909342 [0,1,0,0,0,0|1,0,2]=4 636 B10R1.14 COC(=O)[C@@H]1CCC(=O)C1 MCULE-8638772412 [0,1,0,0,0,0|1,0,2]=4 637 B10R1.14 COC(=O)[C@@H]1CC[C@@H](C1)N MCULE-5290595526 [0,1,0,0,0,0|2,0,0]=3 638 B10R1.14 COC(=O)[C@@H]1CC[C@@H](C1)N MCULE-5583492414 [0,1,0,0,0,0|2,0,0]=3 639 B10R1.14 COC(=O)[C@@H]1CC[C@@H](C1)N MCULE-7887655347 [0,1,0,0,0,0|2,0,0]=3 640 B10R1.14 COC(=O)[C@@H]1CC[C@@H](C1)N MCULE-8575060963 [0,1,0,0,0,0|2,0,0]=3 641 B10R1.14 COC(=O)[C@@H]1CC[C@@H](C1)O MCULE-2058582855 [0,1,0,0,0,0|1,0,0]=2 642 B10R1.14 COC(=O)[C@@H]1CC[C@@H](C1)O MCULE-5432347510 [0,1,0,0,0,0|1,0,0]=2 643 B10R1.14 COC(=O)[C@@H]1CC[C@H](C1)N MCULE-1643472314 [0,1,0,0,0,0|2,0,0]=3 644 B10R1.14 COC(=O)[C@@H]1CC[C@H](C1)N MCULE-1990922940 [0,1,0,0,0,0|2,0,0]=3 645 B10R1.14 COC(=O)[C@@H]1CC[C@H](C1)N MCULE-6782857130 [0,1,0,0,0,0|2,0,0]=3 646 B10R1.14 COC(=O)[C@@H]1CC[C@H](C1)N MCULE-9884963881 [0,1,0,0,0,0|2,0,0]=3 647 B10R1.14 COC(=O)[C@@H]1CC[C@H](C1)O MCULE-1118474224 [0,1,0,0,0,0|1,0,0]=2 648 B10R1.14 COC(=O)[C@@H]1CC[C@H](C1)O MCULE-9373995272 [0,1,0,0,0,0|1,0,0]=2 649 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)C MCULE-2144317031 [0,1,0,0,0,0|1,0,0]=2 650 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)C MCULE-9538905492 [0,1,0,0,0,0|1,0,0]=2 651 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)Cl MCULE-7224874385 [0,1,0,0,0,0|1,0,0]=2 652 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)F MCULE-2546063017 [0,1,0,0,0,0|1,0,0]=2 653 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)F MCULE-4253971232 [0,1,0,0,0,0|1,0,0]=2 654 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)F MCULE-6284746395 [0,1,0,0,0,0|1,0,0]=2 655 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)F MCULE-9565417654 [0,1,0,0,0,0|1,0,0]=2 656 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)O MCULE-5518895757 [0,1,0,0,0,0|0,0,0]=1 657 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)O MCULE-5601019886 [0,1,0,0,0,0|0,0,0]=1 658 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)O MCULE-7806570596 [0,1,0,0,0,0|0,0,0]=1 659 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)O MCULE-9487428732 [0,1,0,0,0,0|0,0,0]=1 660 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)Cl MCULE-6914923278 [0,1,0,0,0,0|1,0,0]=2 661 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)F MCULE-1505289566 [0,1,0,0,0,0|1,0,0]=2 662 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)F MCULE-4321836109 [0,1,0,0,0,0|1,0,0]=2 663 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)F MCULE-6390890167 [0,1,0,0,0,0|1,0,0]=2 664 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)F MCULE-8073196756 [0,1,0,0,0,0|1,0,0]=2 665 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)N MCULE-5029881504 [0,1,0,0,0,0|1,0,0]=2 666 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)O MCULE-3617032083 [0,1,0,0,0,0|0,0,0]=1 667 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)O MCULE-3763938961 [0,1,0,0,0,0|0,0,0]=1 668 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)O MCULE-4682429159 [0,1,0,0,0,0|0,0,0]=1 669 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)O MCULE-5777795887 [0,1,0,0,0,0|0,0,0]=1 670 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)S MCULE-2723747894 [0,1,0,0,0,0|0,1,0]=2 671 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)S MCULE-2949852995 [0,1,0,0,0,0|0,1,0]=2 672 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)S MCULE-8089855245 [0,1,0,0,0,0|0,1,0]=2 673 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)S MCULE-8209870736 [0,1,0,0,0,0|0,1,0]=2 674 B10R1.14 COC(=O)[C@H]1C=C[C@H](C1)N MCULE-6742670187 [0,1,0,0,0,0|2,0,1]=4 675 B10R1.14 COC(=O)[C@H]1C=C[C@H](C1)N MCULE-9489158988 [0,1,0,0,0,0|2,0,1]=4 676 B10R1.14 COC(=O)[C@H]1C=C[C@H](C1)N MCULE-9823471100 [0,1,0,0,0,0|2,0,1]=4 677 B10R1.14 COC(=O)[C@H]1C=C[C@H](C1)N MCULE-9880567301 [0,1,0,0,0,0|2,0,1]=4 678 B10R1.14 COC(=O)[C@H]1CCC(=O)C1 MCULE-6859943891 [0,1,0,0,0,0|1,0,2]=4 679 B10R1.14 COC(=O)[C@H]1CCC(=O)C1 MCULE-7172592478 [0,1,0,0,0,0|1,0,2]=4 680 B10R1.14 COC(=O)[C@H]1CC[C@@H](C1)Br MCULE-4639654853 [0,1,0,0,0,0|2,0,0]=3 681 B10R1.14 COC(=O)[C@H]1CC[C@@H](C1)Br MCULE-7552610243 [0,1,0,0,0,0|2,0,0]=3 682 B10R1.14 COC(=O)[C@H]1CC[C@@H](C1)N MCULE-3698760557 [0,1,0,0,0,0|2,0,0]=3 683 B10R1.14 COC(=O)[C@H]1CC[C@@H](C1)N MCULE-6035569341 [0,1,0,0,0,0|2,0,0]=3 684 B10R1.14 COC(=O)[C@H]1CC[C@@H](C1)N MCULE-7728824085 [0,1,0,0,0,0|2,0,0]=3 685 B10R1.14 COC(=O)[C@H]1CC[C@@H](C1)N MCULE-9095267083 [0,1,0,0,0,0|2,0,0]=3 686 B10R1.14 COC(=O)[C@H]1CC[C@@H](C1)O MCULE-5555455830 [0,1,0,0,0,0|1,0,0]=2 687 B10R1.14 COC(=O)[C@H]1CC[C@H](C1)N MCULE-1428316255 [0,1,0,0,0,0|2,0,0]=3 688 B10R1.14 COC(=O)[C@H]1CC[C@H](C1)N MCULE-1825834657 [0,1,0,0,0,0|2,0,0]=3 689 B10R1.14 COC(=O)[C@H]1CC[C@H](C1)N MCULE-2834462513 [0,1,0,0,0,0|2,0,0]=3 690 B10R1.14 COC(=O)[C@H]1CC[C@H](C1)N MCULE-5809473178 [0,1,0,0,0,0|2,0,0]=3 691 B10R1.14 COC(=O)[C@H]1CC[C@H](C1)N MCULE-6051273141 [0,1,0,0,0,0|2,0,0]=3 692 B10R1.14 COC(=O)[C@H]1CC[C@H](C1)N MCULE-6835025811 [0,1,0,0,0,0|2,0,0]=3 693 B10R1.14 COC(=O)[C@H]1CC[C@H](C1)O MCULE-5194030962 [0,1,0,0,0,0|1,0,0]=2 694 B10R1.14 COC(=O)[C@H]1CC[C@H](C1)O MCULE-9211450556 [0,1,0,0,0,0|1,0,0]=2 695 B10R1.14 COC(=O)[C@H]1CC[C@H](C1)O MCULE-9901379045 [0,1,0,0,0,0|1,0,0]=2 696 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)F MCULE-1760326276 [0,1,0,0,0,0|1,0,0]=2 697 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)F MCULE-5699214877 [0,1,0,0,0,0|1,0,0]=2 698 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)F MCULE-8843462982 [0,1,0,0,0,0|1,0,0]=2 699 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)F MCULE-8997204113 [0,1,0,0,0,0|1,0,0]=2 700 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)N MCULE-2819941028 [0,1,0,0,0,0|1,0,0]=2 701 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)O MCULE-1245408761 [0,1,0,0,0,0|0,0,0]=1 702 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)O MCULE-3057383638 [0,1,0,0,0,0|0,0,0]=1 703 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)O MCULE-4148644588 [0,1,0,0,0,0|0,0,0]=1 704 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)O MCULE-9267825535 [0,1,0,0,0,0|0,0,0]=1 705 B10R1.14 COC(=O)[C@H]1C[C@H](CN1)F MCULE-3303214665 [0,1,0,0,0,0|1,0,0]=2 706 B10R1.14 COC(=O)[C@H]1C[C@H](CN1)F MCULE-3890802948 [0,1,0,0,0,0|1,0,0]=2 707 B10R1.14 COC(=O)[C@H]1C[C@H](CN1)F MCULE-6610054779 [0,1,0,0,0,0|1,0,0]=2 708 B10R1.14 COC(=O)[C@H]1C[C@H](CN1)F MCULE-7491439068 [0,1,0,0,0,0|1,0,0]=2 709 B10R1.14 COC(=O)[C@H]1C[C@H](CN1)O MCULE-1940578186 [0,1,0,0,0,0|0,0,0]=1 710 B10R1.14 COC(=O)[C@H]1C[C@H](CN1)O MCULE-2778952777 [0,1,0,0,0,0|0,0,0]=1 711 B10R1.14 COC(=O)[C@H]1C[C@H](CN1)O MCULE-5090473531 [0,1,0,0,0,0|0,0,0]=1 712 B10R1.14 COC(=O)[C@H]1C[C@H](CN1)O MCULE-6223710798 [0,1,0,0,0,0|0,0,0]=1 713 B10R1.14 NCC(=O)N1CCC(C1)O MCULE-6061017701 [0,1,0,0,0,0|3,0,0]=4 714 B10R1.14 NCC(=O)N1CCC(C1)O MCULE-9396470411 [0,1,0,0,0,0|3,0,0]=4 715 B10R1.14 O=C(CCl)N1CCC(C1)O MCULE-1014119097 [0,1,0,0,0,0|3,0,0]=4 716 B10R1.14 O=C(CCl)N1CC[C@@H](C1)O MCULE-1149718120 [0,1,0,0,0,0|3,0,0]=4 717 B10R1.14 O=C(CCl)N1CC[C@H](C1)O MCULE-7432440004 [0,1,0,0,0,0|3,0,0]=4 718 B10R1.14 [C@@H]1(CN[C@H](C1)C(=O)OC)F MCULE-5638056091 [0,1,0,0,0,0|1,0,0]=2 719 B10R1.14 [C@@H]1(CN[C@H](C1)C(=O)OC)F MCULE-9779401571 [0,1,0,0,0,0|1,0,0]=2 720 B10R1.14 [C@@H]1(CN[C@H](C1)C(=O)OC)O MCULE-2597929891 [0,1,0,0,0,0|0,0,0]=1 721 B10R1.14 [C@@H]1(CN[C@H](C1)C(=O)OC)O MCULE-4487472832 [0,1,0,0,0,0|0,0,0]=1 722 B10R1.14 [C@H]1(CC[C@H](C1)C(=O)OC)Br MCULE-3396007386 [0,1,0,0,0,0|2,0,0]=3 723 B10R1.14 [C@H]1(CC[C@H](C1)C(=O)OC)N MCULE-4947096311 [0,1,0,0,0,0|2,0,0]=3 724 B10R1.14 [C@H]1(CC[C@H](C1)C(=O)OC)N MCULE-6857998793 [0,1,0,0,0,0|2,0,0]=3 725 B10R1.14 [C@H]1(CC[C@H](C1)C(=O)OC)O MCULE-9908119773 [0,1,0,0,0,0|1,0,0]=2 726 B10R1.31 CC(=O)N1CCC(C1)CO MCULE-5247358570 [0,1,0,0,0,0|3,0,0]=4 727 B10R1.31 CC(=O)N1CC[C@@H](C1)CO MCULE-3163945323 [0,1,0,0,0,0|3,0,0]=4 728 B10R1.31 CC(=O)N1CC[C@@H](C1)CO MCULE-5491599910 [0,1,0,0,0,0|3,0,0]=4 729 B10R1.31 CC(=O)N1CC[C@H](C1)CO MCULE-2897214159 [0,1,0,0,0,0|3,0,0]=4 730 B10R1.31 CCC1CCC(N1)C(=O)O MCULE-9089135115 [0,1,0,0,0,0|3,0,0]=4 731 B10R1.31 CCC1CCC(N1)C(=O)O MCULE-9951781675 [0,1,0,0,0,0|3,0,0]=4 732 B10R1.31 CCN1CCC(C1)C(=O)O MCULE-6987605321 [0,1,0,0,0,0|3,0,0]=4 733 B10R1.31 COC1CCC(C1)C(=O)O MCULE-5189432372 [0,1,0,0,0,0|1,0,0]=2 734 B10R1.31 CO[C@@H]1CN[C@@H](C1)C(=O)O MCULE-2339543928 [0,1,0,0,0,0|0,0,0]=1 735 B10R1.31 CO[C@H]1CC[C@@H](C1)C(=O)O MCULE-8255434197 [0,1,0,0,0,0|1,0,0]=2 736 B10R1.31 CO[C@H]1CC[C@H](C1)C(=O)O MCULE-3942607370 [0,1,0,0,0,0|1,0,0]=2 737 B10R1.31 CO[C@H]1CN[C@@H](C1)C(=O)O MCULE-2951589630 [0,1,0,0,0,0|0,0,0]=1 738 B10R1.31 NC[C@@H]1CN[C@@H](C1)C(=O)O MCULE-2543185174 [0,1,0,0,0,0|1,0,0]=2 739 B10R1.31 NC[C@@H]1CN[C@@H](C1)C(=O)O MCULE-5699643655 [0,1,0,0,0,0|1,0,0]=2 740 B10R1.31 O=C(O)C1CCC(=NO)C1 MCULE-1447348290 [0,1,0,0,0,0|1,0,1]=3 741 B10R1.55 CS(=O)(=O)C1CCC(C1)O MCULE-4996591583 [0,1,0,0,0,0|2,0,1]=4 742 B10R1.58 CN1CC(NC1=O)C(=O)O MCULE-5672121272 [0,1,0,0,0,0|2,0,1]=4 743 B10R1.58 CN1C[C@H](NC1=O)C(=O)O MCULE-2436172057 [0,1,0,0,0,0|2,0,1]=4 744 B10R1.58 CN1C[C@H](NC1=O)C(=O)O MCULE-8618404133 [0,1,0,0,0,0|2,0,1]=4 745 B10R1.58 N[C@@H]1C[C@@H](C[C@H]1O)C(=O)O MCULE-2019095795 [0,1,0,0,0,0|1,0,0]=2 746 B10R1.58 N[C@@H]1C[C@@H](C[C@H]1O)C(=O)O MCULE-7012514700 [0,1,0,0,0,0|1,0,0]=2 747 B10R1.58 O=C(O)C1CC(=O)N(C1)O MCULE-1951815385 [0,1,0,0,0,0|2,0,1]=4 748 B10R1.58 O=C(O)C1CC(C(C1)Br)Br MCULE-6168529373 [0,1,0,0,0,0|2,0,0]=3 749 B10R1.58 O=C(O)[C@@H]1C[C@H](C(=O)N1)F MCULE-3594620408 [0,1,0,0,0,0|1,0,1]=3 750 B10R1.58 O=C(O)[C@@H]1C[C@H](C(=O)N1)F MCULE-7616817872 [0,1,0,0,0,0|1,0,1]=3 751 B10R1.58 O=C1NC(CC1F)C(=O)O MCULE-5782471146 [0,1,0,0,0,0|1,0,1]=3 752 B10R1.58 O=C1N[C@@H](C[C@@H]1F)C(=O)O MCULE-5667846232 [0,1,0,0,0,0|1,0,1]=3 753 B10R1.58 O=C1N[C@@H](C[C@@H]1F)C(=O)O MCULE-8319847079 [0,1,0,0,0,0|1,0,1]=3 754 B10R1.59 C=C1C[C@@H]([C@@H](C1)C(=O)O)N MCULE-9822470688 [0,1,0,0,0,0|2,0,1]=4 755 B10R1.59 CC1CC(C(=O)O1)C(=O)O MCULE-5538965549 [0,1,0,0,0,0|3,0,0]=4 756 B10R1.59 CC1CC(C(O1)C(=O)O)C MCULE-6609295709 [0,1,0,0,0,0|3,0,0]=4 757 B10R1.59 CC1CC(C(O1)C)C(=O)O MCULE-4495071251 [0,1,0,0,0,0|3,0,0]=4 758 B10R1.59 CC1CC(N(C1)C)C(=O)O MCULE-1544526499 [0,1,0,0,0,0|1,0,0]=2 759 B10R1.59 CC1CC(N(C1)C)C(=O)O MCULE-4035906246 [0,1,0,0,0,0|1,0,0]=2 760 B10R1.59 CN1CC(CC1C(=O)O)N MCULE-7362090633 [0,1,0,0,0,0|1,0,0]=2 761 B10R1.59 CN1CC(CC1C(=O)O)O MCULE-6963505872 [0,1,0,0,0,0|0,0,0]=1 762 B10R1.59 CN1C[C@@H](C[C@@H]1C(=O)O)O MCULE-7645006550 [0,1,0,0,0,0|0,0,0]=1 763 B10R1.59 CN1C[C@@H](C[C@H]1C(=O)O)F MCULE-1701571164 [0,1,0,0,0,0|1,0,0]=2 764 B10R1.59 CN1C[C@@H](C[C@H]1C(=O)O)F MCULE-3801669792 [0,1,0,0,0,0|1,0,0]=2 765 B10R1.59 CN1C[C@@H](C[C@H]1C(=O)O)O MCULE-4289101461 [0,1,0,0,0,0|0,0,0]=1 766 B10R1.59 CN1C[C@@H](C[C@H]1C(=O)O)O MCULE-5652344615 [0,1,0,0,0,0|0,0,0]=1 767 B10R1.59 CN1C[C@H](C[C@@H]1C(=O)O)O MCULE-4231676044 [0,1,0,0,0,0|0,0,0]=1 768 B10R1.59 CN1C[C@H](C[C@H]1C(=O)O)N MCULE-7565756526 [0,1,0,0,0,0|1,0,0]=2 769 B10R1.59 CN1C[C@H](C[C@H]1C(=O)O)N MCULE-8931908939 [0,1,0,0,0,0|1,0,0]=2 770 B10R1.59 CN1C[C@H](C[C@H]1C(=O)O)O MCULE-2551559641 [0,1,0,0,0,0|0,0,0]=1 771 B10R1.59 CN1C[C@H](C[C@H]1C(=O)O)O MCULE-4981449681 [0,1,0,0,0,0|0,0,0]=1 772 B10R1.59 CN1NC(=O)CC1C(=O)O MCULE-1720509184 [0,1,0,0,0,0|1,0,2]=4 773 B10R1.59 CN1NC(=O)CC1C(=O)O MCULE-3806344360 [0,1,0,0,0,0|1,0,2]=4 774 B10R1.59 C[C@@H]1C[C@H](N(C1)C)C(=O)O MCULE-3249388528 [0,1,0,0,0,0|1,0,0]=2 775 B10R1.59 C[C@@H]1C[C@H](N(C1)C)C(=O)O MCULE-5892295670 [0,1,0,0,0,0|1,0,0]=2 776 B10R1.59 C[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-1379494499 [0,1,0,0,0,0|1,0,0]=2 777 B10R1.59 C[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-1502363575 [0,1,0,0,0,0|1,0,0]=2 778 B10R1.59 C[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-1565262465 [0,1,0,0,0,0|1,0,0]=2 779 B10R1.59 C[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-4515635703 [0,1,0,0,0,0|1,0,0]=2 780 B10R1.59 O=C(O)N1CC(CC1=O)O MCULE-8810484712 [0,1,0,0,0,0|2,0,0]=3 781 B10R1.59 [C@H]1(C[C@H](CN1C)C)C(=O)O MCULE-6457651208 [0,1,0,0,0,0|1,0,0]=2 782 B10R1.194 CC(=O)C1COC(C1C)O MCULE-2166954588 [0,1,0,0,0,0|3,0,0]=4 783 B10R1.194 CC1C(CCN1C)C(=O)O MCULE-3080880087 [0,1,0,0,0,0|3,0,0]=4 784 B10R1.194 CC1C(CCN1C)C(=O)O MCULE-8463571511 [0,1,0,0,0,0|3,0,0]=4 785 B10R1.194 CC1CCC(N1C)C(=O)O MCULE-1631473352 [0,1,0,0,0,0|3,0,0]=4 786 B10R1.194 C[C@@H]1CC[C@H](N1C)C(=O)O MCULE-5064787674 [0,1,0,0,0,0|3,0,0]=4 787 B10R1.194 C[C@@H]1CC[C@H](N1C)C(=O)O MCULE-5375480697 [0,1,0,0,0,0|3,0,0]=4 788 B10R1.194 C[C@@H]1[C@@H](CCN1C)C(=O)O MCULE-1037781010 [0,1,0,0,0,0|3,0,0]=4 789 B10R1.194 C[C@@H]1[C@@H](CCN1C)C(=O)O MCULE-5608694177 [0,1,0,0,0,0|3,0,0]=4 790 B10R1.194 C[C@H]1CC[C@H](N1C)C(=O)O MCULE-2143702379 [0,1,0,0,0,0|3,0,0]=4 791 B10R1.194 C[C@H]1CC[C@H](N1C)C(=O)O MCULE-3730566868 [0,1,0,0,0,0|3,0,0]=4 792 B10R1.194 C[C@H]1CC[C@H](N1C)C(=O)O MCULE-7974927719 [0,1,0,0,0,0|3,0,0]=4 793 B10R1.194 C[C@H]1CC[C@H](N1C)C(=O)O MCULE-9806319171 [0,1,0,0,0,0|3,0,0]=4 794 B10R1.359 C1(CC(CN1)(F)F)C(=O)N MCULE-3572063756 [0,1,0,0,0,0|2,0,0]=3 795 B10R1.359 C1(CC(CN1)(F)F)C(=O)N MCULE-9418751339 [0,1,0,0,0,0|2,0,0]=3 796 B10R1.359 C1(CC(CN1)(F)F)C(=O)O MCULE-2953204230 [0,1,0,0,0,0|1,0,0]=2 797 B10R1.359 C1(CC(CN1)(F)F)C(=O)O MCULE-4110303624 [0,1,0,0,0,0|1,0,0]=2 798 B10R1.359 CC(=O)C1CCC(C1)(F)F MCULE-5021812467 [0,1,0,0,0,0|3,0,0]=4 799 B10R1.359 CC(=O)N1CCC(C1)(C)O MCULE-8587632489 [0,1,0,0,0,0|3,0,0]=4 800 B10R1.359 CC(=O)[C@H]1CCC(C1)(F)F MCULE-6481522414 [0,1,0,0,0,0|3,0,0]=4 801 B10R1.359 CC1(CC(CO1)C(=O)O)C MCULE-2939144976 [0,1,0,0,0,0|3,0,0]=4 802 B10R1.359 CC1(CCC(C1)C(=O)O)C MCULE-9978136872 [0,1,0,0,0,0|2,0,0]=3 803 B10R1.359 CC1(CCC(N1)C(=O)O)C MCULE-5310172848 [0,1,0,0,0,0|3,0,0]=4 804 B10R1.359 CC1(CCC(N1)C(=O)O)C MCULE-5921965282 [0,1,0,0,0,0|3,0,0]=4 805 B10R1.359 CC1(CCC(O1)C(=O)O)C MCULE-6347581531 [0,1,0,0,0,0|3,0,0]=4 806 B10R1.359 CC1(CNC(C1)C(=O)O)C MCULE-3559457457 [0,1,0,0,0,0|1,0,0]=2 807 B10R1.359 CC1(CNC(C1)C(=O)O)C MCULE-4286050645 [0,1,0,0,0,0|1,0,0]=2 808 B10R1.359 CC1(CN[C@@H](C1)C(=O)O)C MCULE-2704032687 [0,1,0,0,0,0|1,0,0]=2 809 B10R1.359 CC1(CN[C@@H](C1)C(=O)O)C MCULE-3701263335 [0,1,0,0,0,0|1,0,0]=2 810 B10R1.359 CC1(CN[C@@H](C1)C(=O)O)C MCULE-5777695775 [0,1,0,0,0,0|1,0,0]=2 811 B10R1.359 CC1(CN[C@@H](C1)C(=O)O)C MCULE-7930268339 [0,1,0,0,0,0|1,0,0]=2 812 B10R1.359 CC1(CN[C@H](C1)C(=O)O)C MCULE-5601172836 [0,1,0,0,0,0|1,0,0]=2 813 B10R1.359 CC1(CN[C@H](C1)C(=O)O)C MCULE-5795533452 [0,1,0,0,0,0|1,0,0]=2 814 B10R1.359 CC1(CN[C@H](C1)C(=O)O)C MCULE-6871769907 [0,1,0,0,0,0|1,0,0]=2 815 B10R1.359 CC1(COC(C1)C(=O)O)C MCULE-3465757314 [0,1,0,0,0,0|2,0,0]=3 816 B10R1.359 NC(=O)C1CC(CN1)(F)F MCULE-3386184862 [0,1,0,0,0,0|2,0,0]=3 817 B10R1.359 NC(=O)C1CC(CN1)(F)F MCULE-7587095498 [0,1,0,0,0,0|2,0,0]=3 818 B10R1.359 NC(=O)[C@@H]1CC(CN1)(F)F MCULE-5347034095 [0,1,0,0,0,0|2,0,0]=3 819 B10R1.359 NC(=O)[C@@H]1CC(CN1)(F)F MCULE-5765717202 [0,1,0,0,0,0|2,0,0]=3 820 B10R1.359 NC(=O)[C@@H]1CC(CN1)(F)F MCULE-5955733071 [0,1,0,0,0,0|2,0,0]=3 821 B10R1.359 NC(=O)[C@@H]1CC(CN1)(F)F MCULE-6363195996 [0,1,0,0,0,0|2,0,0]=3 822 B10R1.359 NC(=O)[C@@H]1CC(CN1)(F)F MCULE-6591467450 [0,1,0,0,0,0|2,0,0]=3 823 B10R1.359 NC(=O)[C@@H]1CC(CN1)(F)F MCULE-6778984360 [0,1,0,0,0,0|2,0,0]=3 824 B10R1.359 NC(=O)[C@H]1CC(CN1)(F)F MCULE-1821278703 [0,1,0,0,0,0|2,0,0]=3 825 B10R1.359 NC(=O)[C@H]1CC(CN1)(F)F MCULE-5924357750 [0,1,0,0,0,0|2,0,0]=3 826 B10R1.359 NC(=O)[C@H]1CC(CN1)(F)F MCULE-6367192550 [0,1,0,0,0,0|2,0,0]=3 827 B10R1.359 NC(=O)[C@H]1CC(CN1)(F)F MCULE-9121304614 [0,1,0,0,0,0|2,0,0]=3 828 B10R1.359 O=C(O)C1CC(CN1)(F)F MCULE-2199319897 [0,1,0,0,0,0|1,0,0]=2 829 B10R1.359 O=C(O)C1CC(CN1)(F)F MCULE-2586326597 [0,1,0,0,0,0|1,0,0]=2 830 B10R1.359 O=C(O)C1CC(CN1)(F)F MCULE-3828268777 [0,1,0,0,0,0|1,0,0]=2 831 B10R1.359 O=C(O)C1CCC(C1)(F)F MCULE-3866141496 [0,1,0,0,0,0|2,0,0]=3 832 B10R1.359 O=C(O)C1CCC(C1)(F)F MCULE-9447411120 [0,1,0,0,0,0|2,0,0]=3 833 B10R1.359 O=C(O)C1CCS(=O)(=O)C1 MCULE-3551776261 [0,1,0,0,0,0|2,0,1]=4 834 B10R1.359 O=C(O)[C@@H]1CC(CN1)(F)F MCULE-2937959665 [0,1,0,0,0,0|1,0,0]=2 835 B10R1.359 O=C(O)[C@@H]1CC(CN1)(F)F MCULE-3681935460 [0,1,0,0,0,0|1,0,0]=2 836 B10R1.359 O=C(O)[C@@H]1CC(CN1)(F)F MCULE-4375321400 [0,1,0,0,0,0|1,0,0]=2 837 B10R1.359 O=C(O)[C@@H]1CC(CN1)(F)F MCULE-5689630052 [0,1,0,0,0,0|1,0,0]=2 838 B10R1.359 O=C(O)[C@@H]1CC(CN1)(F)F MCULE-6005973714 [0,1,0,0,0,0|1,0,0]=2 839 B10R1.359 O=C(O)[C@@H]1CC(CN1)(F)F MCULE-6623135745 [0,1,0,0,0,0|1,0,0]=2 840 B10R1.359 O=C(O)[C@@H]1CCC(C1)(F)F MCULE-1982062527 [0,1,0,0,0,0|2,0,0]=3 841 B10R1.359 O=C(O)[C@@H]1CCC(C1)(F)F MCULE-8436417104 [0,1,0,0,0,0|2,0,0]=3 842 B10R1.359 O=C(O)[C@H]1CC(CN1)(F)F MCULE-1798729548 [0,1,0,0,0,0|1,0,0]=2 843 B10R1.359 O=C(O)[C@H]1CC(CN1)(F)F MCULE-3144994706 [0,1,0,0,0,0|1,0,0]=2 844 B10R1.359 O=C(O)[C@H]1CC(CN1)(F)F MCULE-5393615017 [0,1,0,0,0,0|1,0,0]=2 845 B10R1.359 O=C(O)[C@H]1CC(CN1)(F)F MCULE-9844310114 [0,1,0,0,0,0|1,0,0]=2 846 B10R1.359 O=C(O)[C@H]1CCC(C1)(F)F MCULE-1884661502 [0,1,0,0,0,0|2,0,0]=3 847 B10R1.359 O=C(O)[C@H]1CCC(C1)(F)F MCULE-4373169739 [0,1,0,0,0,0|2,0,0]=3 848 B10R1.470 CC1(CC(CN1)O)C(=O)O MCULE-1962390815 [0,1,0,0,0,0|0,0,0]=1 849 B10R1.470 CC1(CC(CN1)O)C(=O)O MCULE-3381499671 [0,1,0,0,0,0|0,0,0]=1 850 B10R1.470 CC1(CCC(=O)C1)C(=O)O MCULE-8301527257 [0,1,0,0,0,0|1,0,2]=4 851 B10R1.470 CC1(CCC(C1)N)C(=O)O MCULE-5009717504 [0,1,0,0,0,0|2,0,0]=3 852 B10R1.470 CC1(CCC(C1)N)C(=O)O MCULE-6646895058 [0,1,0,0,0,0|2,0,0]=3 853 B10R1.470 CC1CCC(C1)(C)C(=O)O MCULE-3638409630 [0,1,0,0,0,0|2,0,0]=3 854 B10R1.470 CN1CCC(C1)(C)C(=O)O MCULE-3111826192 [0,1,0,0,0,0|3,0,0]=4 855 B10R1.470 CN1CCC(C1)(F)C(=O)O MCULE-3877912842 [0,1,0,0,0,0|3,0,0]=4 856 B10R1.470 NC1CCC(C1)(F)C(=O)O MCULE-1564321784 [0,1,0,0,0,0|2,0,0]=3 857 B10R1.470 NC1CCC(C1)(F)C(=O)O MCULE-3542104690 [0,1,0,0,0,0|2,0,0]=3 858 B8R0.8 C#CCOC(C)C(=O)O MCULE-7792481116 [0,0,1,0,0,0|2,0,1]=4 859 B8R0.8 C=CCCC(C)C(=O)O MCULE-3089071984 [0,0,1,0,0,0|2,0,1]=4 860 B8R0.8 C=CCOC(C)C(=O)O MCULE-4801958900 [0,0,1,0,0,0|2,0,1]=4 861 B8R0.8 C=CCSC(C)C(=O)O MCULE-4683246165 [0,0,1,0,0,0|2,0,1]=4 862 B8R0.8 CC(CCCCl)C(=O)O MCULE-6504631587 [0,0,1,0,0,0|2,0,0]=3 863 B8R0.8 CC(OCCN)C(=O)O MCULE-4117277894 [0,0,1,0,0,0|2,0,0]=3 864 B8R0.8 CC(OCCN)C(=O)O MCULE-6407651037 [0,0,1,0,0,0|2,0,0]=3 865 B8R0.8 CC(OCCO)C(=O)O MCULE-4305620136 [0,0,1,0,0,0|1,0,0]=2 866 B8R0.8 CCC/C=C(\C)/C(=O)O MCULE-4080682767 [0,0,1,0,0,0|2,0,1]=4 867 B8R0.8 CCCC=C(C)C(=O)O MCULE-1072900673 [0,0,1,0,0,0|2,0,1]=4 868 B8R0.8 CCCCC(Br)C(=O)O MCULE-5428502537 [0,0,1,0,0,0|3,0,0]=4 869 B8R0.8 CCCCC(C)C(=O)C MCULE-2303839464 [0,0,1,0,0,0|3,0,0]=4 870 B8R0.8 CCCCC(C)C(=O)Cl MCULE-1718383314 [0,0,1,0,0,0|3,0,0]=4 871 B8R0.8 CCCCC(C)C(=O)N MCULE-6062124512 [0,0,1,0,0,0|3,0,0]=4 872 B8R0.8 CCCCC(C)C(=O)O MCULE-7933263354 [0,0,1,0,0,0|2,0,0]=3 873 B8R0.8 CCCCC(F)C(=O)O MCULE-2276381656 [0,0,1,0,0,0|3,0,0]=4 874 B8R0.8 CCCCC(N)C(=O)O MCULE-4930484202 [0,0,1,0,0,0|3,0,0]=4 875 B8R0.8 CCCCC(O)C(=O)O MCULE-2557585903 [0,0,1,0,0,0|3,0,0]=4 876 B8R0.8 CCCC[C@@H](C)C(=O)O MCULE-3454696473 [0,0,1,0,0,0|2,0,0]=3 877 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-3687527484 [0,0,1,0,0,0|3,0,0]=4 878 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-9410581572 [0,0,1,0,0,0|3,0,0]=4 879 B8R0.8 CCCC[C@H](C)C(=O)O MCULE-9016844851 [0,0,1,0,0,0|2,0,0]=3 880 B8R0.8 CCCC[C@H](C)C(=O)O MCULE-9437190196 [0,0,1,0,0,0|2,0,0]=3 881 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-3656145338 [0,0,1,0,0,0|3,0,0]=4 882 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-7427914532 [0,0,1,0,0,0|3,0,0]=4 883 B8R0.8 CCCNC(=O)C(=O)O MCULE-6074987864 [0,0,1,0,0,0|2,0,1]=4 884 B8R0.8 CCCOC(C)C(=O)O MCULE-4477829415 [0,0,1,0,0,0|2,0,0]=3 885 B8R0.8 CCNCC(C)C(=O)O MCULE-3863191122 [0,0,1,0,0,0|3,0,0]=4 886 B8R0.8 CCNCC(C)C(=O)O MCULE-4164323563 [0,0,1,0,0,0|3,0,0]=4 887 B8R0.8 CCOCC(C)C(=O)O MCULE-5346959026 [0,0,1,0,0,0|3,0,0]=4 888 B8R0.8 COCCC(C)C(=O)O MCULE-5066180613 [0,0,1,0,0,0|3,0,0]=4 889 B8R0.8 NC(CCCO)C(=O)O MCULE-5421732564 [0,0,1,0,0,0|2,0,0]=3 890 B8R0.8 NCCCC(N)C(=O)O MCULE-1970642620 [0,0,1,0,0,0|3,0,0]=4 891 B8R0.8 NCCCC(N)C(=O)O MCULE-4486209373 [0,0,1,0,0,0|3,0,0]=4 892 B8R0.8 NCCCC(N)C(=O)O MCULE-8193724048 [0,0,1,0,0,0|3,0,0]=4 893 B8R0.8 NCCCC(N)C(=O)O MCULE-9223414094 [0,0,1,0,0,0|3,0,0]=4 894 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-1634156072 [0,0,1,0,0,0|3,0,0]=4 895 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2602820298 [0,0,1,0,0,0|3,0,0]=4 896 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2719848774 [0,0,1,0,0,0|3,0,0]=4 897 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-8413545449 [0,0,1,0,0,0|3,0,0]=4 898 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2588005079 [0,0,1,0,0,0|3,0,0]=4 899 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2852667696 [0,0,1,0,0,0|3,0,0]=4 900 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-3029872280 [0,0,1,0,0,0|3,0,0]=4 901 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-4242810787 [0,0,1,0,0,0|3,0,0]=4 902 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-6924538097 [0,0,1,0,0,0|3,0,0]=4 903 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-8642266626 [0,0,1,0,0,0|3,0,0]=4 904 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9352931710 [0,0,1,0,0,0|3,0,0]=4 905 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9532999202 [0,0,1,0,0,0|3,0,0]=4 906 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-3220645027 [0,0,1,0,0,0|2,0,0]=3 907 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-4608316868 [0,0,1,0,0,0|2,0,0]=3 908 B8R0.8 O=C(O)C(O)CCCO MCULE-9386031706 [0,0,1,0,0,0|2,0,0]=3 909 B8R0.8 O=C([O-])C(O)CCCO MCULE-5137868319 [0,0,1,0,0,0|2,0,1]=4 910 B8R0.9 C=CC(N)CCC(=O)O MCULE-3453656580 [0,0,1,0,0,0|2,0,1]=4 911 B8R0.9 C=CC(N)CCC(=O)O MCULE-4435406748 [0,0,1,0,0,0|2,0,1]=4 912 B8R0.9 C=C[C@@H](N)CCC(=O)O MCULE-5470042954 [0,0,1,0,0,0|2,0,1]=4 913 B8R0.9 C=C[C@@H](N)CCC(=O)O MCULE-9017090012 [0,0,1,0,0,0|2,0,1]=4 914 B8R0.9 C=C[C@H](N)CCC(=O)O MCULE-4615585642 [0,0,1,0,0,0|2,0,1]=4 915 B8R0.9 CC(=O)NCC(C)CN MCULE-6305271563 [0,0,1,0,0,0|3,0,0]=4 916 B8R0.9 CC(=O)NCC(O)CCl MCULE-4912177314 [0,0,1,0,0,0|3,0,0]=4 917 B8R0.9 CC(=O)NC[C@H](O)CCl MCULE-5027407972 [0,0,1,0,0,0|3,0,0]=4 918 B8R0.9 CC(=O)OCC(O)CCl MCULE-3591995437 [0,0,1,0,0,0|3,0,0]=4 919 B8R0.9 CC(=O)OCC(O)CO MCULE-7518673015 [0,0,1,0,0,0|3,0,0]=4 920 B8R0.9 CC(C#N)CCC(=O)O MCULE-6867167636 [0,0,1,0,0,0|1,0,2]=4 921 B8R0.9 CC(CCl)CCC(=O)Cl MCULE-3716923938 [0,0,1,0,0,0|3,0,0]=4 922 B8R0.9 CCC(=O)CCC(=O)O MCULE-4505750030 [0,0,1,0,0,0|1,0,2]=4 923 B8R0.9 CCC(C)CCC(=O)C MCULE-6498666006 [0,0,1,0,0,0|3,0,0]=4 924 B8R0.9 CCC(C)CCC(=O)O MCULE-9270270979 [0,0,1,0,0,0|2,0,0]=3 925 B8R0.9 CCC(C)NCC(=O)O MCULE-1578825700 [0,0,1,0,0,0|3,0,0]=4 926 B8R0.9 CCC(C)NCC(=O)O MCULE-8981987872 [0,0,1,0,0,0|3,0,0]=4 927 B8R0.9 CCC(C)OCC(=O)O MCULE-8235265405 [0,0,1,0,0,0|3,0,0]=4 928 B8R0.9 CCC(Cl)CCC(=O)Cl MCULE-3849391288 [0,0,1,0,0,0|3,0,0]=4 929 B8R0.9 CCC(N)CCC(=O)O MCULE-3116763773 [0,0,1,0,0,0|2,0,0]=3 930 B8R0.9 CCC(N)CCC(=O)O MCULE-9126260921 [0,0,1,0,0,0|2,0,0]=3 931 B8R0.9 CCC(O)CCC(=O)O MCULE-1512608136 [0,0,1,0,0,0|1,0,0]=2 932 B8R0.9 CCC(O)CCC(=O)[O-] MCULE-6831827135 [0,0,1,0,0,0|1,0,1]=3 933 B8R0.9 CCN(C)CCC(=O)O MCULE-2510720087 [0,0,1,0,0,0|3,0,0]=4 934 B8R0.9 CCN(C)CCC(=O)O MCULE-4192684079 [0,0,1,0,0,0|3,0,0]=4 935 B8R0.9 CCS(=O)CCC(=O)O MCULE-4027618720 [0,0,1,0,0,0|2,0,1]=4 936 B8R0.9 COC(C)CCC(=O)O MCULE-5873043454 [0,0,1,0,0,0|3,0,0]=4 937 B8R0.9 CSC(C)CCC(=O)O MCULE-3505570511 [0,0,1,0,0,0|3,0,0]=4 938 B8R0.9 NCC(=O)CCC(=O)O MCULE-6371115085 [0,0,1,0,0,0|0,0,2]=3 939 B8R0.9 NCC(=O)CCC(=O)O MCULE-8125179397 [0,0,1,0,0,0|0,0,2]=3 940 B8R0.9 NCC(=O)CCC(=O)O MCULE-8676354165 [0,0,1,0,0,0|0,0,2]=3 941 B8R0.9 NCC(=O)NCC(=O)O MCULE-1239116894 [0,0,1,0,0,0|1,0,2]=4 942 B8R0.9 NCC(=O)NCC(=O)O MCULE-2139302839 [0,0,1,0,0,0|1,0,2]=4 943 B8R0.9 NCC(N)CCC(=O)O MCULE-1054409990 [0,0,1,0,0,0|1,0,0]=2 944 B8R0.9 NC[C@@H](N)CCC(=O)O MCULE-2916881042 [0,0,1,0,0,0|1,0,0]=2 945 B8R0.9 NC[C@@H](N)CCC(=O)O MCULE-7249154843 [0,0,1,0,0,0|1,0,0]=2 946 B8R0.9 NNC(=O)CCC(=O)O MCULE-7643180740 [0,0,1,0,0,0|1,0,2]=4 947 B8R0.9 NNC(=O)CCC(=O)O MCULE-9888193887 [0,0,1,0,0,0|1,0,2]=4 948 B8R0.9 N[C@H](CO)CCC(=O)O MCULE-1233079264 [0,0,1,0,0,0|2,0,0]=3 949 B8R0.9 N[C@H](CO)CCC(=O)O MCULE-8091475267 [0,0,1,0,0,0|2,0,0]=3 950 B8R0.9 O=C(O)CCC(=O)CBr MCULE-8373387398 [0,0,1,0,0,0|1,0,2]=4 951 B8R0.9 O=C(O)CCP(=O)CO MCULE-3163541128 [0,0,1,0,0,0|2,0,1]=4 952 B8R0.15 C=CCC(CC)C(=O)O MCULE-8599414655 [0,0,1,0,0,0|2,0,1]=4 953 B8R0.15 CCC(CCN)C(=O)O MCULE-3540595708 [0,0,1,0,0,0|2,0,0]=3 954 B8R0.15 CCC(CCN)C(=O)O MCULE-6369668711 [0,0,1,0,0,0|2,0,0]=3 955 B8R0.15 CCCC(C#N)C(=O)O MCULE-8231205596 [0,0,1,0,0,0|3,0,0]=4 956 B8R0.15 CCCC(CC)C(=O)C MCULE-3483794250 [0,0,1,0,0,0|3,0,0]=4 957 B8R0.15 CCCC(CC)C(=O)O MCULE-2070546888 [0,0,1,0,0,0|2,0,0]=3 958 B8R0.15 CCCC(CO)C(=O)O MCULE-2653026260 [0,0,1,0,0,0|3,0,0]=4 959 B8R0.15 CCCC(NC)C(=O)O MCULE-5292420123 [0,0,1,0,0,0|1,0,0]=2 960 B8R0.15 CCCC(NC)C(=O)O MCULE-5734283547 [0,0,1,0,0,0|1,0,0]=2 961 B8R0.15 CCCC(NC)C(=O)O MCULE-9559460593 [0,0,1,0,0,0|1,0,0]=2 962 B8R0.15 CCCC(NO)C(=O)O MCULE-7484331195 [0,0,1,0,0,0|2,0,0]=3 963 B8R0.15 CCCC(OC)C(=O)O MCULE-6875744280 [0,0,1,0,0,0|2,0,0]=3 964 B8R0.15 CCC[C@@H](NC)C(=O)O MCULE-3394704356 [0,0,1,0,0,0|1,0,0]=2 965 B8R0.15 CCC[C@@H](NC)C(=O)O MCULE-8140893147 [0,0,1,0,0,0|1,0,0]=2 966 B8R0.15 CCC[C@H](CO)C(=O)O MCULE-1805025355 [0,0,1,0,0,0|3,0,0]=4 967 B8R0.15 CCC[C@H](CO)C(=O)O MCULE-3449491143 [0,0,1,0,0,0|3,0,0]=4 968 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-1028689544 [0,0,1,0,0,0|1,0,0]=2 969 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-4848752673 [0,0,1,0,0,0|1,0,0]=2 970 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-5585839502 [0,0,1,0,0,0|1,0,0]=2 971 B8R0.15 CCC[C@H](NO)C(=O)O MCULE-7455558431 [0,0,1,0,0,0|2,0,0]=3 972 B8R0.15 CCOC(CC)C(=O)O MCULE-1674742787 [0,0,1,0,0,0|3,0,0]=4 973 B8R0.15 CNC(CCN)C(=O)N MCULE-4176706453 [0,0,1,0,0,0|2,0,0]=3 974 B8R0.15 CNC(CCN)C(=O)O MCULE-6687313255 [0,0,1,0,0,0|1,0,0]=2 975 B8R0.15 CNC(COC)C(=O)N MCULE-9124173069 [0,0,1,0,0,0|3,0,0]=4 976 B8R0.15 CNC(COC)C(=O)O MCULE-4091913769 [0,0,1,0,0,0|2,0,0]=3 977 B8R0.15 CNC(COC)C(=O)O MCULE-6745647660 [0,0,1,0,0,0|2,0,0]=3 978 B8R0.15 CN[C@@H](CCO)C(=O)O MCULE-4209872941 [0,0,1,0,0,0|0,0,0]=1 979 B8R0.15 CN[C@@H](CCO)C(=O)O MCULE-7202916887 [0,0,1,0,0,0|0,0,0]=1 980 B8R0.15 CN[C@@H](COC)C(=O)N MCULE-2651499559 [0,0,1,0,0,0|3,0,0]=4 981 B8R0.15 CN[C@@H](COC)C(=O)N MCULE-2761071254 [0,0,1,0,0,0|3,0,0]=4 982 B8R0.15 CN[C@H](CCO)C(=O)O MCULE-1874728709 [0,0,1,0,0,0|0,0,0]=1 983 B8R0.15 CN[C@H](CCO)C(=O)O MCULE-3716592032 [0,0,1,0,0,0|0,0,0]=1 984 B8R0.15 COC(CCN)C(=O)N MCULE-4310174639 [0,0,1,0,0,0|3,0,0]=4 985 B8R0.15 COC(CCN)C(=O)O MCULE-1510512790 [0,0,1,0,0,0|2,0,0]=3 986 B8R0.15 COCC(OC)C(=O)O MCULE-5776685365 [0,0,1,0,0,0|3,0,0]=4 987 B8R0.23 C(N)(CC(C)C)C(=O)O MCULE-7664540924 [0,0,1,0,0,0|1,0,0]=2 988 B8R0.23 C(N)(CS(=O)C)C(=O)O MCULE-3320985154 [0,0,1,0,0,0|1,0,1]=3 989 B8R0.23 C=C(Br)CC(N)C(=O)O MCULE-2311003313 [0,0,1,0,0,0|1,0,2]=4 990 B8R0.23 C=C(Br)C[C@@H](N)C(=O)O MCULE-2061865879 [0,0,1,0,0,0|1,0,2]=4 991 B8R0.23 C=C(Br)C[C@@H](N)C(=O)O MCULE-6617690939 [0,0,1,0,0,0|1,0,2]=4 992 B8R0.23 C=C(Br)C[C@H](N)C(=O)O MCULE-2602336550 [0,0,1,0,0,0|1,0,2]=4 993 B8R0.23 C=C(Br)C[C@H](N)C(=O)O MCULE-9274484893 [0,0,1,0,0,0|1,0,2]=4 994 B8R0.23 C=C(C)CC(C)C(=O)O MCULE-7268483710 [0,0,1,0,0,0|2,0,1]=4 995 B8R0.23 C=C(C)CC(N)C(=O)O MCULE-5915882776 [0,0,1,0,0,0|1,0,1]=3 996 B8R0.23 C=C(C)C[C@@H](N)C(=O)O MCULE-2841714882 [0,0,1,0,0,0|1,0,1]=3 997 B8R0.23 C=C(C)C[C@H](C)C(=O)O MCULE-9053114079 [0,0,1,0,0,0|2,0,1]=4 998 B8R0.23 C=C(C)C[C@H](N)C(=O)O MCULE-1029058491 [0,0,1,0,0,0|1,0,1]=3 999 B8R0.23 C=C(C)C[C@H](N)C(=O)O MCULE-6974720260 [0,0,1,0,0,0|1,0,1]=3 1000 B8R0.23 C=C(CC(C)C)C(=O)O MCULE-5929811654 [0,0,1,0,0,0|2,0,1]=4 1001 B8R0.23 C=C(Cl)CC(N)C(=O)O MCULE-3498417929 [0,0,1,0,0,0|1,0,2]=4 1002 B8R0.23 C=C(Cl)CC(N)C(=O)O MCULE-7451890779 [0,0,1,0,0,0|1,0,2]=4 1003 B8R0.23 CC(=O)C(C)CC(C)C MCULE-9956513410 [0,0,1,0,0,0|3,0,0]=4 1004 B8R0.23 CC(=O)C(N)CC(=O)O MCULE-7043175556 [0,0,1,0,0,0|2,0,1]=4 1005 B8R0.23 CC(=O)C(N)CC(C)C MCULE-2548441556 [0,0,1,0,0,0|2,0,0]=3 1006 B8R0.23 CC(=O)CC(C)C(=O)O MCULE-4640477792 [0,0,1,0,0,0|1,0,2]=4 1007 B8R0.23 CC(=O)CC(N)C(=O)O MCULE-6275652695 [0,0,1,0,0,0|0,0,2]=3 1008 B8R0.23 CC(=O)CC(N)C(=O)O MCULE-6690241894 [0,0,1,0,0,0|0,0,2]=3 1009 B8R0.23 CC(=O)CC(O)C(=O)O MCULE-4728629069 [0,0,1,0,0,0|1,0,2]=4 1010 B8R0.23 CC(C)CC(=O)C(=O)O MCULE-4155006996 [0,0,1,0,0,0|2,0,1]=4 1011 B8R0.23 CC(C)CC(Br)C(=O)O MCULE-2778142655 [0,0,1,0,0,0|2,0,0]=3 1012 B8R0.23 CC(C)CC(Br)C(=O)O MCULE-7689846956 [0,0,1,0,0,0|2,0,0]=3 1013 B8R0.23 CC(C)CC(C)C(=O)O MCULE-7217536279 [0,0,1,0,0,0|2,0,0]=3 1014 B8R0.23 CC(C)CC(Cl)C(=O)O MCULE-6347367806 [0,0,1,0,0,0|2,0,0]=3 1015 B8R0.23 CC(C)CC(F)C(=O)O MCULE-6908911956 [0,0,1,0,0,0|2,0,0]=3 1016 B8R0.23 CC(C)CC(N)C(=O)N MCULE-8974870406 [0,0,1,0,0,0|2,0,0]=3 1017 B8R0.23 CC(C)CC(N)C(=O)N MCULE-9193295179 [0,0,1,0,0,0|2,0,0]=3 1018 B8R0.23 CC(C)CC(N)C(=O)O MCULE-2550986320 [0,0,1,0,0,0|1,0,0]=2 1019 B8R0.23 CC(C)CC(N)C(=O)O MCULE-7657212416 [0,0,1,0,0,0|1,0,0]=2 1020 B8R0.23 CC(C)CC(O)C(=O)O MCULE-3638762911 [0,0,1,0,0,0|2,0,0]=3 1021 B8R0.23 CC(C)CC(O)C(=O)O MCULE-4315013875 [0,0,1,0,0,0|2,0,0]=3 1022 B8R0.23 CC(C)C[C@@H](Br)C(=O)O MCULE-2325122781 [0,0,1,0,0,0|2,0,0]=3 1023 B8R0.23 CC(C)C[C@@H](Cl)C(=O)O MCULE-6797937420 [0,0,1,0,0,0|2,0,0]=3 1024 B8R0.23 CC(C)C[C@@H](N)C(=O)N MCULE-6195005494 [0,0,1,0,0,0|2,0,0]=3 1025 B8R0.23 CC(C)C[C@@H](N)C(=O)O MCULE-3041792060 [0,0,1,0,0,0|1,0,0]=2 1026 B8R0.23 CC(C)C[C@@H](N)C(=O)O MCULE-8280206722 [0,0,1,0,0,0|1,0,0]=2 1027 B8R0.23 CC(C)C[C@@H](O)C(=O)O MCULE-4108530385 [0,0,1,0,0,0|2,0,0]=3 1028 B8R0.23 CC(C)C[C@@H](O)C(=O)O MCULE-5253943571 [0,0,1,0,0,0|2,0,0]=3 1029 B8R0.23 CC(C)C[C@H](Br)C(=O)O MCULE-4423121396 [0,0,1,0,0,0|2,0,0]=3 1030 B8R0.23 CC(C)C[C@H](Br)C(=O)O MCULE-7601821889 [0,0,1,0,0,0|2,0,0]=3 1031 B8R0.23 CC(C)C[C@H](Cl)C(=O)O MCULE-1038344796 [0,0,1,0,0,0|2,0,0]=3 1032 B8R0.23 CC(C)C[C@H](Cl)C(=O)O MCULE-9007168250 [0,0,1,0,0,0|2,0,0]=3 1033 B8R0.23 CC(C)C[C@H](N)C(=O)N MCULE-3907393760 [0,0,1,0,0,0|2,0,0]=3 1034 B8R0.23 CC(C)C[C@H](N)C(=O)N MCULE-5393472198 [0,0,1,0,0,0|2,0,0]=3 1035 B8R0.23 CC(C)C[C@H](N)C(=O)N MCULE-7425207205 [0,0,1,0,0,0|2,0,0]=3 1036 B8R0.23 CC(C)C[C@H](N)C(=O)N MCULE-8093463847 [0,0,1,0,0,0|2,0,0]=3 1037 B8R0.23 CC(C)C[C@H](N)C(=O)O MCULE-4718215038 [0,0,1,0,0,0|1,0,0]=2 1038 B8R0.23 CC(C)C[C@H](N)C(=O)O MCULE-4930237913 [0,0,1,0,0,0|1,0,0]=2 1039 B8R0.23 CC(C)C[C@H](N)C(=O)O MCULE-8722899457 [0,0,1,0,0,0|1,0,0]=2 1040 B8R0.23 CC(C)C[C@H](O)C(=O)O MCULE-1740362996 [0,0,1,0,0,0|2,0,0]=3 1041 B8R0.23 CC(C)C[C@H](O)C(=O)O MCULE-4466965907 [0,0,1,0,0,0|2,0,0]=3 1042 B8R0.23 CC(C)NC(C)C(=O)O MCULE-1412835872 [0,0,1,0,0,0|3,0,0]=4 1043 B8R0.23 CC(C)NC(C)C(=O)O MCULE-5184634957 [0,0,1,0,0,0|3,0,0]=4 1044 B8R0.23 CC(C)OC(C)C(=O)O MCULE-6571129429 [0,0,1,0,0,0|3,0,0]=4 1045 B8R0.23 CC(C)SC(C)C(=O)O MCULE-1620493707 [0,0,1,0,0,0|3,0,0]=4 1046 B8R0.23 CC(CC(=O)O)C(=O)O MCULE-4824634360 [0,0,1,0,0,0|2,0,1]=4 1047 B8R0.23 CC(CC(=O)O)C(=O)O MCULE-8116748590 [0,0,1,0,0,0|2,0,1]=4 1048 B8R0.23 CC(CC(F)F)C(=O)O MCULE-2211206695 [0,0,1,0,0,0|3,0,0]=4 1049 B8R0.23 CC(CN(C)C)C(=O)O MCULE-7139783268 [0,0,1,0,0,0|3,0,0]=4 1050 B8R0.23 CC(CN(C)C)C(=O)O MCULE-7716649676 [0,0,1,0,0,0|3,0,0]=4 1051 B8R0.23 CC(CS(=O)C)C(=O)O MCULE-4855592077 [0,0,1,0,0,0|2,0,1]=4 1052 B8R0.23 CN(C)CC(N)C(=O)O MCULE-4589211472 [0,0,1,0,0,0|2,0,0]=3 1053 B8R0.23 CN(C)CC(N)C(=O)O MCULE-4873136690 [0,0,1,0,0,0|2,0,0]=3 1054 B8R0.23 CN(C)CC(O)C(=O)O MCULE-2461037518 [0,0,1,0,0,0|3,0,0]=4 1055 B8R0.23 CN(C)C[C@@H](N)C(=O)O MCULE-7056570231 [0,0,1,0,0,0|2,0,0]=3 1056 B8R0.23 CN(C)C[C@H](N)C(=O)O MCULE-1155351106 [0,0,1,0,0,0|2,0,0]=3 1057 B8R0.23 CN(C)C[C@H](N)C(=O)O MCULE-2217543416 [0,0,1,0,0,0|2,0,0]=3 1058 B8R0.23 CN(C)C[C@H](N)C(=O)O MCULE-6989814495 [0,0,1,0,0,0|2,0,0]=3 1059 B8R0.23 CN(C)C[C@H](N)C(=O)O MCULE-7529109312 [0,0,1,0,0,0|2,0,0]=3 1060 B8R0.23 CN(C)C[C@H](O)C(=O)O MCULE-7629489364 [0,0,1,0,0,0|3,0,0]=4 1061 B8R0.23 CS(=O)CC(N)C(=O)O MCULE-5699602621 [0,0,1,0,0,0|1,0,1]=3 1062 B8R0.23 CS(=O)C[C@@H](N)C(=O)O MCULE-8253087333 [0,0,1,0,0,0|1,0,1]=3 1063 B8R0.23 CS(=O)C[C@H](N)C(=O)O MCULE-5080098254 [0,0,1,0,0,0|1,0,1]=3 1064 B8R0.23 C[C@@H](CC(=O)O)C(=O)O MCULE-1711994689 [0,0,1,0,0,0|2,0,1]=4 1065 B8R0.23 C[C@@H](CC(=O)O)C(=O)O MCULE-6107805812 [0,0,1,0,0,0|2,0,1]=4 1066 B8R0.23 C[C@H](CC(=O)O)C(=O)O MCULE-2738295504 [0,0,1,0,0,0|2,0,1]=4 1067 B8R0.23 C[C@H](CC(=O)O)C(=O)O MCULE-4544789339 [0,0,1,0,0,0|2,0,1]=4 1068 B8R0.23 C[C@H](Cl)C[C@H](N)C(=O)O MCULE-5195061270 [0,0,1,0,0,0|1,0,0]=2 1069 B8R0.23 C[C@H](Cl)C[C@H](N)C(=O)O MCULE-5975065356 [0,0,1,0,0,0|1,0,0]=2 1070 B8R0.23 C[S@](=O)C[C@@H](N)C(=O)O MCULE-4004385080 [0,0,1,0,0,0|1,0,1]=3 1071 B8R0.23 NC(=O)C(N)CC(=O)O MCULE-2277575843 [0,0,1,0,0,0|2,0,1]=4 1072 B8R0.23 NC(=O)CC(N)C(=O)O MCULE-1395307434 [0,0,1,0,0,0|1,0,2]=4 1073 B8R0.23 NC(=O)C[C@@H](N)C(=O)O MCULE-5685974579 [0,0,1,0,0,0|1,0,2]=4 1074 B8R0.23 NC(=O)C[C@@H](N)C(=O)O MCULE-6923060287 [0,0,1,0,0,0|1,0,2]=4 1075 B8R0.23 NC(=O)C[C@H](N)C(=O)O MCULE-1868046141 [0,0,1,0,0,0|1,0,2]=4 1076 B8R0.23 NC(=O)C[C@H](N)C(=O)O MCULE-8248953574 [0,0,1,0,0,0|1,0,2]=4 1077 B8R0.23 NC(=O)[C@@H](N)CC(=O)O MCULE-1924512659 [0,0,1,0,0,0|2,0,1]=4 1078 B8R0.23 NC(=O)[C@@H](N)CC(=O)O MCULE-5836180326 [0,0,1,0,0,0|2,0,1]=4 1079 B8R0.23 NC(=O)[C@@H](N)CC(=O)O MCULE-8799617587 [0,0,1,0,0,0|2,0,1]=4 1080 B8R0.23 NC(=O)[C@@H](N)CC(=O)O MCULE-9477928215 [0,0,1,0,0,0|2,0,1]=4 1081 B8R0.23 NC(=O)[C@H](N)CC(=O)O MCULE-5316198498 [0,0,1,0,0,0|2,0,1]=4 1082 B8R0.23 NC(=O)[C@H](N)CC(=O)O MCULE-9833023193 [0,0,1,0,0,0|2,0,1]=4 1083 B8R0.23 NC(CC(=O)O)C(=O)O MCULE-1247865301 [0,0,1,0,0,0|1,0,1]=3 1084 B8R0.23 NC(CC(=O)O)C(=O)O MCULE-9328817309 [0,0,1,0,0,0|1,0,1]=3 1085 B8R0.23 NC(CC(=O)O)C(=O)[O-] MCULE-5149469296 [0,0,1,0,0,0|1,0,2]=4 1086 B8R0.23 NC(CC(=O)O)C(=O)[O-] MCULE-6655576025 [0,0,1,0,0,0|1,0,2]=4 1087 B8R0.23 NC(CC(=O)[O-])C(=O)O MCULE-9221777365 [0,0,1,0,0,0|1,0,2]=4 1088 B8R0.23 NC(CC(F)F)C(=O)O MCULE-1880803967 [0,0,1,0,0,0|2,0,0]=3 1089 B8R0.23 NC(CC(F)F)C(=O)O MCULE-7276277891 [0,0,1,0,0,0|2,0,0]=3 1090 B8R0.23 N[C@@H](CC(=O)O)C(=O)O MCULE-3710241722 [0,0,1,0,0,0|1,0,1]=3 1091 B8R0.23 N[C@@H](CC(=O)O)C(=O)O MCULE-6700641640 [0,0,1,0,0,0|1,0,1]=3 1092 B8R0.23 N[C@@H](CC(=O)O)C(=O)[O-] MCULE-6196524297 [0,0,1,0,0,0|1,0,2]=4 1093 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O MCULE-5793000569 [0,0,1,0,0,0|1,0,2]=4 1094 B8R0.23 N[C@@H](CC(Cl)Cl)C(=O)O MCULE-9426370618 [0,0,1,0,0,0|2,0,0]=3 1095 B8R0.23 N[C@@H](CC(F)F)C(=O)O MCULE-3232895455 [0,0,1,0,0,0|2,0,0]=3 1096 B8R0.23 N[C@@H](CC(F)F)C(=O)O MCULE-3771092799 [0,0,1,0,0,0|2,0,0]=3 1097 B8R0.23 N[C@@H](CC(F)F)C(=O)O MCULE-5990452255 [0,0,1,0,0,0|2,0,0]=3 1098 B8R0.23 N[C@@H](CS(=O)O)C(=O)O MCULE-6647925908 [0,0,1,0,0,0|2,0,0]=3 1099 B8R0.23 N[C@@H](CS(=O)O)C(=O)O MCULE-7596867929 [0,0,1,0,0,0|2,0,0]=3 1100 B8R0.23 N[C@H](CC(=O)O)C(=O)O MCULE-8102700760 [0,0,1,0,0,0|1,0,1]=3 1101 B8R0.23 N[C@H](CC(F)F)C(=O)O MCULE-2615133633 [0,0,1,0,0,0|2,0,0]=3 1102 B8R0.23 N[C@H](CC(F)F)C(=O)O MCULE-4923641891 [0,0,1,0,0,0|2,0,0]=3 1103 B8R0.23 O=C(O)CC(Br)C(=O)O MCULE-8178780603 [0,0,1,0,0,0|2,0,1]=4 1104 B8R0.23 O=C(O)CC(Cl)C(=O)O MCULE-6357456691 [0,0,1,0,0,0|2,0,1]=4 1105 B8R0.23 O=C(O)CC(F)C(=O)O MCULE-8433198001 [0,0,1,0,0,0|2,0,1]=4 1106 B8R0.23 O=C(O)CC(O)C(=O)O MCULE-5852208511 [0,0,1,0,0,0|2,0,1]=4 1107 B8R0.23 O=C(O)CC(O)C(=O)O MCULE-9713558868 [0,0,1,0,0,0|2,0,1]=4 1108 B8R0.23 O=C(O)CC(O)C(=O)O MCULE-9924961830 [0,0,1,0,0,0|2,0,1]=4 1109 B8R0.23 O=C(O)CC(S)C(=O)O MCULE-7005300961 [0,0,1,0,0,0|2,0,1]=4 1110 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O MCULE-4598056907 [0,0,1,0,0,0|2,0,1]=4 1111 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O MCULE-7861798045 [0,0,1,0,0,0|2,0,1]=4 1112 B8R0.23 O=C(O)C[C@@H](O)C(=O)O MCULE-2239273084 [0,0,1,0,0,0|2,0,1]=4 1113 B8R0.23 O=C(O)C[C@@H](O)C(=O)O MCULE-4984266891 [0,0,1,0,0,0|2,0,1]=4 1114 B8R0.23 O=C(O)C[C@H](Br)C(=O)O MCULE-6763472515 [0,0,1,0,0,0|2,0,1]=4 1115 B8R0.23 O=C(O)C[C@H](Br)C(=O)O MCULE-7524683930 [0,0,1,0,0,0|2,0,1]=4 1116 B8R0.23 O=C(O)C[C@H](F)C(=O)O MCULE-9607625100 [0,0,1,0,0,0|2,0,1]=4 1117 B8R0.23 O=C(O)C[C@H](O)C(=O)O MCULE-8339271078 [0,0,1,0,0,0|2,0,1]=4 1118 B8R0.23 O=C(O)C[C@H](O)C(=O)O MCULE-8865188741 [0,0,1,0,0,0|2,0,1]=4 1119 B8R0.23 O=C(O)C[C@H](S)C(=O)O MCULE-6393371024 [0,0,1,0,0,0|2,0,1]=4 1120 B8R0.23 [C@@H](N)(CC(=O)O)C(=O)O MCULE-7899824165 [0,0,1,0,0,0|1,0,1]=3 1121 B8R0.23 [C@@H](N)(CC(C)C)C(=O)N MCULE-4796212792 [0,0,1,0,0,0|2,0,0]=3 1122 B8R0.23 [C@@H](N)(CC(C)C)C(=O)N MCULE-7620299780 [0,0,1,0,0,0|2,0,0]=3 1123 B8R0.23 [C@@H](N)(CC(C)C)C(=O)N MCULE-8990653324 [0,0,1,0,0,0|2,0,0]=3 1124 B8R0.23 [C@H](N)(CS(=O)C)C(=O)O MCULE-5084638505 [0,0,1,0,0,0|1,0,1]=3 1125 B8R0.28 C=C(C)CCCC(=O)O MCULE-1282031449 [0,0,1,0,0,0|2,0,1]=4 1126 B8R0.28 CC(=O)CCCC(=O)O MCULE-2498129200 [0,0,1,0,0,0|1,0,2]=4 1127 B8R0.28 CC(=O)CCCC(C)C MCULE-7256575819 [0,0,1,0,0,0|3,0,0]=4 1128 B8R0.28 CC(=O)CNCC(C)C MCULE-3943786157 [0,0,1,0,0,0|2,0,0]=3 1129 B8R0.28 CC(=O)CNCC(C)C MCULE-9329085422 [0,0,1,0,0,0|2,0,0]=3 1130 B8R0.28 CC(=O)CSCC(C)C MCULE-1710631404 [0,0,1,0,0,0|3,0,0]=4 1131 B8R0.28 CC(C)/C=C/CC(=O)O MCULE-6288178603 [0,0,1,0,0,0|2,0,1]=4 1132 B8R0.28 CC(C)C=CCC(=O)O MCULE-1057297040 [0,0,1,0,0,0|2,0,1]=4 1133 B8R0.28 CC(C)CC=CC(=O)O MCULE-4966710694 [0,0,1,0,0,0|2,0,1]=4 1134 B8R0.28 CC(C)CCCC(=O)O MCULE-3645348479 [0,0,1,0,0,0|2,0,0]=3 1135 B8R0.28 CC(C)CNCC(=O)N MCULE-6834225327 [0,0,1,0,0,0|2,0,0]=3 1136 B8R0.28 CC(C)CNCC(=O)N MCULE-8464570977 [0,0,1,0,0,0|2,0,0]=3 1137 B8R0.28 CC(C)CNCC(=O)O MCULE-4695293444 [0,0,1,0,0,0|1,0,0]=2 1138 B8R0.28 CC(C)CNCC(=O)O MCULE-9936739681 [0,0,1,0,0,0|1,0,0]=2 1139 B8R0.28 CC(C)CNCC(C)O MCULE-5110606510 [0,0,1,0,0,0|2,0,1]=4 1140 B8R0.28 CC(C)COCC(=O)N MCULE-8148336060 [0,0,1,0,0,0|3,0,0]=4 1141 B8R0.28 CC(C)COCC(=O)O MCULE-8643896966 [0,0,1,0,0,0|2,0,0]=3 1142 B8R0.28 CC(C)CSCC(=O)O MCULE-5182400762 [0,0,1,0,0,0|2,0,0]=3 1143 B8R0.28 CC(C)NCCC(=O)O MCULE-2087792459 [0,0,1,0,0,0|3,0,0]=4 1144 B8R0.28 CC(C)NCCC(=O)O MCULE-6893587807 [0,0,1,0,0,0|3,0,0]=4 1145 B8R0.28 CC(C)OCCC(=O)O MCULE-6533666992 [0,0,1,0,0,0|3,0,0]=4 1146 B8R0.28 CC(C)SCCC(=O)O MCULE-1434094352 [0,0,1,0,0,0|3,0,0]=4 1147 B8R0.28 CC(Cl)CCCC(=O)Cl MCULE-6993455396 [0,0,1,0,0,0|3,0,0]=4 1148 B8R0.28 CC(O)CCCC(=O)O MCULE-6696855762 [0,0,1,0,0,0|1,0,0]=2 1149 B8R0.28 CC(O)CCCC(=O)[O-] MCULE-7722587632 [0,0,1,0,0,0|1,0,1]=3 1150 B8R0.28 CC(O)CNCC(C)O MCULE-2715190259 [0,0,1,0,0,0|1,0,1]=3 1151 B8R0.28 CC(O)CNCC(F)F MCULE-7816104376 [0,0,1,0,0,0|2,0,1]=4 1152 B8R0.28 CC(O)COCC(C)O MCULE-9464290948 [0,0,1,0,0,0|2,0,1]=4 1153 B8R0.28 CN(C)CCCC(=O)O MCULE-5562283434 [0,0,1,0,0,0|3,0,0]=4 1154 B8R0.28 CN(C)CCCC(=O)O MCULE-5657963851 [0,0,1,0,0,0|3,0,0]=4 1155 B8R0.28 NC(=O)CNCC(=O)O MCULE-2816922286 [0,0,1,0,0,0|1,0,2]=4 1156 B8R0.28 O=C(O)CCCC(=O)O MCULE-4286022994 [0,0,1,0,0,0|2,0,1]=4 1157 B8R0.28 O=C(O)CCCC(F)F MCULE-1906281877 [0,0,1,0,0,0|3,0,0]=4 1158 B8R0.28 O=C(O)CNCC(=O)O MCULE-4131542591 [0,0,1,0,0,0|1,0,1]=3 1159 B8R0.28 O=C(O)COCC(=O)O MCULE-5687758679 [0,0,1,0,0,0|2,0,1]=4 1160 B8R0.28 O=C(O)COCC(F)F MCULE-2599944385 [0,0,1,0,0,0|3,0,0]=4 1161 B8R0.28 O=C(O)CSCC(=O)O MCULE-8112166808 [0,0,1,0,0,0|2,0,1]=4 1162 B10R2.14 OC1CNC(C1)C2CC2 MCULE-1983417153 [0,0,0,1,0,0|2,0,1]=4 1163 B10R2.14 OC1CNC(C1)C2CC2 MCULE-6477074344 [0,0,0,1,0,0|2,0,1]=4 1164 B10R2.60 O=C1OC2CC1CC2Br MCULE-9788012516 [0,0,0,1,0,0|2,0,0]=3 1165 B10R2.60 OC1CC2CC1CC2O MCULE-1737041652 [0,0,0,1,0,0|2,0,1]=4 1166 B10R2.178 O=C1CCC2CCC1C2 MCULE-9878559019 [0,0,0,1,0,0|3,0,0]=4 1167 B10R2.178 O=C1NCC2CCC1C2 MCULE-3479263424 [0,0,0,1,0,0|3,0,0]=4 1168 B10R2.178 [C@H]12CNC(=O)[C@H](C1)NC2 MCULE-4419255963 [0,0,0,1,0,0|2,0,0]=3 1169 B10R2.178 [C@H]12CNC(=O)[C@H](C1)NC2 MCULE-8674860929 [0,0,0,1,0,0|2,0,0]=3 1170 B10R2.348 NC(=O)C12CC(C1)CN2 MCULE-4899287908 [0,0,0,1,0,0|2,0,0]=3 1171 B10R2.348 NC(=O)C12CCC(C1)C2 MCULE-7319305149 [0,0,0,1,0,0|3,0,0]=4 1172 B10R2.348 O=C(O)C12CC(C1)CN2 MCULE-3301053502 [0,0,0,1,0,0|1,0,0]=2 1173 B10R2.348 O=C(O)C12CC(C1)CN2 MCULE-9060454076 [0,0,0,1,0,0|1,0,0]=2 1174 B10R2.348 O=C(O)C12CC(C1)CO2 MCULE-4565029695 [0,0,0,1,0,0|2,0,0]=3 1175 B10R2.348 O=C(O)C12CC(C1)CO2 MCULE-7423494837 [0,0,0,1,0,0|2,0,0]=3 1176 B10R2.348 O=C(O)C12CCC(C1)C2 MCULE-8219273908 [0,0,0,1,0,0|2,0,0]=3 1177 B10R2.348 O=C(O)C12CNC(C1)C2 MCULE-7157298202 [0,0,0,1,0,0|3,0,0]=4 1178 B10R2.348 O=C(O)C12COC(C1)C2 MCULE-8326120300 [0,0,0,1,0,0|3,0,0]=4 1179 B10R2.355 O=C(O)C1NCC2C1C2 MCULE-8087821545 [0,0,0,1,0,0|1,0,0]=2 1180 B10R2.355 O=C(O)C1NCC2C1C2 MCULE-9943749675 [0,0,0,1,0,0|1,0,0]=2 1181 B10R2.355 O=C(O)C1NC[C@@H]2[C@H]1C2 MCULE-3741942930 [0,0,0,1,0,0|1,0,0]=2 1182 B10R2.355 O=C(O)C1NC[C@@H]2[C@H]1C2 MCULE-8099098772 [0,0,0,1,0,0|1,0,0]=2 1183 B10R2.355 O=C(O)[C@@H]1NC[C@@H]2[C@H]1C2 MCULE-6549710478 [0,0,0,1,0,0|1,0,0]=2 1184 B10R2.355 O=C(O)[C@@H]1NC[C@@H]2[C@H]1C2 MCULE-7349536483 [0,0,0,1,0,0|1,0,0]=2 1185 B10R2.355 O=C(O)[C@H]1NC[C@@H]2[C@H]1C2 MCULE-1865131686 [0,0,0,1,0,0|1,0,0]=2 1186 B10R2.355 O=C(O)[C@H]1NC[C@H]2[C@@H]1C2 MCULE-3923610209 [0,0,0,1,0,0|1,0,0]=2 1187 B10R2.355 O=C(O)[C@H]1NC[C@H]2[C@@H]1C2 MCULE-6551780838 [0,0,0,1,0,0|1,0,0]=2 1188 B10R2.355 O=C(O)[C@H]1NC[C@H]2[C@@H]1C2 MCULE-9694754423 [0,0,0,1,0,0|1,0,0]=2 1189 B10R2.355 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)O MCULE-4493728887 [0,0,0,1,0,0|1,0,0]=2 1190 B10R2.355 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)O MCULE-8766409370 [0,0,0,1,0,0|1,0,0]=2 1191 B10R2.355 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)O MCULE-8840539566 [0,0,0,1,0,0|1,0,0]=2 1192 B10R2.355 [C@@H]12CN[C@H]([C@@H]1C2)C(=O)O MCULE-1970630066 [0,0,0,1,0,0|1,0,0]=2 1193 B10R2.355 [C@@H]12CN[C@H]([C@@H]1C2)C(=O)O MCULE-7946950016 [0,0,0,1,0,0|1,0,0]=2 1194 B10R2.355 [C@H]12C[C@H]1CN[C@@H]2C(=O)O MCULE-9408302039 [0,0,0,1,0,0|1,0,0]=2 1195 B10R2.355 [C@H]12C[C@H]1CN[C@H]2C(=O)O MCULE-4802776373 [0,0,0,1,0,0|1,0,0]=2 1196 B10R2.357 C12CC(NC1C2)C(=O)N MCULE-4859115894 [0,0,0,1,0,0|2,0,0]=3 1197 B10R2.357 C12CC(NC1C2)C(=O)N MCULE-7323043594 [0,0,0,1,0,0|2,0,0]=3 1198 B10R2.357 C12CC(NC1C2)C(=O)N MCULE-7946144059 [0,0,0,1,0,0|2,0,0]=3 1199 B10R2.357 CC(=O)N1CC2OC2C1 MCULE-5798145423 [0,0,0,1,0,0|3,0,0]=4 1200 B10R2.357 O=C(O)C1CC2CC2C1 MCULE-9890442572 [0,0,0,1,0,0|2,0,0]=3 1201 B10R2.357 O=C(O)C1CC2CC2N1 MCULE-4212410891 [0,0,0,1,0,0|1,0,0]=2 1202 B10R2.357 O=C(O)C1CC2CC2N1 MCULE-5642169472 [0,0,0,1,0,0|1,0,0]=2 1203 B10R2.357 O=C(O)C1CC2CC2N1 MCULE-6526449280 [0,0,0,1,0,0|1,0,0]=2 1204 B10R2.357 O=C(O)C1CC2OC2C1 MCULE-1665894100 [0,0,0,1,0,0|1,0,0]=2 1205 B10R2.357 O=C(O)[C@@H]1C[C@@H]2C[C@@H]2N1 MCULE-8901519673 [0,0,0,1,0,0|1,0,0]=2 1206 B10R2.357 O=C(O)[C@@H]1C[C@@H]2C[C@@H]2N1 MCULE-8974728452 [0,0,0,1,0,0|1,0,0]=2 1207 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 MCULE-2251552616 [0,0,0,1,0,0|1,0,0]=2 1208 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 MCULE-3670081653 [0,0,0,1,0,0|1,0,0]=2 1209 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 MCULE-4127413852 [0,0,0,1,0,0|1,0,0]=2 1210 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 MCULE-5543837378 [0,0,0,1,0,0|1,0,0]=2 1211 B10R2.357 [C@@H]12C[C@@H](N[C@@H]1C2)C(=O)O MCULE-2699537727 [0,0,0,1,0,0|1,0,0]=2 1212 B10R2.357 [C@@H]12C[C@@H](N[C@@H]1C2)C(=O)O MCULE-2957583599 [0,0,0,1,0,0|1,0,0]=2 1213 B10R2.357 [C@@H]12C[C@@H](N[C@@H]1C2)C(=O)O MCULE-8019742930 [0,0,0,1,0,0|1,0,0]=2 1214 B10R2.357 [C@@H]12C[C@@H](N[C@@H]1C2)C(=O)O MCULE-9906255485 [0,0,0,1,0,0|1,0,0]=2 1215 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-1783881546 [0,0,0,1,0,0|2,0,0]=3 1216 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-2191940678 [0,0,0,1,0,0|2,0,0]=3 1217 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-3269432034 [0,0,0,1,0,0|2,0,0]=3 1218 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-4463912241 [0,0,0,1,0,0|2,0,0]=3 1219 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-6809518361 [0,0,0,1,0,0|2,0,0]=3 1220 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-6941150528 [0,0,0,1,0,0|2,0,0]=3 1221 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-9444667290 [0,0,0,1,0,0|2,0,0]=3 1222 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-9739462821 [0,0,0,1,0,0|2,0,0]=3 1223 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)O MCULE-3004356941 [0,0,0,1,0,0|1,0,0]=2 1224 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)O MCULE-7104749205 [0,0,0,1,0,0|1,0,0]=2 1225 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)O MCULE-9522199577 [0,0,0,1,0,0|1,0,0]=2 1226 B8R1.23 C1(CC(=O)N1)C(=O)O MCULE-3416083471 [0,0,0,0,1,0|0,0,2]=3 1227 B8R1.23 C=C1CC(C1)C(=O)C MCULE-4738657819 [0,0,0,0,1,0|2,0,1]=4 1228 B8R1.23 C=C1CC(C1)C(=O)Cl MCULE-2176633503 [0,0,0,0,1,0|2,0,1]=4 1229 B8R1.23 C=C1CC(C1)C(=O)N MCULE-9592937262 [0,0,0,0,1,0|2,0,1]=4 1230 B8R1.23 C=C1CC(C1)C(=O)O MCULE-6435857280 [0,0,0,0,1,0|1,0,1]=3 1231 B8R1.23 CC(=O)C1CC(C1)O MCULE-1249992642 [0,0,0,0,1,0|1,0,0]=2 1232 B8R1.23 CC(=O)N1CC(C1)N MCULE-2365148708 [0,0,0,0,1,0|3,0,0]=4 1233 B8R1.23 CC(=O)N1CC(C1)N MCULE-7213807824 [0,0,0,0,1,0|3,0,0]=4 1234 B8R1.23 CC(=O)N1CC(C1)N MCULE-9513131334 [0,0,0,0,1,0|3,0,0]=4 1235 B8R1.23 CC(=O)N1CC(C1)O MCULE-5379013327 [0,0,0,0,1,0|2,0,0]=3 1236 B8R1.23 CC1CC(C1)C(=O)O MCULE-2185016477 [0,0,0,0,1,0|1,0,0]=2 1237 B8R1.23 CC1CC(N1)C(=O)O MCULE-2803934033 [0,0,0,0,1,0|1,0,0]=2 1238 B8R1.23 CN(C)C1CC(C1)O MCULE-1150389286 [0,0,0,0,1,0|3,0,0]=4 1239 B8R1.23 CN(C)C1CC(C1)O MCULE-2281417663 [0,0,0,0,1,0|3,0,0]=4 1240 B8R1.23 CN(C)[C@H]1C[C@@H](C1)O MCULE-9687643999 [0,0,0,0,1,0|3,0,0]=4 1241 B8R1.23 CN(C)[C@H]1C[C@H](C1)O MCULE-5096590941 [0,0,0,0,1,0|3,0,0]=4 1242 B8R1.23 CN1CC(C1)C(=O)Cl MCULE-4240668885 [0,0,0,0,1,0|3,0,0]=4 1243 B8R1.23 CN1CC(C1)C(=O)Cl MCULE-8969093472 [0,0,0,0,1,0|3,0,0]=4 1244 B8R1.23 CN1CC(C1)C(=O)O MCULE-8825389553 [0,0,0,0,1,0|2,0,0]=3 1245 B8R1.23 C[C@@H]1C[C@H](N1)C(=O)O MCULE-6318758002 [0,0,0,0,1,0|1,0,0]=2 1246 B8R1.23 C[C@H]1C[C@@H](C1)C(=O)O MCULE-1777784731 [0,0,0,0,1,0|1,0,0]=2 1247 B8R1.23 C[C@H]1C[C@H](C1)C(=O)O MCULE-8951813405 [0,0,0,0,1,0|1,0,0]=2 1248 B8R1.23 C[C@H]1C[C@H](N1)C(=O)O MCULE-2969381793 [0,0,0,0,1,0|1,0,0]=2 1249 B8R1.23 NC(=O)C1CC(C1)N MCULE-5148844906 [0,0,0,0,1,0|2,0,0]=3 1250 B8R1.23 NC(=O)C1CC(C1)N MCULE-6769121107 [0,0,0,0,1,0|2,0,0]=3 1251 B8R1.23 NC(=O)C1CC(C1)O MCULE-5735068093 [0,0,0,0,1,0|1,0,0]=2 1252 B8R1.23 NC(=O)N1CC(C1)F MCULE-7038677987 [0,0,0,0,1,0|3,0,0]=4 1253 B8R1.23 NC(=O)N1CC(C1)O MCULE-8624777593 [0,0,0,0,1,0|2,0,0]=3 1254 B8R1.23 NC1CC(C1)C(=O)O MCULE-8750839632 [0,0,0,0,1,0|1,0,0]=2 1255 B8R1.23 NC1CC(C1)C(=O)O MCULE-9051964103 [0,0,0,0,1,0|1,0,0]=2 1256 B8R1.23 N[C@H]1C[C@@H](C1)C(=O)O MCULE-1844060803 [0,0,0,0,1,0|1,0,0]=2 1257 B8R1.23 N[C@H]1C[C@@H](C1)C(=O)O MCULE-2707924504 [0,0,0,0,1,0|1,0,0]=2 1258 B8R1.23 N[C@H]1C[C@H](C1)C(=O)O MCULE-3847725342 [0,0,0,0,1,0|1,0,0]=2 1259 B8R1.23 N[C@H]1C[C@H](C1)C(=O)O MCULE-4578532365 [0,0,0,0,1,0|1,0,0]=2 1260 B8R1.23 O=C(O)C1CC(C1)Br MCULE-8162503332 [0,0,0,0,1,0|1,0,0]=2 1261 B8R1.23 O=C(O)C1CC(C1)Cl MCULE-7489933597 [0,0,0,0,1,0|1,0,0]=2 1262 B8R1.23 O=C(O)C1CC(C1)F MCULE-7905028761 [0,0,0,0,1,0|1,0,0]=2 1263 B8R1.23 O=C(O)C1CC(C1)O MCULE-4341192467 [0,0,0,0,1,0|0,0,0]=1 1264 B8R1.23 O=C(O)[C@H]1C[C@@H](C1)Br MCULE-1173253398 [0,0,0,0,1,0|1,0,0]=2 1265 B8R1.23 O=C(O)[C@H]1C[C@@H](C1)F MCULE-4909435716 [0,0,0,0,1,0|1,0,0]=2 1266 B8R1.23 O=C(O)[C@H]1C[C@@H](C1)O MCULE-9908072079 [0,0,0,0,1,0|0,0,0]=1 1267 B8R1.23 O=C(O)[C@H]1C[C@H](C1)Br MCULE-9142067708 [0,0,0,0,1,0|1,0,0]=2 1268 B8R1.23 O=C(O)[C@H]1C[C@H](C1)F MCULE-7816380416 [0,0,0,0,1,0|1,0,0]=2 1269 B8R1.23 O=C(O)[C@H]1C[C@H](C1)O MCULE-5181925767 [0,0,0,0,1,0|0,0,0]=1 1270 B8R1.23 O=C1CC(C1)C(=O)Cl MCULE-5261758509 [0,0,0,0,1,0|1,0,2]=4 1271 B8R1.23 O=C1CC(C1)C(=O)O MCULE-8672788982 [0,0,0,0,1,0|0,0,2]=3 1272 B8R1.23 O=C1CC(N1)C(=O)O MCULE-3167823583 [0,0,0,0,1,0|0,0,2]=3 1273 B8R1.23 O=C1CC(O1)C(=O)O MCULE-1791104685 [0,0,0,0,1,0|1,0,2]=4 1274 B8R1.23 O=C1C[C@@H](N1)C(=O)O MCULE-2118093307 [0,0,0,0,1,0|0,0,2]=3 1275 B8R1.23 O=C1C[C@@H](N1)C(=O)O MCULE-7784171286 [0,0,0,0,1,0|0,0,2]=3 1276 B8R1.23 O=C1C[C@H](N1)C(=O)O MCULE-1255798587 [0,0,0,0,1,0|0,0,2]=3 1277 B8R1.23 O=C1C[C@H](N1)C(=O)O MCULE-6947698869 [0,0,0,0,1,0|0,0,2]=3 1278 B8R1.23 OC1CC(C1)C(F)F MCULE-5734568055 [0,0,0,0,1,0|2,0,1]=4 1279 B8R1.23 [C@@H]1(C[C@@H](C1)C(=O)O)Cl MCULE-4605935494 [0,0,0,0,1,0|1,0,0]=2 1280 B8R1.31 C1(CCN1C)C(=O)O MCULE-3478640390 [0,0,0,0,1,0|3,0,0]=4 1281 B8R1.31 C=C1CCC1C(=O)O MCULE-7307560863 [0,0,0,0,1,0|2,0,1]=4 1282 B8R1.31 CC(=O)[C@@H]1CC[C@H]1C MCULE-1543129128 [0,0,0,0,1,0|3,0,0]=4 1283 B8R1.31 CC1CCC1C(=O)O MCULE-2755332087 [0,0,0,0,1,0|2,0,0]=3 1284 B8R1.31 CC1CNC1C(=O)O MCULE-4084486339 [0,0,0,0,1,0|1,0,0]=2 1285 B8R1.31 CC1NCC1C(=O)O MCULE-3701314568 [0,0,0,0,1,0|3,0,0]=4 1286 B8R1.31 CN1CCC1C(=O)O MCULE-5037838055 [0,0,0,0,1,0|3,0,0]=4 1287 B8R1.31 CN1CC[C@@H]1C(=O)O MCULE-3293015609 [0,0,0,0,1,0|3,0,0]=4 1288 B8R1.31 CN1CC[C@@H]1C(=O)O MCULE-6726499104 [0,0,0,0,1,0|3,0,0]=4 1289 B8R1.31 CN1CC[C@H]1C(=O)O MCULE-1519401164 [0,0,0,0,1,0|3,0,0]=4 1290 B8R1.31 CN1CC[C@H]1C(=O)O MCULE-2682368839 [0,0,0,0,1,0|3,0,0]=4 1291 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O MCULE-6870930523 [0,0,0,0,1,0|1,0,0]=2 1292 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O MCULE-9495962068 [0,0,0,0,1,0|1,0,0]=2 1293 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O MCULE-4996743185 [0,0,0,0,1,0|3,0,0]=4 1294 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O MCULE-5548697786 [0,0,0,0,1,0|3,0,0]=4 1295 B8R1.31 NC1CCC1C(=O)O MCULE-1271890671 [0,0,0,0,1,0|2,0,0]=3 1296 B8R1.31 NC1CCC1C(=O)O MCULE-6203451123 [0,0,0,0,1,0|2,0,0]=3 1297 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O MCULE-7309195085 [0,0,0,0,1,0|2,0,0]=3 1298 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-1231832702 [0,0,0,0,1,0|2,0,0]=3 1299 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-4120413857 [0,0,0,0,1,0|2,0,0]=3 1300 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-7581321099 [0,0,0,0,1,0|2,0,0]=3 1301 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-8814127531 [0,0,0,0,1,0|2,0,0]=3 1302 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O MCULE-1877122488 [0,0,0,0,1,0|2,0,0]=3 1303 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-2323153571 [0,0,0,0,1,0|2,0,0]=3 1304 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-3627026930 [0,0,0,0,1,0|2,0,0]=3 1305 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-3814908416 [0,0,0,0,1,0|2,0,0]=3 1306 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-8552378194 [0,0,0,0,1,0|2,0,0]=3 1307 B8R1.31 O=C(O)C1CCC1F MCULE-6928594613 [0,0,0,0,1,0|2,0,0]=3 1308 B8R1.31 O=C(O)C1CCC1O MCULE-5612797663 [0,0,0,0,1,0|1,0,0]=2 1309 B8R1.31 O=C(O)[C@@H]1CC[C@H]1O MCULE-4502275905 [0,0,0,0,1,0|1,0,0]=2 1310 B8R1.31 O=C(O)[C@H]1CC[C@@H]1O MCULE-1446557503 [0,0,0,0,1,0|1,0,0]=2 1311 B8R1.31 [C@@H]1(CC[C@@H]1C(=O)O)N MCULE-3693378535 [0,0,0,0,1,0|2,0,0]=3 1312 B8R1.31 [C@@H]1(CC[C@@H]1C(=O)O)N MCULE-4998471402 [0,0,0,0,1,0|2,0,0]=3 1313 B8R1.31 [C@@H]1(CC[C@H]1C(=O)O)N MCULE-1179436878 [0,0,0,0,1,0|2,0,0]=3 1314 B8R1.31 [C@@H]1(CC[C@H]1C(=O)O)N MCULE-6666180327 [0,0,0,0,1,0|2,0,0]=3 1315 B8R1.31 [C@@H]1(NC[C@H]1C)C(=O)O MCULE-4107819391 [0,0,0,0,1,0|1,0,0]=2 1316 B10R1.13 C=C1CCC(CC1)C(=O)O MCULE-9520777832 [0,0,0,0,0,1|2,0,1]=4 1317 B10R1.13 CC(=O)C1CCC(CC1)C MCULE-6102529388 [0,0,0,0,0,1|3,0,0]=4 1318 B10R1.13 CC(=O)C1CCC(CC1)N MCULE-1009720315 [0,0,0,0,0,1|3,0,0]=4 1319 B10R1.13 CC(=O)C1CCC(CC1)N MCULE-5617448654 [0,0,0,0,0,1|3,0,0]=4 1320 B10R1.13 CC(=O)C1CCC(CC1)O MCULE-8384212790 [0,0,0,0,0,1|2,0,0]=3 1321 B10R1.13 CC(=O)N1CCC(CC1)O MCULE-8657432815 [0,0,0,0,0,1|3,0,0]=4 1322 B10R1.13 CC(=O)[C@H]1CC[C@@H](CC1)C MCULE-1016150505 [0,0,0,0,0,1|3,0,0]=4 1323 B10R1.13 CC(=O)[C@H]1CC[C@@H](CC1)N MCULE-6674769937 [0,0,0,0,0,1|3,0,0]=4 1324 B10R1.13 CC(=O)[C@H]1CC[C@@H](CC1)N MCULE-7289775544 [0,0,0,0,0,1|3,0,0]=4 1325 B10R1.13 CC1=CCC(CC1)C(=O)O MCULE-8997751425 [0,0,0,0,0,1|2,0,1]=4 1326 B10R1.13 CC1CC=C(CC1)C(=O)O MCULE-7341526311 [0,0,0,0,0,1|2,0,1]=4 1327 B10R1.13 CC1CCC(CC1)C(=O)Cl MCULE-4812590612 [0,0,0,0,0,1|3,0,0]=4 1328 B10R1.13 CC1CCC(CC1)C(=O)O MCULE-3225182334 [0,0,0,0,0,1|2,0,0]=3 1329 B10R1.13 CC1CCC(CN1)C(=O)N MCULE-7780455991 [0,0,0,0,0,1|3,0,0]=4 1330 B10R1.13 CC1CCC(CN1)C(=O)O MCULE-3840727873 [0,0,0,0,0,1|2,0,0]=3 1331 B10R1.13 CC1CCC(CN1)C(=O)O MCULE-5946890830 [0,0,0,0,0,1|2,0,0]=3 1332 B10R1.13 CC1CCC(CO1)C(=O)O MCULE-6526905782 [0,0,0,0,0,1|2,0,0]=3 1333 B10R1.13 CC1CCC(NC1)C(=O)O MCULE-2912599846 [0,0,0,0,0,1|1,0,0]=2 1334 B10R1.13 CC1CCC(NC1)C(=O)O MCULE-3297162881 [0,0,0,0,0,1|1,0,0]=2 1335 B10R1.13 CC1COC(CN1)C(=O)O MCULE-7809709557 [0,0,0,0,0,1|2,0,0]=3 1336 B10R1.13 CN1CCC(CC1)C(=O)O MCULE-1330176845 [0,0,0,0,0,1|3,0,0]=4 1337 B10R1.13 CN1CCC(CC1)C(=O)O MCULE-2860414660 [0,0,0,0,0,1|3,0,0]=4 1338 B10R1.13 C[C@@H]1CC[C@@H](CN1)C(=O)O MCULE-8843664488 [0,0,0,0,0,1|2,0,0]=3 1339 B10R1.13 C[C@@H]1CC[C@H](CN1)C(=O)O MCULE-2204464981 [0,0,0,0,0,1|2,0,0]=3 1340 B10R1.13 C[C@@H]1CC[C@H](CN1)C(=O)O MCULE-2225073323 [0,0,0,0,0,1|2,0,0]=3 1341 B10R1.13 C[C@@H]1CC[C@H](CN1)C(=O)O MCULE-3036379148 [0,0,0,0,0,1|2,0,0]=3 1342 B10R1.13 C[C@@H]1CC[C@H](CN1)C(=O)O MCULE-9649426657 [0,0,0,0,0,1|2,0,0]=3 1343 B10R1.13 C[C@@H]1CN[C@H](CO1)C(=O)O MCULE-8093925660 [0,0,0,0,0,1|1,0,0]=2 1344 B10R1.13 C[C@@H]1CN[C@H](CO1)C(=O)O MCULE-9603514021 [0,0,0,0,0,1|1,0,0]=2 1345 B10R1.13 C[C@H]1CC[C@@H](CC1)C(=O)Cl MCULE-2231388476 [0,0,0,0,0,1|3,0,0]=4 1346 B10R1.13 C[C@H]1CC[C@@H](CC1)C(=O)N MCULE-9668889856 [0,0,0,0,0,1|3,0,0]=4 1347 B10R1.13 C[C@H]1CC[C@@H](CC1)C(=O)O MCULE-3272652270 [0,0,0,0,0,1|2,0,0]=3 1348 B10R1.13 C[C@H]1CC[C@@H](CN1)C(=O)O MCULE-6340569413 [0,0,0,0,0,1|2,0,0]=3 1349 B10R1.13 C[C@H]1CC[C@H](CC1)C(=O)O MCULE-7434442752 [0,0,0,0,0,1|2,0,0]=3 1350 B10R1.13 C[C@H]1CC[C@H](CN1)C(=O)O MCULE-3955685184 [0,0,0,0,0,1|2,0,0]=3 1351 B10R1.13 C[C@H]1CN[C@@H](CO1)C(=O)O MCULE-4706739993 [0,0,0,0,0,1|1,0,0]=2 1352 B10R1.13 C[C@H]1CN[C@@H](CO1)C(=O)O MCULE-9210189761 [0,0,0,0,0,1|1,0,0]=2 1353 B10R1.13 NC(=O)C1CCC(CC1)N MCULE-4469475065 [0,0,0,0,0,1|3,0,0]=4 1354 B10R1.13 NC(=O)C1CCC(CC1)N MCULE-4892039405 [0,0,0,0,0,1|3,0,0]=4 1355 B10R1.13 NC(=O)C1CCC(CC1)O MCULE-9699134683 [0,0,0,0,0,1|2,0,0]=3 1356 B10R1.13 NC(=O)C1CCC(CO1)N MCULE-1702911232 [0,0,0,0,0,1|3,0,0]=4 1357 B10R1.13 NC(=O)C1CCC(CO1)N MCULE-9609134356 [0,0,0,0,0,1|3,0,0]=4 1358 B10R1.13 NC(=O)[C@@H]1CC[C@H](CO1)N MCULE-1123100792 [0,0,0,0,0,1|3,0,0]=4 1359 B10R1.13 NC(=O)[C@@H]1CC[C@H](CO1)N MCULE-1890273222 [0,0,0,0,0,1|3,0,0]=4 1360 B10R1.13 NC(=O)[C@@H]1CC[C@H](CO1)N MCULE-3122399272 [0,0,0,0,0,1|3,0,0]=4 1361 B10R1.13 NC(=O)[C@@H]1CC[C@H](CO1)N MCULE-5583780093 [0,0,0,0,0,1|3,0,0]=4 1362 B10R1.13 NC(=O)[C@H]1CC[C@@H](CC1)O MCULE-6564995524 [0,0,0,0,0,1|2,0,0]=3 1363 B10R1.13 NC(=O)[C@H]1CC[C@H](CC1)N MCULE-1727204707 [0,0,0,0,0,1|3,0,0]=4 1364 B10R1.13 NC(=O)[C@H]1CC[C@H](CC1)N MCULE-4007102653 [0,0,0,0,0,1|3,0,0]=4 1365 B10R1.13 NC1CC=C(CC1)C(=O)O MCULE-8027933659 [0,0,0,0,0,1|2,0,1]=4 1366 B10R1.13 NC1CCC(CC1)C(=O)Cl MCULE-4909714198 [0,0,0,0,0,1|3,0,0]=4 1367 B10R1.13 NC1CCC(CC1)C(=O)O MCULE-6722954971 [0,0,0,0,0,1|2,0,0]=3 1368 B10R1.13 NC1CCC(CC1)C(=O)O MCULE-9273524734 [0,0,0,0,0,1|2,0,0]=3 1369 B10R1.13 N[C@H]1CC[C@@H](CC1)C(=O)O MCULE-5282665037 [0,0,0,0,0,1|2,0,0]=3 1370 B10R1.13 N[C@H]1CC[C@@H](CC1)C(=O)O MCULE-8647828626 [0,0,0,0,0,1|2,0,0]=3 1371 B10R1.13 N[C@H]1CC[C@H](CC1)C(=O)O MCULE-1388612667 [0,0,0,0,0,1|2,0,0]=3 1372 B10R1.13 N[C@H]1CC[C@H](CC1)C(=O)O MCULE-8724032546 [0,0,0,0,0,1|2,0,0]=3 1373 B10R1.13 O=C(Cl)C1CCC(CC1)O MCULE-9104583730 [0,0,0,0,0,1|2,0,0]=3 1374 B10R1.13 O=C(O)C1CC=C(CC1)Br MCULE-3957085478 [0,0,0,0,0,1|2,0,1]=4 1375 B10R1.13 O=C(O)C1CC=C(CC1)F MCULE-5924974191 [0,0,0,0,0,1|2,0,1]=4 1376 B10R1.13 O=C(O)C1CCC(CC1)Br MCULE-4952970959 [0,0,0,0,0,1|2,0,0]=3 1377 B10R1.13 O=C(O)C1CCC(CC1)Cl MCULE-9596975674 [0,0,0,0,0,1|2,0,0]=3 1378 B10R1.13 O=C(O)C1CCC(CC1)F MCULE-8237318279 [0,0,0,0,0,1|2,0,0]=3 1379 B10R1.13 O=C(O)C1CCC(CC1)O MCULE-2480420127 [0,0,0,0,0,1|1,0,0]=2 1380 B10R1.13 O=C(O)C1CCC(CN1)O MCULE-3204705068 [0,0,0,0,0,1|0,0,0]=1 1381 B10R1.13 O=C(O)C1CCC(CN1)O MCULE-7178398033 [0,0,0,0,0,1|0,0,0]=1 1382 B10R1.13 O=C(O)[C@@H]1CC[C@@H](CN1)O MCULE-1384355113 [0,0,0,0,0,1|0,0,0]=1 1383 B10R1.13 O=C(O)[C@@H]1CC[C@@H](CN1)O MCULE-1678351091 [0,0,0,0,0,1|0,0,0]=1 1384 B10R1.13 O=C(O)[C@@H]1CC[C@@H](CN1)O MCULE-5287470680 [0,0,0,0,0,1|0,0,0]=1 1385 B10R1.13 O=C(O)[C@@H]1CC[C@@H](CN1)O MCULE-7907264464 [0,0,0,0,0,1|0,0,0]=1 1386 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-2425882122 [0,0,0,0,0,1|0,0,0]=1 1387 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-3071319870 [0,0,0,0,0,1|0,0,0]=1 1388 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-3130571634 [0,0,0,0,0,1|0,0,0]=1 1389 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-4156067811 [0,0,0,0,0,1|0,0,0]=1 1390 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-6185299507 [0,0,0,0,0,1|0,0,0]=1 1391 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-8875046289 [0,0,0,0,0,1|0,0,0]=1 1392 B10R1.13 O=C(O)[C@H]1CC[C@@H](CC1)F MCULE-9036564869 [0,0,0,0,0,1|2,0,0]=3 1393 B10R1.13 O=C(O)[C@H]1CC[C@@H](CC1)O MCULE-6625595981 [0,0,0,0,0,1|1,0,0]=2 1394 B10R1.13 O=C(O)[C@H]1CC[C@@H](CN1)O MCULE-2267551829 [0,0,0,0,0,1|0,0,0]=1 1395 B10R1.13 O=C(O)[C@H]1CC[C@@H](CN1)O MCULE-7339394632 [0,0,0,0,0,1|0,0,0]=1 1396 B10R1.13 O=C(O)[C@H]1CC[C@@H](CN1)O MCULE-7777420620 [0,0,0,0,0,1|0,0,0]=1 1397 B10R1.13 O=C(O)[C@H]1CC[C@@H](CN1)O MCULE-9629486094 [0,0,0,0,0,1|0,0,0]=1 1398 B10R1.13 O=C(O)[C@H]1CC[C@H](CC1)F MCULE-1112147502 [0,0,0,0,0,1|2,0,0]=3 1399 B10R1.13 O=C(O)[C@H]1CC[C@H](CC1)O MCULE-5519058025 [0,0,0,0,0,1|1,0,0]=2 1400 B10R1.13 O=C(O)[C@H]1CC[C@H](CN1)O MCULE-3991583469 [0,0,0,0,0,1|0,0,0]=1 1401 B10R1.13 O=C(O)[C@H]1CC[C@H](CN1)O MCULE-8329848691 [0,0,0,0,0,1|0,0,0]=1 1402 B10R1.13 O=C(O)[C@H]1CC[C@H](CN1)O MCULE-8730600296 [0,0,0,0,0,1|0,0,0]=1 1403 B10R1.13 O=C1CCC(CC1)C(=O)O MCULE-3268045048 [0,0,0,0,0,1|1,0,2]=4 1404 B10R1.13 O=C1CCC(CN1)C(=O)O MCULE-9788917215 [0,0,0,0,0,1|1,0,2]=4 1405 B10R1.13 O=C1CCC(NC1)C(=O)O MCULE-4067834062 [0,0,0,0,0,1|0,0,2]=3 1406 B10R1.13 O=C1CCC(NC1)C(=O)O MCULE-8147757527 [0,0,0,0,0,1|0,0,2]=3 1407 B10R1.13 O=C1CC[C@@H](CN1)C(=O)O MCULE-3191286949 [0,0,0,0,0,1|1,0,2]=4 1408 B10R1.13 O=C1CC[C@@H](CN1)C(=O)O MCULE-9692186311 [0,0,0,0,0,1|1,0,2]=4 1409 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-4350301488 [0,0,0,0,0,1|0,0,2]=3 1410 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-6122427477 [0,0,0,0,0,1|0,0,2]=3 1411 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-7864506900 [0,0,0,0,0,1|0,0,2]=3 1412 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-8690683788 [0,0,0,0,0,1|0,0,2]=3 1413 B10R1.13 O=C1CC[C@H](CN1)C(=O)O MCULE-6590332785 [0,0,0,0,0,1|1,0,2]=4 1414 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-2845724258 [0,0,0,0,0,1|0,0,2]=3 1415 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-4534690891 [0,0,0,0,0,1|0,0,2]=3 1416 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-5755683417 [0,0,0,0,0,1|0,0,2]=3 1417 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-6015971784 [0,0,0,0,0,1|0,0,2]=3 1418 B10R1.13 O=C1CNC(CN1)C(=O)O MCULE-1011618274 [0,0,0,0,0,1|0,0,2]=3 1419 B10R1.13 O=C1CNC(CN1)C(=O)O MCULE-9345081526 [0,0,0,0,0,1|0,0,2]=3 1420 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-1270509503 [0,0,0,0,0,1|0,0,2]=3 1421 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-5912128916 [0,0,0,0,0,1|0,0,2]=3 1422 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-6974754540 [0,0,0,0,0,1|0,0,2]=3 1423 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-9137341829 [0,0,0,0,0,1|0,0,2]=3 1424 B10R1.13 O=C1CN[C@H](CN1)C(=O)O MCULE-8928326150 [0,0,0,0,0,1|0,0,2]=3 1425 B10R1.13 [C@@H]1(CC[C@H](NC1)C(=O)O)O MCULE-1423621462 [0,0,0,0,0,1|0,0,0]=1 1426 B10R1.13 [C@@H]1(CC[C@H](NC1)C(=O)O)O MCULE-1814136074 [0,0,0,0,0,1|0,0,0]=1 1427 B10R1.54 CC(=O)OC1C=CC(C1)O MCULE-6689209340 [0,0,0,0,0,1|2,0,1]=4 1428 B10R1.54 CC(=O)O[C@@H]1C=C[C@@H](C1)O MCULE-7020670709 [0,0,0,0,0,1|2,0,1]=4 1429 B10R1.54 CC(=O)O[C@@H]1C=C[C@@H](C1)O MCULE-9136558773 [0,0,0,0,0,1|2,0,1]=4 1430 B10R1.54 CC(=O)O[C@@H]1C=C[C@H](C1)O MCULE-3237879509 [0,0,0,0,0,1|2,0,1]=4 1431 B10R1.54 CC(=O)O[C@H]1C=C[C@@H](C1)O MCULE-4684454825 [0,0,0,0,0,1|2,0,1]=4 1432 B10R1.54 CC(=O)O[C@H]1C=C[C@@H](C1)O MCULE-7756903175 [0,0,0,0,0,1|2,0,1]=4 1433 B10R1.54 CC(=O)O[C@H]1C=C[C@@H](C1)O MCULE-8920693523 [0,0,0,0,0,1|2,0,1]=4 1434 B10R1.54 CC(=O)O[C@H]1C=C[C@H](C1)O MCULE-2981517362 [0,0,0,0,0,1|2,0,1]=4 1435 B10R1.54 CC(=O)O[C@H]1C=C[C@H](C1)O MCULE-5260414695 [0,0,0,0,0,1|2,0,1]=4 1436 B10R1.54 CC1CCC(C1)CC(=O)O MCULE-2712956835 [0,0,0,0,0,1|2,0,0]=3 1437 B10R1.54 CC1CCC(O1)CC(=O)O MCULE-8857014749 [0,0,0,0,0,1|3,0,0]=4 1438 B10R1.54 CC1CCN(C1)CC(=O)O MCULE-1407049911 [0,0,0,0,0,1|3,0,0]=4 1439 B10R1.54 CC1CCN(C1)CC(=O)O MCULE-9097138381 [0,0,0,0,0,1|3,0,0]=4 1440 B10R1.54 CN1CCC(C1)CC(=O)O MCULE-6518175603 [0,0,0,0,0,1|3,0,0]=4 1441 B10R1.54 CN1CCC(C1)CC(=O)O MCULE-7858558191 [0,0,0,0,0,1|3,0,0]=4 1442 B10R1.54 NC1CCN(C1)CC(=O)O MCULE-5943171118 [0,0,0,0,0,1|3,0,0]=4 1443 B10R1.54 NC1CCN(C1)CC(=O)O MCULE-9229773679 [0,0,0,0,0,1|3,0,0]=4 1444 B10R1.54 N[C@@H]1CCN(C1)CC(=O)O MCULE-2161728364 [0,0,0,0,0,1|3,0,0]=4 1445 B10R1.54 N[C@@H]1CCN(C1)CC(=O)O MCULE-8593996404 [0,0,0,0,0,1|3,0,0]=4 1446 B10R1.54 N[C@@H]1CCN(C1)CC(=O)O MCULE-8985734275 [0,0,0,0,0,1|3,0,0]=4 1447 B10R1.54 N[C@H]1CCN(C1)CC(=O)O MCULE-1503909439 [0,0,0,0,0,1|3,0,0]=4 1448 B10R1.54 N[C@H]1CCN(C1)CC(=O)O MCULE-6977922157 [0,0,0,0,0,1|3,0,0]=4 1449 B10R1.54 O=C(O)CC1CC(CN1)O MCULE-7161298106 [0,0,0,0,0,1|0,0,0]=1 1450 B10R1.54 O=C(O)CC1CC(CN1)O MCULE-8476180516 [0,0,0,0,0,1|0,0,0]=1 1451 B10R1.54 O=C(O)CC1CCC(=O)C1 MCULE-8065311815 [0,0,0,0,0,1|1,0,2]=4 1452 B10R1.54 O=C(O)CC1CCC(C1)O MCULE-1306554926 [0,0,0,0,0,1|1,0,0]=2 1453 B10R1.54 O=C(O)CN1CCC(C1)Br MCULE-3288536521 [0,0,0,0,0,1|3,0,0]=4 1454 B10R1.54 O=C(O)CN1CCC(C1)Cl MCULE-1930405641 [0,0,0,0,0,1|3,0,0]=4 1455 B10R1.54 O=C(O)CN1CCC(C1)I MCULE-4537982496 [0,0,0,0,0,1|3,0,0]=4 1456 B10R1.54 O=C(O)CN1CCC(C1)O MCULE-7707471649 [0,0,0,0,0,1|2,0,0]=3 1457 B10R1.54 O=C(O)CN1CCC(C1)O MCULE-8936002282 [0,0,0,0,0,1|2,0,0]=3 1458 B10R1.54 O=C(O)CN1CC[C@@H](C1)O MCULE-1249814394 [0,0,0,0,0,1|2,0,0]=3 1459 B10R1.54 O=C(O)CN1CC[C@@H](C1)O MCULE-2140738871 [0,0,0,0,0,1|2,0,0]=3 1460 B10R1.54 O=C(O)CN1CC[C@H](C1)O MCULE-4416769889 [0,0,0,0,0,1|2,0,0]=3 1461 B10R1.54 O=C(O)CN1CC[C@H](C1)O MCULE-4926367147 [0,0,0,0,0,1|2,0,0]=3 1462 B10R1.54 O=C(O)C[C@@H]1CC(CN1)O MCULE-5520496479 [0,0,0,0,0,1|0,0,0]=1 1463 B10R1.54 O=C(O)C[C@@H]1CC(CN1)O MCULE-9606256613 [0,0,0,0,0,1|0,0,0]=1 1464 B10R1.54 O=C(O)C[C@@H]1CC[C@@H](C1)O MCULE-2394601749 [0,0,0,0,0,1|1,0,0]=2 1465 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-1516021519 [0,0,0,0,0,1|0,0,0]=1 1466 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-4246846585 [0,0,0,0,0,1|0,0,0]=1 1467 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-5090681884 [0,0,0,0,0,1|0,0,0]=1 1468 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-6554402545 [0,0,0,0,0,1|0,0,0]=1 1469 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-8720083389 [0,0,0,0,0,1|0,0,0]=1 1470 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-9359661762 [0,0,0,0,0,1|0,0,0]=1 1471 B10R1.54 O=C(O)C[C@H]1CCC(=O)C1 MCULE-1700675888 [0,0,0,0,0,1|1,0,2]=4 1472 B10R1.54 O=C(O)C[C@H]1CCC(=O)C1 MCULE-3179723751 [0,0,0,0,0,1|1,0,2]=4 1473 B10R1.54 [C@H]1(C=C[C@@H](C1)OC(=O)C)O MCULE-8509096456 [0,0,0,0,0,1|2,0,1]=4 1474 B10R1.113 CC(=O)N1CCCC(C1)O MCULE-4557043332 [0,0,0,0,0,1|3,0,0]=4 1475 B10R1.113 CC(=O)N1CCC[C@@H](C1)O MCULE-1777848146 [0,0,0,0,0,1|3,0,0]=4 1476 B10R1.113 CC(=O)N1CCC[C@@H](C1)O MCULE-5198604448 [0,0,0,0,0,1|3,0,0]=4 1477 B10R1.113 CC(=O)N1CCC[C@H](C1)O MCULE-4329362874 [0,0,0,0,0,1|3,0,0]=4 1478 B10R1.113 CC(=O)N1CCC[C@H](C1)O MCULE-8344466566 [0,0,0,0,0,1|3,0,0]=4 1479 B10R1.113 CC(C)C1CC(CCN1)O MCULE-2341644755 [0,0,0,0,0,1|2,0,1]=4 1480 B10R1.113 CC(C)[C@@H]1C[C@@H](CCN1)O MCULE-2946595963 [0,0,0,0,0,1|2,0,1]=4 1481 B10R1.113 CC(C)[C@@H]1C[C@@H](CCN1)O MCULE-3688499788 [0,0,0,0,0,1|2,0,1]=4 1482 B10R1.113 CC(C)[C@@H]1C[C@H](CCN1)O MCULE-8503863337 [0,0,0,0,0,1|2,0,1]=4 1483 B10R1.113 CC(C)[C@H]1C[C@@H](CCN1)O MCULE-6741577201 [0,0,0,0,0,1|2,0,1]=4 1484 B10R1.113 CC(C)[C@H]1C[C@H](CCN1)O MCULE-5784918402 [0,0,0,0,0,1|2,0,1]=4 1485 B10R1.113 CC1=CCCC(C1)C(=O)O MCULE-1528958679 [0,0,0,0,0,1|2,0,1]=4 1486 B10R1.113 CC1CC(CCN1)C(=O)O MCULE-7720743223 [0,0,0,0,0,1|2,0,0]=3 1487 B10R1.113 CC1CC(CCN1)C(=O)O MCULE-8584436669 [0,0,0,0,0,1|2,0,0]=3 1488 B10R1.113 CC1CC(CCO1)C(=O)O MCULE-8051149188 [0,0,0,0,0,1|2,0,0]=3 1489 B10R1.113 CC1CCCC(C1)C(=O)O MCULE-1709216331 [0,0,0,0,0,1|2,0,0]=3 1490 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-2752928027 [0,0,0,0,0,1|3,0,0]=4 1491 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-7361502591 [0,0,0,0,0,1|3,0,0]=4 1492 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-7906995060 [0,0,0,0,0,1|3,0,0]=4 1493 B10R1.113 CC1CCCC(O1)C(=O)O MCULE-2545962496 [0,0,0,0,0,1|3,0,0]=4 1494 B10R1.113 CC1CCNC(C1)C(=O)N MCULE-8372541866 [0,0,0,0,0,1|2,0,0]=3 1495 B10R1.113 CC1CCNC(C1)C(=O)O MCULE-7170086856 [0,0,0,0,0,1|1,0,0]=2 1496 B10R1.113 CC1CCNC(C1)C(C)O MCULE-6816426503 [0,0,0,0,0,1|2,0,1]=4 1497 B10R1.113 CC1CNCC(C1)C(=O)O MCULE-6208683659 [0,0,0,0,0,1|1,0,0]=2 1498 B10R1.113 CC1CNCC(O1)C(=O)N MCULE-4373996098 [0,0,0,0,0,1|3,0,0]=4 1499 B10R1.113 CC1CNCC(O1)C(=O)O MCULE-4851002529 [0,0,0,0,0,1|2,0,0]=3 1500 B10R1.113 CC1COCC(N1)C(=O)O MCULE-6739051094 [0,0,0,0,0,1|3,0,0]=4 1501 B10R1.113 CN1CCCC(C1)C(=O)O MCULE-2577677138 [0,0,0,0,0,1|3,0,0]=4 1502 B10R1.113 CN1CCCC(C1)C(=O)O MCULE-9093982856 [0,0,0,0,0,1|3,0,0]=4 1503 B10R1.113 CN1CCC[C@@H](C1)C(=O)O MCULE-3472059995 [0,0,0,0,0,1|3,0,0]=4 1504 B10R1.113 CN1CCC[C@@H](C1)C(=O)O MCULE-3661518240 [0,0,0,0,0,1|3,0,0]=4 1505 B10R1.113 CN1CCC[C@@H](C1)C(=O)O MCULE-4244061094 [0,0,0,0,0,1|3,0,0]=4 1506 B10R1.113 CN1CCC[C@H](C1)C(=O)O MCULE-1368409828 [0,0,0,0,0,1|3,0,0]=4 1507 B10R1.113 CN1CCC[C@H](C1)C(=O)O MCULE-2079226353 [0,0,0,0,0,1|3,0,0]=4 1508 B10R1.113 CN1CCNC(C1)C(=O)N MCULE-3257789162 [0,0,0,0,0,1|3,0,0]=4 1509 B10R1.113 CN1CCNC(C1)C(=O)N MCULE-6597619500 [0,0,0,0,0,1|3,0,0]=4 1510 B10R1.113 CN1CCNC(C1)C(=O)O MCULE-2247528725 [0,0,0,0,0,1|2,0,0]=3 1511 B10R1.113 CN1CCNC(C1)C(=O)O MCULE-9094338983 [0,0,0,0,0,1|2,0,0]=3 1512 B10R1.113 CN1CCN[C@@H](C1)C(=O)O MCULE-5238925665 [0,0,0,0,0,1|2,0,0]=3 1513 B10R1.113 CN1CCN[C@@H](C1)C(=O)O MCULE-6341643779 [0,0,0,0,0,1|2,0,0]=3 1514 B10R1.113 CN1CCN[C@H](C1)C(=O)O MCULE-1518073789 [0,0,0,0,0,1|2,0,0]=3 1515 B10R1.113 CN1CCN[C@H](C1)C(=O)O MCULE-8312508233 [0,0,0,0,0,1|2,0,0]=3 1516 B10R1.113 CN1CCOC(C1)C(=O)O MCULE-5046751827 [0,0,0,0,0,1|3,0,0]=4 1517 B10R1.113 CN1CCOC(C1)C(=O)O MCULE-8819512874 [0,0,0,0,0,1|3,0,0]=4 1518 B10R1.113 CS(=O)C1CCCC(C1)O MCULE-2451665084 [0,0,0,0,0,1|3,0,0]=4 1519 B10R1.113 C[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-4534640450 [0,0,0,0,0,1|2,0,0]=3 1520 B10R1.113 C[C@@H]1CCC[C@@H](N1)C(=O)O MCULE-6827473516 [0,0,0,0,0,1|3,0,0]=4 1521 B10R1.113 C[C@@H]1CCC[C@@H](N1)C(=O)O MCULE-6916060172 [0,0,0,0,0,1|3,0,0]=4 1522 B10R1.113 C[C@@H]1CCC[C@H](C1)C(=O)O MCULE-2658835025 [0,0,0,0,0,1|2,0,0]=3 1523 B10R1.113 C[C@@H]1CCN[C@@H](C1)C(=O)O MCULE-6382189211 [0,0,0,0,0,1|1,0,0]=2 1524 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-3220705725 [0,0,0,0,0,1|1,0,0]=2 1525 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-4368703620 [0,0,0,0,0,1|1,0,0]=2 1526 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-5852226290 [0,0,0,0,0,1|1,0,0]=2 1527 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-8448888283 [0,0,0,0,0,1|1,0,0]=2 1528 B10R1.113 C[C@@H]1CNC[C@@H](C1)C(=O)O MCULE-6787897599 [0,0,0,0,0,1|1,0,0]=2 1529 B10R1.113 C[C@@H]1CNC[C@@H](C1)C(=O)O MCULE-7011808441 [0,0,0,0,0,1|1,0,0]=2 1530 B10R1.113 C[C@@H]1CNC[C@@H](O1)C(=O)O MCULE-1640808929 [0,0,0,0,0,1|2,0,0]=3 1531 B10R1.113 C[C@@H]1CNC[C@@H](O1)C(=O)O MCULE-5152957457 [0,0,0,0,0,1|2,0,0]=3 1532 B10R1.113 C[C@@H]1CNC[C@H](C1)C(=O)O MCULE-8762702780 [0,0,0,0,0,1|1,0,0]=2 1533 B10R1.113 C[C@@H]1C[C@@H](CCN1)C(=O)O MCULE-6500795104 [0,0,0,0,0,1|2,0,0]=3 1534 B10R1.113 C[C@@H]1C[C@@H](CCN1)C(=O)O MCULE-9135304432 [0,0,0,0,0,1|2,0,0]=3 1535 B10R1.113 C[C@H]1CCC[C@@H](C1)C(=O)O MCULE-2151963828 [0,0,0,0,0,1|2,0,0]=3 1536 B10R1.113 C[C@H]1CCC[C@H](C1)C(=O)O MCULE-9191189376 [0,0,0,0,0,1|2,0,0]=3 1537 B10R1.113 C[C@H]1CCN[C@@H](C1)C(=O)O MCULE-3797871093 [0,0,0,0,0,1|1,0,0]=2 1538 B10R1.113 C[C@H]1CCN[C@@H](C1)C(=O)O MCULE-3813657182 [0,0,0,0,0,1|1,0,0]=2 1539 B10R1.113 C[C@H]1CCN[C@H](C1)C(=O)O MCULE-8048617173 [0,0,0,0,0,1|1,0,0]=2 1540 B10R1.113 C[C@H]1CNC[C@@H](C1)C(=O)O MCULE-9182357479 [0,0,0,0,0,1|1,0,0]=2 1541 B10R1.113 C[C@H]1CNC[C@H](C1)C(=O)O MCULE-7208949681 [0,0,0,0,0,1|1,0,0]=2 1542 B10R1.113 C[C@H]1C[C@H](CCN1)C(=O)O MCULE-3777490064 [0,0,0,0,0,1|2,0,0]=3 1543 B10R1.113 C[C@H]1C[C@H](CCN1)C(=O)O MCULE-7587755997 [0,0,0,0,0,1|2,0,0]=3 1544 B10R1.113 NC(=O)C1CCCC(C1)N MCULE-5887465193 [0,0,0,0,0,1|3,0,0]=4 1545 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-1352569589 [0,0,0,0,0,1|3,0,0]=4 1546 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-3084012877 [0,0,0,0,0,1|3,0,0]=4 1547 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-3571668618 [0,0,0,0,0,1|3,0,0]=4 1548 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-3930179934 [0,0,0,0,0,1|3,0,0]=4 1549 B10R1.113 NC1C=CCC(C1)C(=O)O MCULE-4308750395 [0,0,0,0,0,1|2,0,1]=4 1550 B10R1.113 NC1C=CCC(C1)C(=O)O MCULE-5984594154 [0,0,0,0,0,1|2,0,1]=4 1551 B10R1.113 NC1CCCC(C1)C(=O)O MCULE-1721377644 [0,0,0,0,0,1|2,0,0]=3 1552 B10R1.113 NC1CCCC(C1)C(=O)O MCULE-3598251126 [0,0,0,0,0,1|2,0,0]=3 1553 B10R1.113 NC1CCOC(C1)C(=O)O MCULE-7071803947 [0,0,0,0,0,1|2,0,0]=3 1554 B10R1.113 NC1CCOC(C1)C(=O)O MCULE-7129710557 [0,0,0,0,0,1|2,0,0]=3 1555 B10R1.113 N[C@@H]1C=CCC(C1)C(=O)O MCULE-5349723370 [0,0,0,0,0,1|2,0,1]=4 1556 B10R1.113 N[C@@H]1C=CCC(C1)C(=O)O MCULE-8912699325 [0,0,0,0,0,1|2,0,1]=4 1557 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-5563204448 [0,0,0,0,0,1|2,0,0]=3 1558 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-5798146682 [0,0,0,0,0,1|2,0,0]=3 1559 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-8105249419 [0,0,0,0,0,1|2,0,0]=3 1560 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-9161171059 [0,0,0,0,0,1|2,0,0]=3 1561 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-2713838733 [0,0,0,0,0,1|2,0,0]=3 1562 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-2810146308 [0,0,0,0,0,1|2,0,0]=3 1563 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-3141762073 [0,0,0,0,0,1|2,0,0]=3 1564 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-6970045085 [0,0,0,0,0,1|2,0,0]=3 1565 B10R1.113 N[C@@H]1CCO[C@H](C1)C(=O)O MCULE-5264166397 [0,0,0,0,0,1|2,0,0]=3 1566 B10R1.113 N[C@@H]1CCO[C@H](C1)C(=O)O MCULE-6153195788 [0,0,0,0,0,1|2,0,0]=3 1567 B10R1.113 N[C@H]1C=CCC(C1)C(=O)O MCULE-1166952810 [0,0,0,0,0,1|2,0,1]=4 1568 B10R1.113 N[C@H]1C=CCC(C1)C(=O)O MCULE-4761766781 [0,0,0,0,0,1|2,0,1]=4 1569 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-3283868687 [0,0,0,0,0,1|2,0,0]=3 1570 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-5009823003 [0,0,0,0,0,1|2,0,0]=3 1571 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-6716939610 [0,0,0,0,0,1|2,0,0]=3 1572 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-8264766500 [0,0,0,0,0,1|2,0,0]=3 1573 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-1016300044 [0,0,0,0,0,1|2,0,0]=3 1574 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-2730367375 [0,0,0,0,0,1|2,0,0]=3 1575 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-3326410223 [0,0,0,0,0,1|2,0,0]=3 1576 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-3370817462 [0,0,0,0,0,1|2,0,0]=3 1577 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-3467671648 [0,0,0,0,0,1|2,0,0]=3 1578 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-7929171022 [0,0,0,0,0,1|2,0,0]=3 1579 B10R1.113 O=C(O)C1=CC(CCC1)O MCULE-3053514968 [0,0,0,0,0,1|1,0,2]=4 1580 B10R1.113 O=C(O)C1CC(CCN1)O MCULE-2758341308 [0,0,0,0,0,1|0,0,0]=1 1581 B10R1.113 O=C(O)C1CC(CCN1)O MCULE-7585455422 [0,0,0,0,0,1|0,0,0]=1 1582 B10R1.113 O=C(O)C1CCCC(C1)F MCULE-2589850350 [0,0,0,0,0,1|2,0,0]=3 1583 B10R1.113 O=C(O)C1CCCC(C1)O MCULE-9068909742 [0,0,0,0,0,1|1,0,0]=2 1584 B10R1.113 O=C(O)C1CNCC(C1)O MCULE-1307689360 [0,0,0,0,0,1|0,0,0]=1 1585 B10R1.113 O=C(O)C1CNCC(C1)O MCULE-6671293935 [0,0,0,0,0,1|0,0,0]=1 1586 B10R1.113 O=C(O)C1CS(=O)CCN1 MCULE-2725116552 [0,0,0,0,0,1|1,0,1]=3 1587 B10R1.113 O=C(O)C1CS(=O)CCN1 MCULE-7493333189 [0,0,0,0,0,1|1,0,1]=3 1588 B10R1.113 O=C(O)[C@@H]1CC=C[C@@H](C1)O MCULE-3205925226 [0,0,0,0,0,1|1,0,1]=3 1589 B10R1.113 O=C(O)[C@@H]1CCC[C@@H](C1)O MCULE-1509835362 [0,0,0,0,0,1|1,0,0]=2 1590 B10R1.113 O=C(O)[C@@H]1CCC[C@@H](C1)O MCULE-2282540668 [0,0,0,0,0,1|1,0,0]=2 1591 B10R1.113 O=C(O)[C@@H]1CCC[C@H](C1)O MCULE-2678948022 [0,0,0,0,0,1|1,0,0]=2 1592 B10R1.113 O=C(O)[C@@H]1CCC[C@H](C1)O MCULE-6048774329 [0,0,0,0,0,1|1,0,0]=2 1593 B10R1.113 O=C(O)[C@@H]1C[C@@H](CCN1)O MCULE-1390000123 [0,0,0,0,0,1|0,0,0]=1 1594 B10R1.113 O=C(O)[C@@H]1C[C@@H](CCN1)O MCULE-5873942206 [0,0,0,0,0,1|0,0,0]=1 1595 B10R1.113 O=C(O)[C@@H]1C[C@H](CCN1)O MCULE-5317131791 [0,0,0,0,0,1|0,0,0]=1 1596 B10R1.113 O=C(O)[C@H]1CCC[C@@H](C1)O MCULE-1308626340 [0,0,0,0,0,1|1,0,0]=2 1597 B10R1.113 O=C(O)[C@H]1CCC[C@@H](C1)O MCULE-5789638591 [0,0,0,0,0,1|1,0,0]=2 1598 B10R1.113 O=C(O)[C@H]1CCC[C@H](C1)O MCULE-3370494896 [0,0,0,0,0,1|1,0,0]=2 1599 B10R1.113 O=C(O)[C@H]1CCC[C@H](C1)O MCULE-3728932412 [0,0,0,0,0,1|1,0,0]=2 1600 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-1474484031 [0,0,0,0,0,1|0,0,0]=1 1601 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-1820373402 [0,0,0,0,0,1|0,0,0]=1 1602 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-4771226737 [0,0,0,0,0,1|0,0,0]=1 1603 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-4907773186 [0,0,0,0,0,1|0,0,0]=1 1604 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-8175624129 [0,0,0,0,0,1|0,0,0]=1 1605 B10R1.113 O=C(O)[C@H]1C[C@H](CCN1)O MCULE-4751772547 [0,0,0,0,0,1|0,0,0]=1 1606 B10R1.113 O=C(O)[C@H]1C[C@H](CCN1)O MCULE-6686826243 [0,0,0,0,0,1|0,0,0]=1 1607 B10R1.113 O=C1CC(CCN1)C(=O)O MCULE-8037650535 [0,0,0,0,0,1|1,0,2]=4 1608 B10R1.113 O=C1CC(CNN1)C(=O)O MCULE-4653652849 [0,0,0,0,0,1|1,0,2]=4 1609 B10R1.113 O=C1CC(CNN1)C(=O)O MCULE-5555795045 [0,0,0,0,0,1|1,0,2]=4 1610 B10R1.113 O=C1CCCC(C1)C(=O)O MCULE-6286773194 [0,0,0,0,0,1|1,0,2]=4 1611 B10R1.113 O=C1CCC[C@@H](C1)C(=O)O MCULE-5396925186 [0,0,0,0,0,1|1,0,2]=4 1612 B10R1.113 O=C1CCC[C@H](C1)C(=O)O MCULE-8936667281 [0,0,0,0,0,1|1,0,2]=4 1613 B10R1.113 O=C1CCNC(C1)C(=O)O MCULE-6916176336 [0,0,0,0,0,1|0,0,2]=3 1614 B10R1.113 O=C1CCNC(C1)C(=O)O MCULE-9262761817 [0,0,0,0,0,1|0,0,2]=3 1615 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-1115212106 [0,0,0,0,0,1|0,0,2]=3 1616 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-5896394571 [0,0,0,0,0,1|0,0,2]=3 1617 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-5937606037 [0,0,0,0,0,1|0,0,2]=3 1618 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-7073629862 [0,0,0,0,0,1|0,0,2]=3 1619 B10R1.113 O=C1CNCC(N1)C(=O)O MCULE-4117148380 [0,0,0,0,0,1|1,0,2]=4 1620 B10R1.113 O=C1CNC[C@@H](N1)C(=O)O MCULE-3006600193 [0,0,0,0,0,1|1,0,2]=4 1621 B10R1.113 O=C1CNC[C@H](N1)C(=O)O MCULE-4345470043 [0,0,0,0,0,1|1,0,2]=4 1622 B10R1.113 O=C1C[C@@H](CCN1)C(=O)O MCULE-5205458306 [0,0,0,0,0,1|1,0,2]=4 1623 B10R1.113 O=C1C[C@H](CCN1)C(=O)O MCULE-6254957663 [0,0,0,0,0,1|1,0,2]=4 1624 B10R1.113 O=C1C[C@H](CCN1)C(=O)O MCULE-9670666580 [0,0,0,0,0,1|1,0,2]=4 1625 B10R1.113 [C@@H]1(CCCC(N1)C)C(=O)O MCULE-7930307305 [0,0,0,0,0,1|3,0,0]=4 1626 B10R1.113 [C@H]1(CCCN(C1)C)C(=O)O MCULE-4364645223 [0,0,0,0,0,1|3,0,0]=4 1627 B10R1.113 [C@H]1(CCC[C@H](C1)C(=O)O)N MCULE-2539251802 [0,0,0,0,0,1|2,0,0]=3 1628 B10R1.113 [C@H]1(CCC[C@H](C1)C(=O)O)N MCULE-4407634771 [0,0,0,0,0,1|2,0,0]=3 1629 B7R0.3 C#CCCC(O)CN MCULE-7845137108 [1,0,1,0,0,0|1,0,1]=4 1630 B7R0.3 C=CCCC(C)CN MCULE-2246705867 [1,0,1,0,0,0|2,0,0]=4 1631 B7R0.3 C=CCCC(C)CN MCULE-5238030814 [1,0,1,0,0,0|2,0,0]=4 1632 B7R0.3 C=CCCC(N)CN MCULE-3448579919 [1,0,1,0,0,0|2,0,0]=4 1633 B7R0.3 C=CCCC(O)CC MCULE-1265881694 [1,0,1,0,0,0|2,0,0]=4 1634 B7R0.3 C=CCCC(O)CCl MCULE-2554338674 [1,0,1,0,0,0|2,0,0]=4 1635 B7R0.3 C=CCCC(O)CN MCULE-4695723420 [1,0,1,0,0,0|1,0,0]=3 1636 B7R0.3 C=CCC[C@@H](O)CO MCULE-6352864696 [1,0,1,0,0,0|2,0,0]=4 1637 B7R0.3 CC(CN)CCCO MCULE-2908684674 [1,0,1,0,0,0|1,0,1]=4 1638 B7R0.3 CC(CN)CCCO MCULE-5608783947 [1,0,1,0,0,0|1,0,1]=4 1639 B7R0.3 CC(CN)CCCO MCULE-9269954426 [1,0,1,0,0,0|1,0,1]=4 1640 B7R0.3 CC(CO)CCCO MCULE-8589885622 [1,0,1,0,0,0|1,0,1]=4 1641 B7R0.3 CC(CO)NCCO MCULE-5180763491 [1,0,1,0,0,0|0,0,1]=3 1642 B7R0.3 CCC(C)NCCO MCULE-1340916666 [1,0,1,0,0,0|1,0,1]=4 1643 B7R0.3 CCC(O)CCCO MCULE-1099760826 [1,0,1,0,0,0|1,0,1]=4 1644 B7R0.3 CCCCC(O)CN MCULE-1383380728 [1,0,1,0,0,0|1,0,1]=4 1645 B7R0.3 CCCC[C@H](C)C=O MCULE-7821873587 [1,0,1,0,0,0|2,0,0]=4 1646 B7R0.3 CCCNC(C)CO MCULE-6575712324 [1,0,1,0,0,0|1,0,1]=4 1647 B7R0.3 CSCCC(O)CN MCULE-3835830442 [1,0,1,0,0,0|2,0,0]=4 1648 B7R0.3 C[C@@H](CN)CCCO MCULE-2859776250 [1,0,1,0,0,0|1,0,1]=4 1649 B7R0.3 C[C@@H](CN)CCCO MCULE-3245433953 [1,0,1,0,0,0|1,0,1]=4 1650 B7R0.3 C[C@@H](CN)CCCO MCULE-7698870351 [1,0,1,0,0,0|1,0,1]=4 1651 B7R0.3 C[C@@H](CN)CCCO MCULE-9900676606 [1,0,1,0,0,0|1,0,1]=4 1652 B7R0.3 OCCCC(O)CO MCULE-3529953491 [1,0,1,0,0,0|1,0,1]=4 1653 B7R0.4 C#CCCCC(=O)O MCULE-7464892335 [1,0,1,0,0,0|1,0,1]=4 1654 B7R0.4 C#CCNCC(=O)O MCULE-3308171795 [1,0,1,0,0,0|0,0,2]=4 1655 B7R0.4 C#CCNCC(=O)O MCULE-7200045848 [1,0,1,0,0,0|0,0,2]=4 1656 B7R0.4 C(=C/C(=O)O)\CCC MCULE-7580507705 [1,0,1,0,0,0|1,0,1]=4 1657 B7R0.4 C(=C/CC(=O)O)\CC MCULE-2731794411 [1,0,1,0,0,0|1,0,1]=4 1658 B7R0.4 C=CCCCC(=O)O MCULE-6043142578 [1,0,1,0,0,0|1,0,1]=4 1659 B7R0.4 C=CCCCC(C)O MCULE-6692920526 [1,0,1,0,0,0|2,0,0]=4 1660 B7R0.4 C=CCNCC(=O)O MCULE-2925626447 [1,0,1,0,0,0|0,0,2]=4 1661 B7R0.4 C=CCNCC(=O)O MCULE-6980667867 [1,0,1,0,0,0|0,0,2]=4 1662 B7R0.4 C=CCNCC(C)C MCULE-1424825920 [1,0,1,0,0,0|2,0,0]=4 1663 B7R0.4 C=CCNCC(C)C MCULE-4634875589 [1,0,1,0,0,0|2,0,0]=4 1664 B7R0.4 CC(=O)CCCCBr MCULE-8801446022 [1,0,1,0,0,0|2,0,0]=4 1665 B7R0.4 CC(=O)CCCCCl MCULE-2883443563 [1,0,1,0,0,0|2,0,0]=4 1666 B7R0.4 CC(=O)CCCCO MCULE-9846338144 [1,0,1,0,0,0|2,0,0]=4 1667 B7R0.4 CC(=O)NCCCN MCULE-6321543480 [1,0,1,0,0,0|2,0,0]=4 1668 B7R0.4 CC(=O)NCCCN MCULE-8441492497 [1,0,1,0,0,0|2,0,0]=4 1669 B7R0.4 CC(C)CCCC=O MCULE-2846844109 [1,0,1,0,0,0|2,0,0]=4 1670 B7R0.4 CC(C)CNCCO MCULE-3948234461 [1,0,1,0,0,0|1,0,1]=4 1671 B7R0.4 CC(C)CNCCO MCULE-6673201049 [1,0,1,0,0,0|1,0,1]=4 1672 B7R0.4 CC(O)CCCCO MCULE-3790969400 [1,0,1,0,0,0|1,0,1]=4 1673 B7R0.4 CC(O)CNCCN MCULE-3904214677 [1,0,1,0,0,0|1,0,1]=4 1674 B7R0.4 CC(O)CNCCO MCULE-4873845500 [1,0,1,0,0,0|0,0,1]=3 1675 B7R0.4 CC(O)CSCCO MCULE-8885458360 [1,0,1,0,0,0|1,0,1]=4 1676 B7R0.4 CCC=CCC(=O)O MCULE-5031939966 [1,0,1,0,0,0|1,0,1]=4 1677 B7R0.4 CCCC#CC(=O)O MCULE-1682387091 [1,0,1,0,0,0|1,0,1]=4 1678 B7R0.4 CCCC=CC(=O)O MCULE-6995077492 [1,0,1,0,0,0|1,0,1]=4 1679 B7R0.4 CCCCCC(=O)C MCULE-6017828463 [1,0,1,0,0,0|2,0,0]=4 1680 B7R0.4 CCCCCC(=O)Cl MCULE-5446850478 [1,0,1,0,0,0|2,0,0]=4 1681 B7R0.4 CCCCCC(=O)N MCULE-3215992514 [1,0,1,0,0,0|2,0,0]=4 1682 B7R0.4 CCCCCC(=O)O MCULE-1671810139 [1,0,1,0,0,0|1,0,0]=3 1683 B7R0.4 CCCCCC(=O)[O-] MCULE-5310584661 [1,0,1,0,0,0|1,0,1]=4 1684 B7R0.4 CCCCCC(=O)[O-] MCULE-9495078126 [1,0,1,0,0,0|1,0,1]=4 1685 B7R0.4 CCCNCC(=O)N MCULE-2330202708 [1,0,1,0,0,0|1,0,0]=3 1686 B7R0.4 CCCNCC(=O)N MCULE-3731054780 [1,0,1,0,0,0|1,0,0]=3 1687 B7R0.4 CCCNCC(=O)O MCULE-4384128915 [1,0,1,0,0,0|0,0,0]=2 1688 B7R0.4 CCCNCC(=O)O MCULE-7537317046 [1,0,1,0,0,0|0,0,0]=2 1689 B7R0.4 CCCNCC(C)O MCULE-8110237473 [1,0,1,0,0,0|1,0,1]=4 1690 B7R0.4 CCCOCC(=O)O MCULE-6841640058 [1,0,1,0,0,0|1,0,0]=3 1691 B7R0.4 CCCSCC(=O)C MCULE-8321448629 [1,0,1,0,0,0|2,0,0]=4 1692 B7R0.4 CCCSCC(=O)O MCULE-7463688573 [1,0,1,0,0,0|1,0,0]=3 1693 B7R0.4 CCNCCC(=O)O MCULE-4226597657 [1,0,1,0,0,0|2,0,0]=4 1694 B7R0.4 CCNCCC(=O)O MCULE-9183951914 [1,0,1,0,0,0|2,0,0]=4 1695 B7R0.4 CCOCCC(=O)O MCULE-3962084059 [1,0,1,0,0,0|2,0,0]=4 1696 B7R0.4 CCSCCC(=O)O MCULE-9385724904 [1,0,1,0,0,0|2,0,0]=4 1697 B7R0.4 CNCCCC(=O)O MCULE-7598762485 [1,0,1,0,0,0|2,0,0]=4 1698 B7R0.4 CNCCCC(=O)O MCULE-7877286915 [1,0,1,0,0,0|2,0,0]=4 1699 B7R0.4 COCCCC(=O)O MCULE-3165881573 [1,0,1,0,0,0|2,0,0]=4 1700 B7R0.4 CSCCCC(=O)O MCULE-2126637794 [1,0,1,0,0,0|2,0,0]=4 1701 B7R0.4 N#CCCCC(=O)O MCULE-9921837071 [1,0,1,0,0,0|0,0,2]=4 1702 B7R0.4 NC(=O)CCCCBr MCULE-4949681497 [1,0,1,0,0,0|2,0,0]=4 1703 B7R0.4 NC(=O)CCCCCl MCULE-7937142112 [1,0,1,0,0,0|2,0,0]=4 1704 B7R0.4 NC(=O)CCCCO MCULE-4820227146 [1,0,1,0,0,0|2,0,0]=4 1705 B7R0.4 NC(=O)COCCO MCULE-3158372920 [1,0,1,0,0,0|2,0,0]=4 1706 B7R0.4 NC(=O)CSCCO MCULE-8225407259 [1,0,1,0,0,0|2,0,0]=4 1707 B7R0.4 NCCCCC(=O)N MCULE-3198962228 [1,0,1,0,0,0|1,0,0]=3 1708 B7R0.4 NCCCCC(=O)N MCULE-7986221705 [1,0,1,0,0,0|1,0,0]=3 1709 B7R0.4 NCCCCC(=O)O MCULE-1155829905 [1,0,1,0,0,0|0,0,0]=2 1710 B7R0.4 NCCCCC(=O)O MCULE-3920398524 [1,0,1,0,0,0|0,0,0]=2 1711 B7R0.4 NCCCCC(=O)O MCULE-4404796498 [1,0,1,0,0,0|0,0,0]=2 1712 B7R0.4 NCCCCC(=O)O MCULE-4971679857 [1,0,1,0,0,0|0,0,0]=2 1713 B7R0.4 NCCCNC(=O)N MCULE-1109440921 [1,0,1,0,0,0|2,0,0]=4 1714 B7R0.4 NCCCNC(=O)N MCULE-3933221897 [1,0,1,0,0,0|2,0,0]=4 1715 B7R0.4 NCCCOS(=O)O MCULE-8389295774 [1,0,1,0,0,0|2,0,0]=4 1716 B7R0.4 NCCNCC(=O)O MCULE-9689592343 [1,0,1,0,0,0|1,0,0]=3 1717 B7R0.4 NCCNCC(=O)O MCULE-9795251557 [1,0,1,0,0,0|1,0,0]=3 1718 B7R0.4 NCCOCC(=O)O MCULE-2375694645 [1,0,1,0,0,0|1,0,0]=3 1719 B7R0.4 NCCOCC(=O)O MCULE-5877065986 [1,0,1,0,0,0|1,0,0]=3 1720 B7R0.4 NCCSCC(=O)O MCULE-5565800206 [1,0,1,0,0,0|1,0,0]=3 1721 B7R0.4 NCCSCC(=O)O MCULE-8322098978 [1,0,1,0,0,0|1,0,0]=3 1722 B7R0.4 NOCCCC(=O)O MCULE-4102473285 [1,0,1,0,0,0|1,0,0]=3 1723 B7R0.4 NOCCCC(=O)O MCULE-7068985203 [1,0,1,0,0,0|1,0,0]=3 1724 B7R0.4 O=C(Cl)CCCCBr MCULE-5574450546 [1,0,1,0,0,0|2,0,0]=4 1725 B7R0.4 O=C(Cl)CCCCCl MCULE-9605707894 [1,0,1,0,0,0|2,0,0]=4 1726 B7R0.4 O=C(Cl)CCCCF MCULE-8110878511 [1,0,1,0,0,0|2,0,0]=4 1727 B7R0.4 O=C(O)C#CCCO MCULE-5211042941 [1,0,1,0,0,0|1,0,1]=4 1728 B7R0.4 O=C(O)CCCCBr MCULE-2655919094 [1,0,1,0,0,0|1,0,0]=3 1729 B7R0.4 O=C(O)CCCCCl MCULE-4094641005 [1,0,1,0,0,0|1,0,0]=3 1730 B7R0.4 O=C(O)CCCCO MCULE-8816195933 [1,0,1,0,0,0|1,0,0]=3 1731 B7R0.4 O=C(O)CCCCS MCULE-2427465795 [1,0,1,0,0,0|1,0,0]=3 1732 B7R0.4 O=C(O)CNCCO MCULE-7501311949 [1,0,1,0,0,0|0,0,0]=2 1733 B7R0.4 O=C(O)COCCBr MCULE-4593325557 [1,0,1,0,0,0|2,0,0]=4 1734 B7R0.4 O=C(O)COCCCl MCULE-2978816248 [1,0,1,0,0,0|2,0,0]=4 1735 B7R0.4 O=C(O)COCCF MCULE-9820799514 [1,0,1,0,0,0|2,0,0]=4 1736 B7R0.4 O=C(O)COCCO MCULE-8297137880 [1,0,1,0,0,0|1,0,0]=3 1737 B7R0.4 O=C(O)CSCCCl MCULE-5204967583 [1,0,1,0,0,0|2,0,0]=4 1738 B7R0.4 O=C(O)CSCCO MCULE-1062560307 [1,0,1,0,0,0|1,0,0]=3 1739 B7R0.4 O=C([O-])CCCCO MCULE-3836827182 [1,0,1,0,0,0|1,0,1]=4 1740 B7R0.4 O=C([O-])COCCO MCULE-7093344226 [1,0,1,0,0,0|1,0,1]=4 1741 B7R0.4 O=CCCCC(=O)O MCULE-8389457571 [1,0,1,0,0,0|1,0,1]=4 1742 B7R0.5 C#CCC(C)C(=O)O MCULE-4819055703 [1,0,1,0,0,0|1,0,1]=4 1743 B7R0.5 C#CCC(N)C(=O)O MCULE-2022398365 [1,0,1,0,0,0|0,0,2]=4 1744 B7R0.5 C#CCC(N)C(=O)O MCULE-2451098139 [1,0,1,0,0,0|0,0,2]=4 1745 B7R0.5 C#CCC(N)C(=O)O MCULE-4330300997 [1,0,1,0,0,0|0,0,2]=4 1746 B7R0.5 C#CCC(N)C(=O)O MCULE-5100293043 [1,0,1,0,0,0|0,0,2]=4 1747 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-1266511504 [1,0,1,0,0,0|0,0,2]=4 1748 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-2589808316 [1,0,1,0,0,0|0,0,2]=4 1749 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-4703021434 [1,0,1,0,0,0|0,0,2]=4 1750 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-5616417783 [1,0,1,0,0,0|0,0,2]=4 1751 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-1593368546 [1,0,1,0,0,0|0,0,2]=4 1752 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-5683421535 [1,0,1,0,0,0|0,0,2]=4 1753 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-7302855511 [1,0,1,0,0,0|0,0,2]=4 1754 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-9256626051 [1,0,1,0,0,0|0,0,2]=4 1755 B7R0.5 C=C(CCC)C(=O)O MCULE-5702167426 [1,0,1,0,0,0|1,0,1]=4 1756 B7R0.5 C=C(CCO)C(=O)O MCULE-3336434079 [1,0,1,0,0,0|0,0,2]=4 1757 B7R0.5 C=CCC(C)C(=O)O MCULE-2912410432 [1,0,1,0,0,0|1,0,1]=4 1758 B7R0.5 C=CCC(N)C(=O)O MCULE-1550468430 [1,0,1,0,0,0|0,0,2]=4 1759 B7R0.5 C=CCC(N)C(=O)O MCULE-1783682768 [1,0,1,0,0,0|0,0,2]=4 1760 B7R0.5 C=CCC(N)C(=O)O MCULE-8721864064 [1,0,1,0,0,0|0,0,2]=4 1761 B7R0.5 C=CCC(N)C(=O)O MCULE-9091562338 [1,0,1,0,0,0|0,0,2]=4 1762 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-3817126030 [1,0,1,0,0,0|0,0,2]=4 1763 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-5479618260 [1,0,1,0,0,0|0,0,2]=4 1764 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-6719393730 [1,0,1,0,0,0|0,0,2]=4 1765 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-7577627870 [1,0,1,0,0,0|0,0,2]=4 1766 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-2073484196 [1,0,1,0,0,0|0,0,2]=4 1767 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-3267648941 [1,0,1,0,0,0|0,0,2]=4 1768 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-4183531139 [1,0,1,0,0,0|0,0,2]=4 1769 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-8225762047 [1,0,1,0,0,0|0,0,2]=4 1770 B7R0.5 CC(=O)C(C)CCBr MCULE-4705039689 [1,0,1,0,0,0|2,0,0]=4 1771 B7R0.5 CC(=O)C(C)CCCl MCULE-2960091698 [1,0,1,0,0,0|2,0,0]=4 1772 B7R0.5 CC(=O)C(C)CCO MCULE-3907160101 [1,0,1,0,0,0|1,0,0]=3 1773 B7R0.5 CC(=O)C(Cl)CCO MCULE-1606704903 [1,0,1,0,0,0|2,0,0]=4 1774 B7R0.5 CC(=O)N(C)CCO MCULE-4135818139 [1,0,1,0,0,0|2,0,0]=4 1775 B7R0.5 CC(CCCl)C(=O)Cl MCULE-4844969943 [1,0,1,0,0,0|2,0,0]=4 1776 B7R0.5 CC(CCN)C(=O)O MCULE-8098419324 [1,0,1,0,0,0|1,0,0]=3 1777 B7R0.5 CC(CCN)C(=O)O MCULE-8509861009 [1,0,1,0,0,0|1,0,0]=3 1778 B7R0.5 CC(CCO)C(=O)N MCULE-3037868887 [1,0,1,0,0,0|1,0,0]=3 1779 B7R0.5 CC(CCO)C(=O)O MCULE-9724304469 [1,0,1,0,0,0|0,0,0]=2 1780 B7R0.5 CC(CCO)C(=O)[O-] MCULE-2278638513 [1,0,1,0,0,0|0,0,1]=3 1781 B7R0.5 CC(NC=O)C(=O)O MCULE-7277951464 [1,0,1,0,0,0|0,0,2]=4 1782 B7R0.5 CC/C=C(\C)/C(=O)O MCULE-1290613859 [1,0,1,0,0,0|1,0,1]=4 1783 B7R0.5 CC=CC(C)C(=O)O MCULE-5584906296 [1,0,1,0,0,0|1,0,1]=4 1784 B7R0.5 CCC=C(C)C(=O)O MCULE-5045441145 [1,0,1,0,0,0|1,0,1]=4 1785 B7R0.5 CCCC(=O)C(=O)O MCULE-5281491858 [1,0,1,0,0,0|1,0,1]=4 1786 B7R0.5 CCCC(Br)C(=O)C MCULE-2062903416 [1,0,1,0,0,0|2,0,0]=4 1787 B7R0.5 CCCC(Br)C(=O)O MCULE-4304229911 [1,0,1,0,0,0|1,0,0]=3 1788 B7R0.5 CCCC(C)C(=O)C MCULE-5585795289 [1,0,1,0,0,0|2,0,0]=4 1789 B7R0.5 CCCC(C)C(=O)Cl MCULE-4855016209 [1,0,1,0,0,0|2,0,0]=4 1790 B7R0.5 CCCC(C)C(=O)N MCULE-1948746391 [1,0,1,0,0,0|2,0,0]=4 1791 B7R0.5 CCCC(C)C(=O)O MCULE-7779384365 [1,0,1,0,0,0|1,0,0]=3 1792 B7R0.5 CCCC(Cl)C(=O)O MCULE-1265367924 [1,0,1,0,0,0|1,0,0]=3 1793 B7R0.5 CCCC(F)C(=O)O MCULE-5551678948 [1,0,1,0,0,0|1,0,0]=3 1794 B7R0.5 CCCC(N)C(=O)N MCULE-5159221123 [1,0,1,0,0,0|1,0,0]=3 1795 B7R0.5 CCCC(N)C(=O)N MCULE-5742773956 [1,0,1,0,0,0|1,0,0]=3 1796 B7R0.5 CCCC(N)C(=O)O MCULE-1684743992 [1,0,1,0,0,0|0,0,0]=2 1797 B7R0.5 CCCC(N)C(=O)O MCULE-5263067403 [1,0,1,0,0,0|0,0,0]=2 1798 B7R0.5 CCCC(N)C(=O)O MCULE-7151907627 [1,0,1,0,0,0|0,0,0]=2 1799 B7R0.5 CCCC(O)C(=O)N MCULE-3143432132 [1,0,1,0,0,0|2,0,0]=4 1800 B7R0.5 CCCC(O)C(=O)O MCULE-8533446195 [1,0,1,0,0,0|1,0,0]=3 1801 B7R0.5 CCCC(O)C(=O)O MCULE-9586449213 [1,0,1,0,0,0|1,0,0]=3 1802 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-1302378905 [1,0,1,0,0,0|0,0,0]=2 1803 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-5246507817 [1,0,1,0,0,0|0,0,0]=2 1804 B7R0.5 CCC[C@@H](O)C(=O)O MCULE-2742119346 [1,0,1,0,0,0|1,0,0]=3 1805 B7R0.5 CCC[C@H](Br)C(=O)O MCULE-3070253588 [1,0,1,0,0,0|1,0,0]=3 1806 B7R0.5 CCC[C@H](N)C(=O)N MCULE-2163059771 [1,0,1,0,0,0|1,0,0]=3 1807 B7R0.5 CCC[C@H](N)C(=O)N MCULE-4687172013 [1,0,1,0,0,0|1,0,0]=3 1808 B7R0.5 CCC[C@H](N)C(=O)N MCULE-7482592029 [1,0,1,0,0,0|1,0,0]=3 1809 B7R0.5 CCC[C@H](N)C(=O)N MCULE-9639796243 [1,0,1,0,0,0|1,0,0]=3 1810 B7R0.5 CCC[C@H](N)C(=O)O MCULE-2890516597 [1,0,1,0,0,0|0,0,0]=2 1811 B7R0.5 CCC[C@H](N)C(=O)O MCULE-4690406880 [1,0,1,0,0,0|0,0,0]=2 1812 B7R0.5 CCC[C@H](N)C(=O)O MCULE-9323049450 [1,0,1,0,0,0|0,0,0]=2 1813 B7R0.5 CCC[C@H](O)C(=O)O MCULE-6533548138 [1,0,1,0,0,0|1,0,0]=3 1814 B7R0.5 CCC[C@H](O)C(=O)O MCULE-8321722254 [1,0,1,0,0,0|1,0,0]=3 1815 B7R0.5 CCNC(=O)C(=O)O MCULE-1213485294 [1,0,1,0,0,0|1,0,1]=4 1816 B7R0.5 CCNC(C)C(=O)N MCULE-2861818493 [1,0,1,0,0,0|1,0,0]=3 1817 B7R0.5 CCNC(C)C(=O)N MCULE-6110291237 [1,0,1,0,0,0|1,0,0]=3 1818 B7R0.5 CCNC(C)C(=O)O MCULE-5445574810 [1,0,1,0,0,0|0,0,0]=2 1819 B7R0.5 CCNC(C)C(=O)O MCULE-5666785247 [1,0,1,0,0,0|0,0,0]=2 1820 B7R0.5 CCN[C@H](C)C(=O)O MCULE-9676358201 [1,0,1,0,0,0|0,0,0]=2 1821 B7R0.5 CCOC(C)C(=O)O MCULE-2185795311 [1,0,1,0,0,0|1,0,0]=3 1822 B7R0.5 CCSC(C)C(=O)O MCULE-9817243573 [1,0,1,0,0,0|1,0,0]=3 1823 B7R0.5 CNCC(C)C(=O)O MCULE-4255373615 [1,0,1,0,0,0|2,0,0]=4 1824 B7R0.5 CNCC(C)C(=O)O MCULE-8076489545 [1,0,1,0,0,0|2,0,0]=4 1825 B7R0.5 CNCC(N)C(=O)O MCULE-4360775406 [1,0,1,0,0,0|1,0,0]=3 1826 B7R0.5 CNCC(N)C(=O)O MCULE-4913403405 [1,0,1,0,0,0|1,0,0]=3 1827 B7R0.5 CNC[C@H](N)C(=O)O MCULE-3465445123 [1,0,1,0,0,0|1,0,0]=3 1828 B7R0.5 CNC[C@H](N)C(=O)O MCULE-7309489523 [1,0,1,0,0,0|1,0,0]=3 1829 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8418254346 [1,0,1,0,0,0|1,0,0]=3 1830 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8752314299 [1,0,1,0,0,0|1,0,0]=3 1831 B7R0.5 COCC(Br)C(=O)O MCULE-2977381282 [1,0,1,0,0,0|2,0,0]=4 1832 B7R0.5 COCC(C)C(=O)O MCULE-9776415948 [1,0,1,0,0,0|2,0,0]=4 1833 B7R0.5 COCC(Cl)C(=O)O MCULE-1439107016 [1,0,1,0,0,0|2,0,0]=4 1834 B7R0.5 COCC(N)C(=O)N MCULE-2465830538 [1,0,1,0,0,0|2,0,0]=4 1835 B7R0.5 COCC(N)C(=O)N MCULE-6194410780 [1,0,1,0,0,0|2,0,0]=4 1836 B7R0.5 COCC(N)C(=O)O MCULE-4336440568 [1,0,1,0,0,0|1,0,0]=3 1837 B7R0.5 COCC(N)C(=O)O MCULE-4899043582 [1,0,1,0,0,0|1,0,0]=3 1838 B7R0.5 COCC(N)C(=O)O MCULE-6964823693 [1,0,1,0,0,0|1,0,0]=3 1839 B7R0.5 COCC(N)C(=O)O MCULE-7037870255 [1,0,1,0,0,0|1,0,0]=3 1840 B7R0.5 COCC(O)C(=O)O MCULE-3185498869 [1,0,1,0,0,0|2,0,0]=4 1841 B7R0.5 COC[C@@H](N)C(=O)O MCULE-1827086666 [1,0,1,0,0,0|1,0,0]=3 1842 B7R0.5 COC[C@@H](N)C(=O)O MCULE-4868456769 [1,0,1,0,0,0|1,0,0]=3 1843 B7R0.5 COC[C@@H](N)C(=O)O MCULE-5275247485 [1,0,1,0,0,0|1,0,0]=3 1844 B7R0.5 COC[C@@H](N)C(=O)O MCULE-7339751251 [1,0,1,0,0,0|1,0,0]=3 1845 B7R0.5 COC[C@H](N)C(=O)O MCULE-3719679803 [1,0,1,0,0,0|1,0,0]=3 1846 B7R0.5 COC[C@H](N)C(=O)O MCULE-4874807874 [1,0,1,0,0,0|1,0,0]=3 1847 B7R0.5 COC[C@H](N)C(=O)O MCULE-5303156917 [1,0,1,0,0,0|1,0,0]=3 1848 B7R0.5 COC[C@H](N)C(=O)O MCULE-8138564560 [1,0,1,0,0,0|1,0,0]=3 1849 B7R0.5 CSCC(C)C(=O)O MCULE-7112130175 [1,0,1,0,0,0|2,0,0]=4 1850 B7R0.5 CSCC(N)C(=O)O MCULE-7668628251 [1,0,1,0,0,0|1,0,0]=3 1851 B7R0.5 CSC[C@H](N)C(=O)O MCULE-1178337776 [1,0,1,0,0,0|1,0,0]=3 1852 B7R0.5 CSC[C@H](N)C(=O)O MCULE-2769761337 [1,0,1,0,0,0|1,0,0]=3 1853 B7R0.5 C[C@@H](CCS)C(=O)O MCULE-2918304262 [1,0,1,0,0,0|0,1,0]=3 1854 B7R0.5 C[C@H](NC=O)C(=O)O MCULE-3824082361 [1,0,1,0,0,0|0,0,2]=4 1855 B7R0.5 C[C@H](NC=O)C(=O)O MCULE-5248110352 [1,0,1,0,0,0|0,0,2]=4 1856 B7R0.5 C[Se]CC(N)C(=O)O MCULE-3357465269 [1,0,1,0,0,0|1,0,0]=3 1857 B7R0.5 C[Se]CC(N)C(=O)O MCULE-7671606756 [1,0,1,0,0,0|1,0,0]=3 1858 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-5208306365 [1,0,1,0,0,0|1,0,0]=3 1859 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6734478742 [1,0,1,0,0,0|1,0,0]=3 1860 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6760615750 [1,0,1,0,0,0|1,0,0]=3 1861 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-7512025617 [1,0,1,0,0,0|1,0,0]=3 1862 B7R0.5 N#CCC(N)C(=O)O MCULE-4929926467 [1,0,1,0,0,0|1,0,1]=4 1863 B7R0.5 N#CC[C@H](N)C(=O)O MCULE-6294926701 [1,0,1,0,0,0|1,0,1]=4 1864 B7R0.5 N#CC[C@H](N)C(=O)O MCULE-6432920316 [1,0,1,0,0,0|1,0,1]=4 1865 B7R0.5 NC(CCBr)C(=O)O MCULE-1900559475 [1,0,1,0,0,0|1,0,0]=3 1866 B7R0.5 NC(CCBr)C(=O)O MCULE-7293320576 [1,0,1,0,0,0|1,0,0]=3 1867 B7R0.5 NC(CCF)C(=O)O MCULE-5519595590 [1,0,1,0,0,0|1,0,0]=3 1868 B7R0.5 NC(CCF)C(=O)O MCULE-7293194855 [1,0,1,0,0,0|1,0,0]=3 1869 B7R0.5 NC(CCO)C(=O)O MCULE-1744838687 [1,0,1,0,0,0|0,0,0]=2 1870 B7R0.5 NC(CCO)C(=O)O MCULE-9642233758 [1,0,1,0,0,0|0,0,0]=2 1871 B7R0.5 NC(CCS)C(=O)O MCULE-8057550187 [1,0,1,0,0,0|0,1,0]=3 1872 B7R0.5 NC(CCS)C(=O)O MCULE-8117596001 [1,0,1,0,0,0|0,1,0]=3 1873 B7R0.5 NC(CNO)C(=O)O MCULE-2332662988 [1,0,1,0,0,0|1,0,0]=3 1874 B7R0.5 NCCC(F)C(=O)O MCULE-5068755002 [1,0,1,0,0,0|2,0,0]=4 1875 B7R0.5 NCCC(F)C(=O)O MCULE-9196695600 [1,0,1,0,0,0|2,0,0]=4 1876 B7R0.5 NCCC(N)C(=O)O MCULE-1239764966 [1,0,1,0,0,0|1,0,0]=3 1877 B7R0.5 NCCC(N)C(=O)O MCULE-2441123923 [1,0,1,0,0,0|1,0,0]=3 1878 B7R0.5 NCCC(N)C(=O)O MCULE-3966593369 [1,0,1,0,0,0|1,0,0]=3 1879 B7R0.5 NCCC(N)C(=O)O MCULE-4212078130 [1,0,1,0,0,0|1,0,0]=3 1880 B7R0.5 NCCC(N)C(=O)O MCULE-7713366571 [1,0,1,0,0,0|1,0,0]=3 1881 B7R0.5 NCCC(N)C(=O)O MCULE-8402131049 [1,0,1,0,0,0|1,0,0]=3 1882 B7R0.5 NCCC(N)C(=O)O MCULE-9198187552 [1,0,1,0,0,0|1,0,0]=3 1883 B7R0.5 NCCC(O)C(=O)O MCULE-3670080484 [1,0,1,0,0,0|2,0,0]=4 1884 B7R0.5 NCCC(O)C(=O)O MCULE-6540935279 [1,0,1,0,0,0|2,0,0]=4 1885 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-4000770618 [1,0,1,0,0,0|1,0,0]=3 1886 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-5775312784 [1,0,1,0,0,0|1,0,0]=3 1887 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-6259961704 [1,0,1,0,0,0|1,0,0]=3 1888 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-9871958374 [1,0,1,0,0,0|1,0,0]=3 1889 B7R0.5 NCC[C@@H](O)C(=O)O MCULE-9726912888 [1,0,1,0,0,0|2,0,0]=4 1890 B7R0.5 NCC[C@H](N)C(=O)O MCULE-1745978456 [1,0,1,0,0,0|1,0,0]=3 1891 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3856066353 [1,0,1,0,0,0|1,0,0]=3 1892 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3919721317 [1,0,1,0,0,0|1,0,0]=3 1893 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5434373726 [1,0,1,0,0,0|1,0,0]=3 1894 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5992578597 [1,0,1,0,0,0|1,0,0]=3 1895 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6536533546 [1,0,1,0,0,0|1,0,0]=3 1896 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6978035806 [1,0,1,0,0,0|1,0,0]=3 1897 B7R0.5 NCC[C@H](N)C(=O)O MCULE-8762011291 [1,0,1,0,0,0|1,0,0]=3 1898 B7R0.5 NCC[C@H](N)C(=O)O MCULE-9645608127 [1,0,1,0,0,0|1,0,0]=3 1899 B7R0.5 NCC[C@H](O)C(=O)O MCULE-3296998083 [1,0,1,0,0,0|2,0,0]=4 1900 B7R0.5 NCC[C@H](O)C(=O)O MCULE-7901866019 [1,0,1,0,0,0|2,0,0]=4 1901 B7R0.5 NOC[C@H](N)C(=O)O MCULE-1050292176 [1,0,1,0,0,0|2,0,0]=4 1902 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2388269464 [1,0,1,0,0,0|1,0,0]=3 1903 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2456796412 [1,0,1,0,0,0|1,0,0]=3 1904 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-6229782603 [1,0,1,0,0,0|1,0,0]=3 1905 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-8123446168 [1,0,1,0,0,0|1,0,0]=3 1906 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-2370353784 [1,0,1,0,0,0|0,0,0]=2 1907 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-4861747928 [1,0,1,0,0,0|0,0,0]=2 1908 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-4021115723 [1,0,1,0,0,0|0,1,0]=3 1909 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-7661321953 [1,0,1,0,0,0|0,1,0]=3 1910 B7R0.5 N[C@@H](CSS)C(=O)O MCULE-3029500977 [1,0,1,0,0,0|1,1,0]=4 1911 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-1975650690 [1,0,1,0,0,0|1,0,0]=3 1912 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-7245104465 [1,0,1,0,0,0|1,0,0]=3 1913 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8005652100 [1,0,1,0,0,0|0,0,0]=2 1914 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8613625039 [1,0,1,0,0,0|0,0,0]=2 1915 B7R0.5 N[C@H](CCS)C(=O)O MCULE-1110046008 [1,0,1,0,0,0|0,1,0]=3 1916 B7R0.5 N[C@H](CCS)C(=O)O MCULE-7556963357 [1,0,1,0,0,0|0,1,0]=3 1917 B7R0.5 O=C(O)C(Br)CCBr MCULE-3091819269 [1,0,1,0,0,0|2,0,0]=4 1918 B7R0.5 O=C(O)C(O)CCO MCULE-9096271794 [1,0,1,0,0,0|1,0,0]=3 1919 B7R0.5 [C@H](N)(CC#C)C(=O)O MCULE-7308061694 [1,0,1,0,0,0|0,0,2]=4 1920 B7R0.6 C=C(C)CCC(=O)O MCULE-8738532812 [1,0,1,0,0,0|1,0,1]=4 1921 B7R0.6 C=C(C)CCC(C)O MCULE-5005514248 [1,0,1,0,0,0|2,0,0]=4 1922 B7R0.6 CC(=O)CCC(=O)O MCULE-1392778065 [1,0,1,0,0,0|0,0,2]=4 1923 B7R0.6 CC(=O)CCC(C)C MCULE-8518693213 [1,0,1,0,0,0|2,0,0]=4 1924 B7R0.6 CC(=O)NCC(C)O MCULE-2406798273 [1,0,1,0,0,0|2,0,0]=4 1925 B7R0.6 CC(=O)OCC(C)O MCULE-3660209140 [1,0,1,0,0,0|2,0,0]=4 1926 B7R0.6 CC(C)CCC(=O)Cl MCULE-6874903195 [1,0,1,0,0,0|2,0,0]=4 1927 B7R0.6 CC(C)CCC(=O)N MCULE-3571818514 [1,0,1,0,0,0|2,0,0]=4 1928 B7R0.6 CC(C)CCC(=O)O MCULE-7691755837 [1,0,1,0,0,0|1,0,0]=3 1929 B7R0.6 CC(C)NCC(=O)O MCULE-4344882030 [1,0,1,0,0,0|2,0,0]=4 1930 B7R0.6 CC(C)NCC(=O)O MCULE-7052227156 [1,0,1,0,0,0|2,0,0]=4 1931 B7R0.6 CC(C)OCC(=O)O MCULE-8295905061 [1,0,1,0,0,0|2,0,0]=4 1932 B7R0.6 CC(C)SCC(=O)O MCULE-3990750464 [1,0,1,0,0,0|2,0,0]=4 1933 B7R0.6 CC(Cl)CCC(=O)Cl MCULE-3066199297 [1,0,1,0,0,0|2,0,0]=4 1934 B7R0.6 CC(N)CCC(=O)O MCULE-3711689460 [1,0,1,0,0,0|1,0,0]=3 1935 B7R0.6 CC(N)CCC(=O)O MCULE-5008572656 [1,0,1,0,0,0|1,0,0]=3 1936 B7R0.6 CC(O)CCC(=O)O MCULE-6352217997 [1,0,1,0,0,0|0,0,0]=2 1937 B7R0.6 CC(O)CCC(=O)[O-] MCULE-5872581098 [1,0,1,0,0,0|0,0,1]=3 1938 B7R0.6 CC(O)CCC(C)O MCULE-6170497684 [1,0,1,0,0,0|1,0,1]=4 1939 B7R0.6 CC(S)CCC(=O)O MCULE-9612173883 [1,0,1,0,0,0|0,1,0]=3 1940 B7R0.6 CN(C)CCC(=O)O MCULE-5553815845 [1,0,1,0,0,0|2,0,0]=4 1941 B7R0.6 CN(C)CCC(=O)O MCULE-7454823322 [1,0,1,0,0,0|2,0,0]=4 1942 B7R0.6 CS(=O)CCC(=O)O MCULE-8243349779 [1,0,1,0,0,0|1,0,1]=4 1943 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-3295260637 [1,0,1,0,0,0|1,0,0]=3 1944 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-5409083898 [1,0,1,0,0,0|1,0,0]=3 1945 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-6530230723 [1,0,1,0,0,0|1,0,0]=3 1946 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-7530095699 [1,0,1,0,0,0|1,0,0]=3 1947 B7R0.6 C[C@@H](O)CC[C@@H](C)O MCULE-3982464496 [1,0,1,0,0,0|1,0,1]=4 1948 B7R0.6 C[C@@H](O)CC[C@@H](C)O MCULE-6083261012 [1,0,1,0,0,0|1,0,1]=4 1949 B7R0.6 C[C@@H](O)CC[C@@H](C)O MCULE-8142548171 [1,0,1,0,0,0|1,0,1]=4 1950 B7R0.6 C[C@@H](O)COC(=O)O MCULE-3794886346 [1,0,1,0,0,0|1,0,0]=3 1951 B7R0.6 C[C@H](N)CCC(=O)O MCULE-3621527632 [1,0,1,0,0,0|1,0,0]=3 1952 B7R0.6 C[C@H](N)CCC(=O)O MCULE-7670557122 [1,0,1,0,0,0|1,0,0]=3 1953 B7R0.6 C[C@H](O)CC[C@H](C)O MCULE-5867971604 [1,0,1,0,0,0|1,0,1]=4 1954 B7R0.6 C[C@H](O)CC[C@H](C)O MCULE-7024859164 [1,0,1,0,0,0|1,0,1]=4 1955 B7R0.6 C[S+](C)CCC(=O)O MCULE-8115187503 [1,0,1,0,0,0|2,0,0]=4 1956 B7R0.6 C[S+](C)CCC(=O)O MCULE-9668037011 [1,0,1,0,0,0|2,0,0]=4 1957 B7R0.6 NC(=O)CCC(=O)O MCULE-5813999826 [1,0,1,0,0,0|0,0,2]=4 1958 B7R0.6 O=C(O)CCB(O)O MCULE-9351023222 [1,0,1,0,0,0|2,0,0]=4 1959 B7R0.6 O=C(O)CCC(=O)O MCULE-1233211613 [1,0,1,0,0,0|1,0,1]=4 1960 B7R0.6 O=C(O)CCC(=O)O MCULE-5889111640 [1,0,1,0,0,0|1,0,1]=4 1961 B7R0.6 O=C(O)CCC(F)F MCULE-6002651269 [1,0,1,0,0,0|2,0,0]=4 1962 B7R0.15 CC=C(CC)C(=O)O MCULE-9303879981 [1,0,1,0,0,0|1,0,1]=4 1963 B7R0.15 CCC(C#N)C(=O)O MCULE-4808497444 [1,0,1,0,0,0|2,0,0]=4 1964 B7R0.15 CCC(CC)C(=O)C MCULE-5291760485 [1,0,1,0,0,0|2,0,0]=4 1965 B7R0.15 CCC(CC)C(=O)Cl MCULE-1027070009 [1,0,1,0,0,0|2,0,0]=4 1966 B7R0.15 CCC(CC)C(=O)N MCULE-7337294425 [1,0,1,0,0,0|2,0,0]=4 1967 B7R0.15 CCC(CC)C(=O)O MCULE-5236890306 [1,0,1,0,0,0|1,0,0]=3 1968 B7R0.15 CCC(CN)C(=O)O MCULE-3795207054 [1,0,1,0,0,0|2,0,0]=4 1969 B7R0.15 CCC(CN)C(=O)O MCULE-3929048283 [1,0,1,0,0,0|2,0,0]=4 1970 B7R0.15 CCC(CO)C(=O)O MCULE-9435802738 [1,0,1,0,0,0|1,0,0]=3 1971 B7R0.15 CCC(CO)C(=O)[O-] MCULE-4277685135 [1,0,1,0,0,0|1,0,1]=4 1972 B7R0.15 CCC(NC)C(=O)N MCULE-1925914686 [1,0,1,0,0,0|1,0,0]=3 1973 B7R0.15 CCC(NC)C(=O)N MCULE-3283265693 [1,0,1,0,0,0|1,0,0]=3 1974 B7R0.15 CCC(NC)C(=O)O MCULE-4101988968 [1,0,1,0,0,0|0,0,0]=2 1975 B7R0.15 CCC(NC)C(=O)O MCULE-4491873969 [1,0,1,0,0,0|0,0,0]=2 1976 B7R0.15 CCC(NN)C(=O)O MCULE-8823684595 [1,0,1,0,0,0|1,0,0]=3 1977 B7R0.15 CCC(NO)C(=O)O MCULE-1962461048 [1,0,1,0,0,0|1,0,0]=3 1978 B7R0.15 CCC(OC)C(=O)N MCULE-4022181907 [1,0,1,0,0,0|2,0,0]=4 1979 B7R0.15 CCC(OC)C(=O)O MCULE-2475290794 [1,0,1,0,0,0|1,0,0]=3 1980 B7R0.15 CCC(SC)C(=O)O MCULE-3373016779 [1,0,1,0,0,0|1,0,0]=3 1981 B7R0.15 CC[C@@H](CN)C(=O)O MCULE-3190659348 [1,0,1,0,0,0|2,0,0]=4 1982 B7R0.15 CC[C@@H](CN)C(=O)O MCULE-5613487575 [1,0,1,0,0,0|2,0,0]=4 1983 B7R0.15 CC[C@@H](CN)C(=O)O MCULE-6726398435 [1,0,1,0,0,0|2,0,0]=4 1984 B7R0.15 CC[C@H](CN)C(=O)O MCULE-2222410753 [1,0,1,0,0,0|2,0,0]=4 1985 B7R0.15 CC[C@H](CN)C(=O)O MCULE-3153536523 [1,0,1,0,0,0|2,0,0]=4 1986 B7R0.15 CC[C@H](CO)C(=O)O MCULE-3017159819 [1,0,1,0,0,0|1,0,0]=3 1987 B7R0.15 CC[C@H](NC)C(=O)N MCULE-6927041915 [1,0,1,0,0,0|1,0,0]=3 1988 B7R0.15 CC[C@H](NC)C(=O)N MCULE-8566282898 [1,0,1,0,0,0|1,0,0]=3 1989 B7R0.15 CC[C@H](NC)C(=O)N MCULE-8659413445 [1,0,1,0,0,0|1,0,0]=3 1990 B7R0.15 CC[C@H](NC)C(=O)N MCULE-8863599251 [1,0,1,0,0,0|1,0,0]=3 1991 B7R0.15 CNC(CN)C(=O)N MCULE-4431940195 [1,0,1,0,0,0|2,0,0]=4 1992 B7R0.15 CNC(CO)C(=O)O MCULE-1439435474 [1,0,1,0,0,0|0,0,0]=2 1993 B7R0.15 CNC(CO)C(=O)O MCULE-7611211207 [1,0,1,0,0,0|0,0,0]=2 1994 B7R0.15 CNC(CS)C(=O)O MCULE-4817727684 [1,0,1,0,0,0|0,1,0]=3 1995 B7R0.15 CNC(CS)C(=O)O MCULE-5741984055 [1,0,1,0,0,0|0,1,0]=3 1996 B7R0.15 CN[C@@H](CN)C(=O)O MCULE-3196852022 [1,0,1,0,0,0|1,0,0]=3 1997 B7R0.15 CN[C@@H](CN)C(=O)O MCULE-3690177999 [1,0,1,0,0,0|1,0,0]=3 1998 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-3320307572 [1,0,1,0,0,0|0,0,0]=2 1999 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-5844994620 [1,0,1,0,0,0|0,0,0]=2 2000 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-6293854138 [1,0,1,0,0,0|0,0,0]=2 2001 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-6463850730 [1,0,1,0,0,0|0,0,0]=2 2002 B7R0.15 CN[C@@H](CS)C(=O)O MCULE-3043115433 [1,0,1,0,0,0|0,1,0]=3 2003 B7R0.15 CN[C@@H](CS)C(=O)O MCULE-8814760080 [1,0,1,0,0,0|0,1,0]=3 2004 B7R0.15 CN[C@H](CO)C(=O)O MCULE-1791141182 [1,0,1,0,0,0|0,0,0]=2 2005 B7R0.15 CN[C@H](CO)C(=O)O MCULE-9346314213 [1,0,1,0,0,0|0,0,0]=2 2006 B7R0.15 COC(CBr)C(=O)O MCULE-5528365617 [1,0,1,0,0,0|2,0,0]=4 2007 B7R0.15 COC(CN)C(=O)O MCULE-1561937449 [1,0,1,0,0,0|2,0,0]=4 2008 B7R0.15 COC(CN)C(=O)O MCULE-7501291426 [1,0,1,0,0,0|2,0,0]=4 2009 B7R0.15 COC(OC)C(=O)O MCULE-3341727181 [1,0,1,0,0,0|2,0,0]=4 2010 B7R0.15 CO[C@@H](CN)C(=O)O MCULE-5536624827 [1,0,1,0,0,0|2,0,0]=4 2011 B7R0.15 CO[C@@H](CN)C(=O)O MCULE-6198841067 [1,0,1,0,0,0|2,0,0]=4 2012 B7R0.15 NCC(CO)C(=O)O MCULE-5510878508 [1,0,1,0,0,0|2,0,0]=4 2013 B7R0.15 NCC(CO)C(=O)O MCULE-9991285445 [1,0,1,0,0,0|2,0,0]=4 2014 B7R0.15 NC[C@@H](CO)C(=O)O MCULE-4607648703 [1,0,1,0,0,0|2,0,0]=4 2015 B7R0.15 NC[C@@H](CO)C(=O)O MCULE-8943978569 [1,0,1,0,0,0|2,0,0]=4 2016 B7R0.15 NC[C@H](CO)C(=O)O MCULE-8459713640 [1,0,1,0,0,0|2,0,0]=4 2017 B7R0.15 O=C(O)[C@H](CO)NP MCULE-8418001133 [1,0,1,0,0,0|1,0,0]=3 2018 B7R0.2 CC(C)CC(C)C=O MCULE-4209363554 [1,0,1,0,0,0|2,0,0]=4 2019 B7R0.2 CC(C)CC(N)CO MCULE-6347344178 [1,0,1,0,0,0|1,0,1]=4 2020 B7R0.2 CC(C)CC(N)CO MCULE-7024759986 [1,0,1,0,0,0|1,0,1]=4 2021 B7R0.2 CC(C)C[C@@H](N)CO MCULE-1979401982 [1,0,1,0,0,0|1,0,1]=4 2022 B7R0.2 CC(C)C[C@@H](N)CO MCULE-3025407298 [1,0,1,0,0,0|1,0,1]=4 2023 B7R0.2 CC(C)C[C@H](N)C=O MCULE-3713415627 [1,0,1,0,0,0|1,0,0]=3 2024 B7R0.2 CC(C)C[C@H](N)CO MCULE-2790872575 [1,0,1,0,0,0|1,0,1]=4 2025 B7R0.2 CC(C)C[C@H](N)CO MCULE-9198147139 [1,0,1,0,0,0|1,0,1]=4 2026 B7R0.2 CCC(N)CC(C)O MCULE-1447243469 [1,0,1,0,0,0|1,0,1]=4 2027 B7R1.1 BrCC1CCCN1 MCULE-2152950124 [2,0,0,0,0,0|1,0,1]=4 2028 B7R1.1 BrCC1CCCN1 MCULE-6083580584 [2,0,0,0,0,0|1,0,1]=4 2029 B7R1.1 BrCC1CCCN1 MCULE-8116807965 [2,0,0,0,0,0|1,0,1]=4 2030 B7R1.1 BrC[C@@H]1CCCN1 MCULE-2609238545 [2,0,0,0,0,0|1,0,1]=4 2031 B7R1.1 BrC[C@@H]1CCCN1 MCULE-4300877722 [2,0,0,0,0,0|1,0,1]=4 2032 B7R1.1 BrC[C@@H]1CCCN1 MCULE-7501559292 [2,0,0,0,0,0|1,0,1]=4 2033 B7R1.1 BrC[C@@H]1CCCN1 MCULE-9528927495 [2,0,0,0,0,0|1,0,1]=4 2034 B7R1.1 C#CC1CCCN1 MCULE-2312235714 [2,0,0,0,0,0|1,0,1]=4 2035 B7R1.1 C#CC1CCCN1 MCULE-2368649911 [2,0,0,0,0,0|1,0,1]=4 2036 B7R1.1 C#C[C@@H]1CCCN1 MCULE-1635908608 [2,0,0,0,0,0|1,0,1]=4 2037 B7R1.1 C#C[C@@H]1CCCN1 MCULE-4766446168 [2,0,0,0,0,0|1,0,1]=4 2038 B7R1.1 C#C[C@@H]1CCCN1 MCULE-7265052825 [2,0,0,0,0,0|1,0,1]=4 2039 B7R1.1 C#C[C@@H]1CCCN1 MCULE-8496158135 [2,0,0,0,0,0|1,0,1]=4 2040 B7R1.1 C#C[C@H]1CCCN1 MCULE-1874586489 [2,0,0,0,0,0|1,0,1]=4 2041 B7R1.1 C#C[C@H]1CCCN1 MCULE-8338634355 [2,0,0,0,0,0|1,0,1]=4 2042 B7R1.1 C1(CCCN1)CF MCULE-2705678622 [2,0,0,0,0,0|1,0,1]=4 2043 B7R1.1 C1(CCCN1)CF MCULE-3175080744 [2,0,0,0,0,0|1,0,1]=4 2044 B7R1.1 C1(CCCN1)CN MCULE-3568349121 [2,0,0,0,0,0|1,0,1]=4 2045 B7R1.1 C1(CCCN1)CN MCULE-9944820727 [2,0,0,0,0,0|1,0,1]=4 2046 B7R1.1 C1(CCCN1)CO MCULE-7277085817 [2,0,0,0,0,0|0,0,1]=3 2047 B7R1.1 C=CC1CCCC1 MCULE-6144532155 [2,0,0,0,0,0|2,0,0]=4 2048 B7R1.1 C=CC1CCCN1 MCULE-5736974496 [2,0,0,0,0,0|1,0,0]=3 2049 B7R1.1 C=CC1CCCN1 MCULE-7626074228 [2,0,0,0,0,0|1,0,0]=3 2050 B7R1.1 CCC1CCCN1 MCULE-1775351089 [2,0,0,0,0,0|1,0,1]=4 2051 B7R1.1 CCC1CCCN1 MCULE-2065682250 [2,0,0,0,0,0|1,0,1]=4 2052 B7R1.1 CCC1CCCN1 MCULE-8326168982 [2,0,0,0,0,0|1,0,1]=4 2053 B7R1.1 CCC1CCCN1 MCULE-9831560442 [2,0,0,0,0,0|1,0,1]=4 2054 B7R1.1 CC[C@@H]1CCCN1 MCULE-1829706908 [2,0,0,0,0,0|1,0,1]=4 2055 B7R1.1 CC[C@@H]1CCCN1 MCULE-6310895621 [2,0,0,0,0,0|1,0,1]=4 2056 B7R1.1 CC[C@@H]1CCCN1 MCULE-6770634475 [2,0,0,0,0,0|1,0,1]=4 2057 B7R1.1 CC[C@@H]1CCCN1 MCULE-9259891597 [2,0,0,0,0,0|1,0,1]=4 2058 B7R1.1 CC[C@H]1CCCN1 MCULE-2347458277 [2,0,0,0,0,0|1,0,1]=4 2059 B7R1.1 CC[C@H]1CCCN1 MCULE-3796565634 [2,0,0,0,0,0|1,0,1]=4 2060 B7R1.1 CC[C@H]1CCCN1 MCULE-6193768639 [2,0,0,0,0,0|1,0,1]=4 2061 B7R1.1 CC[C@H]1CCCN1 MCULE-9679619003 [2,0,0,0,0,0|1,0,1]=4 2062 B7R1.1 ClCC1CCCN1 MCULE-3656101962 [2,0,0,0,0,0|1,0,1]=4 2063 B7R1.1 ClCC1CCCN1 MCULE-9792407426 [2,0,0,0,0,0|1,0,1]=4 2064 B7R1.1 ClC[C@@H]1CCCN1 MCULE-1712418178 [2,0,0,0,0,0|1,0,1]=4 2065 B7R1.1 ClC[C@@H]1CCCN1 MCULE-2092217865 [2,0,0,0,0,0|1,0,1]=4 2066 B7R1.1 ClC[C@@H]1CCCN1 MCULE-4473753787 [2,0,0,0,0,0|1,0,1]=4 2067 B7R1.1 ClC[C@@H]1CCCN1 MCULE-9545872560 [2,0,0,0,0,0|1,0,1]=4 2068 B7R1.1 ClC[C@H]1CCCN1 MCULE-1186865731 [2,0,0,0,0,0|1,0,1]=4 2069 B7R1.1 ClC[C@H]1CCCN1 MCULE-3107383611 [2,0,0,0,0,0|1,0,1]=4 2070 B7R1.1 FCC1CCCN1 MCULE-3216030316 [2,0,0,0,0,0|1,0,1]=4 2071 B7R1.1 FCC1CCCN1 MCULE-4540803550 [2,0,0,0,0,0|1,0,1]=4 2072 B7R1.1 FC[C@@H]1CCCN1 MCULE-2463314208 [2,0,0,0,0,0|1,0,1]=4 2073 B7R1.1 FC[C@@H]1CCCN1 MCULE-3740139569 [2,0,0,0,0,0|1,0,1]=4 2074 B7R1.1 FC[C@@H]1CCCN1 MCULE-6899304468 [2,0,0,0,0,0|1,0,1]=4 2075 B7R1.1 FC[C@@H]1CCCN1 MCULE-9916936373 [2,0,0,0,0,0|1,0,1]=4 2076 B7R1.1 FC[C@H]1CCCN1 MCULE-1380365453 [2,0,0,0,0,0|1,0,1]=4 2077 B7R1.1 FC[C@H]1CCCN1 MCULE-1512160666 [2,0,0,0,0,0|1,0,1]=4 2078 B7R1.1 FC[C@H]1CCCN1 MCULE-2904385734 [2,0,0,0,0,0|1,0,1]=4 2079 B7R1.1 FC[C@H]1CCCN1 MCULE-9837641384 [2,0,0,0,0,0|1,0,1]=4 2080 B7R1.1 ICC1CCCN1 MCULE-3467617934 [2,0,0,0,0,0|1,0,1]=4 2081 B7R1.1 ICC1CCCN1 MCULE-7784862806 [2,0,0,0,0,0|1,0,1]=4 2082 B7R1.1 IC[C@@H]1CCCN1 MCULE-4843756038 [2,0,0,0,0,0|1,0,1]=4 2083 B7R1.1 IC[C@@H]1CCCN1 MCULE-8213667136 [2,0,0,0,0,0|1,0,1]=4 2084 B7R1.1 N#CC1CCCN1 MCULE-1423410021 [2,0,0,0,0,0|1,0,1]=4 2085 B7R1.1 N#CC1CCCN1 MCULE-2656253866 [2,0,0,0,0,0|1,0,1]=4 2086 B7R1.1 N#CC1CCCN1 MCULE-4406196575 [2,0,0,0,0,0|1,0,1]=4 2087 B7R1.1 N#CC1CCCN1 MCULE-7456938108 [2,0,0,0,0,0|1,0,1]=4 2088 B7R1.1 N#CC1CCCN1 MCULE-7786777677 [2,0,0,0,0,0|1,0,1]=4 2089 B7R1.1 N#CC1CCCN1 MCULE-9566371551 [2,0,0,0,0,0|1,0,1]=4 2090 B7R1.1 N#C[C@@H]1CCCN1 MCULE-4099952481 [2,0,0,0,0,0|1,0,1]=4 2091 B7R1.1 N#C[C@@H]1CCCN1 MCULE-4644423856 [2,0,0,0,0,0|1,0,1]=4 2092 B7R1.1 N#C[C@@H]1CCCN1 MCULE-5675394665 [2,0,0,0,0,0|1,0,1]=4 2093 B7R1.1 N#C[C@@H]1CCCN1 MCULE-5881469353 [2,0,0,0,0,0|1,0,1]=4 2094 B7R1.1 N#C[C@@H]1CCCN1 MCULE-8875516240 [2,0,0,0,0,0|1,0,1]=4 2095 B7R1.1 N#C[C@@H]1CCCN1 MCULE-9993553976 [2,0,0,0,0,0|1,0,1]=4 2096 B7R1.1 N#C[C@H]1CCCN1 MCULE-4472756314 [2,0,0,0,0,0|1,0,1]=4 2097 B7R1.1 N#C[C@H]1CCCN1 MCULE-6157392186 [2,0,0,0,0,0|1,0,1]=4 2098 B7R1.1 N#C[C@H]1CCCN1 MCULE-6672062231 [2,0,0,0,0,0|1,0,1]=4 2099 B7R1.1 N#C[C@H]1CCCN1 MCULE-7774660242 [2,0,0,0,0,0|1,0,1]=4 2100 B7R1.1 N#C[C@H]1CCCN1 MCULE-7910694136 [2,0,0,0,0,0|1,0,1]=4 2101 B7R1.1 N#C[C@H]1CCCN1 MCULE-8564583246 [2,0,0,0,0,0|1,0,1]=4 2102 B7R1.1 NCC1CCCN1 MCULE-4764684364 [2,0,0,0,0,0|1,0,1]=4 2103 B7R1.1 NCC1CCCN1 MCULE-8971980286 [2,0,0,0,0,0|1,0,1]=4 2104 B7R1.1 NC[C@@H]1CCCN1 MCULE-4726727563 [2,0,0,0,0,0|1,0,1]=4 2105 B7R1.1 NC[C@@H]1CCCN1 MCULE-7513400460 [2,0,0,0,0,0|1,0,1]=4 2106 B7R1.1 NC[C@@H]1CCCN1 MCULE-7622329174 [2,0,0,0,0,0|1,0,1]=4 2107 B7R1.1 NC[C@@H]1CCCN1 MCULE-8573395464 [2,0,0,0,0,0|1,0,1]=4 2108 B7R1.1 NC[C@H]1CCCN1 MCULE-2813912286 [2,0,0,0,0,0|1,0,1]=4 2109 B7R1.1 NC[C@H]1CCCN1 MCULE-5505144820 [2,0,0,0,0,0|1,0,1]=4 2110 B7R1.1 NC[C@H]1CCCN1 MCULE-7325312327 [2,0,0,0,0,0|1,0,1]=4 2111 B7R1.1 NC[C@H]1CCCN1 MCULE-7708925831 [2,0,0,0,0,0|1,0,1]=4 2112 B7R1.1 O/N=C/1\CCCN1 MCULE-9494233692 [2,0,0,0,0,0|1,0,1]=4 2113 B7R1.1 O=CC1=CCCC1 MCULE-2270030217 [2,0,0,0,0,0|1,0,1]=4 2114 B7R1.1 O=CC1CCCC1 MCULE-4938681495 [2,0,0,0,0,0|1,0,0]=3 2115 B7R1.1 O=CC1CCCO1 MCULE-4587605451 [2,0,0,0,0,0|1,0,0]=3 2116 B7R1.1 O=CC1CCNC1 MCULE-5188223111 [2,0,0,0,0,0|2,0,0]=4 2117 B7R1.1 O=CC1CCOC1 MCULE-9515567606 [2,0,0,0,0,0|2,0,0]=4 2118 B7R1.1 O=CC1CCSC1 MCULE-1282848613 [2,0,0,0,0,0|2,0,0]=4 2119 B7R1.1 O=CN1CCCC1 MCULE-1922854302 [2,0,0,0,0,0|2,0,0]=4 2120 B7R1.1 O=C[C@@H]1CCOC1 MCULE-5181257964 [2,0,0,0,0,0|2,0,0]=4 2121 B7R1.1 O=C[C@H]1CCOC1 MCULE-4532427366 [2,0,0,0,0,0|2,0,0]=4 2122 B7R1.1 OCC1CCCC1 MCULE-2985338933 [2,0,0,0,0,0|1,0,1]=4 2123 B7R1.1 OCC1CCCN1 MCULE-1016922679 [2,0,0,0,0,0|0,0,1]=3 2124 B7R1.1 OCC1CCCN1 MCULE-8224535891 [2,0,0,0,0,0|0,0,1]=3 2125 B7R1.1 OCC1CCCO1 MCULE-5877114547 [2,0,0,0,0,0|1,0,1]=4 2126 B7R1.1 OCC1CCCO1 MCULE-5884880244 [2,0,0,0,0,0|1,0,1]=4 2127 B7R1.1 OCC1CCCS1 MCULE-6106081414 [2,0,0,0,0,0|1,0,1]=4 2128 B7R1.1 OCC1CCON1 MCULE-1199975481 [2,0,0,0,0,0|1,0,1]=4 2129 B7R1.1 OCC1CCON1 MCULE-4772487016 [2,0,0,0,0,0|1,0,1]=4 2130 B7R1.1 OC[C@@H]1CCCN1 MCULE-1791547752 [2,0,0,0,0,0|0,0,1]=3 2131 B7R1.1 OC[C@@H]1CCCN1 MCULE-6448856585 [2,0,0,0,0,0|0,0,1]=3 2132 B7R1.1 OC[C@@H]1CCCN1 MCULE-7214801659 [2,0,0,0,0,0|0,0,1]=3 2133 B7R1.1 OC[C@@H]1CCCN1 MCULE-7248451975 [2,0,0,0,0,0|0,0,1]=3 2134 B7R1.1 OC[C@@H]1CCCO1 MCULE-1788377708 [2,0,0,0,0,0|1,0,1]=4 2135 B7R1.1 OC[C@@H]1CCCO1 MCULE-3533553137 [2,0,0,0,0,0|1,0,1]=4 2136 B7R1.1 OC[C@H]1CCCN1 MCULE-1266532697 [2,0,0,0,0,0|0,0,1]=3 2137 B7R1.1 OC[C@H]1CCCN1 MCULE-1724166794 [2,0,0,0,0,0|0,0,1]=3 2138 B7R1.1 OC[C@H]1CCCN1 MCULE-7513431964 [2,0,0,0,0,0|0,0,1]=3 2139 B7R1.1 OC[C@H]1CCCN1 MCULE-8398083695 [2,0,0,0,0,0|0,0,1]=3 2140 B7R1.1 OC[C@H]1CCCO1 MCULE-3501680239 [2,0,0,0,0,0|1,0,1]=4 2141 B7R1.1 OC[C@H]1CCCO1 MCULE-4925106568 [2,0,0,0,0,0|1,0,1]=4 2142 B7R1.1 ONC1CCCC1 MCULE-1143510043 [2,0,0,0,0,0|2,0,0]=4 2143 B7R1.1 ONC1CCCC1 MCULE-7548854169 [2,0,0,0,0,0|2,0,0]=4 2144 B7R1.2 C1(CNC(=O)C1)N MCULE-6663942203 [2,0,0,0,0,0|1,0,1]=4 2145 B7R1.2 C1(CNC(=O)C1)N MCULE-7862049809 [2,0,0,0,0,0|1,0,1]=4 2146 B7R1.2 C1(CNC(=O)C1)O MCULE-5557473335 [2,0,0,0,0,0|0,0,1]=3 2147 B7R1.2 CC1CC(CN1)F MCULE-5211772527 [2,0,0,0,0,0|1,0,1]=4 2148 B7R1.2 CC1CC(CN1)F MCULE-6845898511 [2,0,0,0,0,0|1,0,1]=4 2149 B7R1.2 CC1CC(CN1)O MCULE-5630063862 [2,0,0,0,0,0|0,0,1]=3 2150 B7R1.2 CC1CC(CN1)O MCULE-7427731937 [2,0,0,0,0,0|0,0,1]=3 2151 B7R1.2 CC1CC(CO1)O MCULE-1304022283 [2,0,0,0,0,0|1,0,1]=4 2152 B7R1.2 CC1CCC(C1)O MCULE-7892602703 [2,0,0,0,0,0|1,0,1]=4 2153 B7R1.2 CC1CNC(=O)C1 MCULE-7180589009 [2,0,0,0,0,0|1,0,1]=4 2154 B7R1.2 CC1CNC(C1)C MCULE-3051496448 [2,0,0,0,0,0|1,0,1]=4 2155 B7R1.2 CC1CNC(C1)C MCULE-9324057254 [2,0,0,0,0,0|1,0,1]=4 2156 B7R1.2 C[C@@H]1CNC(=O)C1 MCULE-2439559922 [2,0,0,0,0,0|1,0,1]=4 2157 B7R1.2 C[C@@H]1CNC(=O)C1 MCULE-7246323100 [2,0,0,0,0,0|1,0,1]=4 2158 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-1790804170 [2,0,0,0,0,0|1,0,1]=4 2159 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-2224321786 [2,0,0,0,0,0|1,0,1]=4 2160 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-6164070045 [2,0,0,0,0,0|1,0,1]=4 2161 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-6870592338 [2,0,0,0,0,0|1,0,1]=4 2162 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-1211015225 [2,0,0,0,0,0|0,0,1]=3 2163 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8025231795 [2,0,0,0,0,0|0,0,1]=3 2164 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8074184383 [2,0,0,0,0,0|0,0,1]=3 2165 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8403784233 [2,0,0,0,0,0|0,0,1]=3 2166 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-1165785658 [2,0,0,0,0,0|1,0,1]=4 2167 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-2237025386 [2,0,0,0,0,0|1,0,1]=4 2168 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-4695463101 [2,0,0,0,0,0|1,0,1]=4 2169 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-9859386988 [2,0,0,0,0,0|1,0,1]=4 2170 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-4359200896 [2,0,0,0,0,0|0,0,1]=3 2171 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-5029850022 [2,0,0,0,0,0|0,0,1]=3 2172 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-8880723450 [2,0,0,0,0,0|0,0,1]=3 2173 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-8966000465 [2,0,0,0,0,0|0,0,1]=3 2174 B7R1.2 C[C@H]1CNC(=O)C1 MCULE-3395896178 [2,0,0,0,0,0|1,0,1]=4 2175 B7R1.2 C[C@H]1CNC(=O)C1 MCULE-8492971593 [2,0,0,0,0,0|1,0,1]=4 2176 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-1742492020 [2,0,0,0,0,0|1,0,1]=4 2177 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-4690497151 [2,0,0,0,0,0|1,0,1]=4 2178 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-7372620241 [2,0,0,0,0,0|1,0,1]=4 2179 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-8319027426 [2,0,0,0,0,0|1,0,1]=4 2180 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-1346257695 [2,0,0,0,0,0|0,0,1]=3 2181 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-3035291598 [2,0,0,0,0,0|0,0,1]=3 2182 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-8611352921 [2,0,0,0,0,0|0,0,1]=3 2183 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-9413190353 [2,0,0,0,0,0|0,0,1]=3 2184 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-1099206732 [2,0,0,0,0,0|1,0,1]=4 2185 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-8257992498 [2,0,0,0,0,0|1,0,1]=4 2186 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-8335445065 [2,0,0,0,0,0|1,0,1]=4 2187 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-9395416229 [2,0,0,0,0,0|1,0,1]=4 2188 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-3188785695 [2,0,0,0,0,0|0,0,1]=3 2189 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-4518572489 [2,0,0,0,0,0|0,0,1]=3 2190 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-5322353871 [2,0,0,0,0,0|0,0,1]=3 2191 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-9693826142 [2,0,0,0,0,0|0,0,1]=3 2192 B7R1.2 NC1CCC(C1)O MCULE-5821071286 [2,0,0,0,0,0|2,0,0]=4 2193 B7R1.2 NC1CCC(C1)O MCULE-9391783901 [2,0,0,0,0,0|2,0,0]=4 2194 B7R1.2 NC1CNC(=O)C1 MCULE-1690074091 [2,0,0,0,0,0|1,0,1]=4 2195 B7R1.2 NC1CNC(=O)C1 MCULE-2563813057 [2,0,0,0,0,0|1,0,1]=4 2196 B7R1.2 NC1CNC(=O)C1 MCULE-5332234739 [2,0,0,0,0,0|1,0,1]=4 2197 B7R1.2 NC1CNC(=O)C1 MCULE-9955937074 [2,0,0,0,0,0|1,0,1]=4 2198 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-2973461190 [2,0,0,0,0,0|2,0,0]=4 2199 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-5462229704 [2,0,0,0,0,0|2,0,0]=4 2200 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-6746606174 [2,0,0,0,0,0|2,0,0]=4 2201 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-7196403409 [2,0,0,0,0,0|2,0,0]=4 2202 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-7511735313 [2,0,0,0,0,0|2,0,0]=4 2203 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-9023897758 [2,0,0,0,0,0|2,0,0]=4 2204 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-3286276562 [2,0,0,0,0,0|2,0,0]=4 2205 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-5345953109 [2,0,0,0,0,0|2,0,0]=4 2206 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-6442703385 [2,0,0,0,0,0|2,0,0]=4 2207 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-7457197538 [2,0,0,0,0,0|2,0,0]=4 2208 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-1502944618 [2,0,0,0,0,0|1,0,1]=4 2209 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-2444469131 [2,0,0,0,0,0|1,0,1]=4 2210 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-7277309874 [2,0,0,0,0,0|1,0,1]=4 2211 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-8533160250 [2,0,0,0,0,0|1,0,1]=4 2212 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-2764158583 [2,0,0,0,0,0|2,0,0]=4 2213 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-5047569623 [2,0,0,0,0,0|2,0,0]=4 2214 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-7674066148 [2,0,0,0,0,0|2,0,0]=4 2215 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-8478778872 [2,0,0,0,0,0|2,0,0]=4 2216 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-3786824722 [2,0,0,0,0,0|2,0,0]=4 2217 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-4140170961 [2,0,0,0,0,0|2,0,0]=4 2218 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-5760466174 [2,0,0,0,0,0|2,0,0]=4 2219 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-5995468864 [2,0,0,0,0,0|2,0,0]=4 2220 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-6230469368 [2,0,0,0,0,0|2,0,0]=4 2221 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-9622062244 [2,0,0,0,0,0|2,0,0]=4 2222 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-1884894725 [2,0,0,0,0,0|1,0,1]=4 2223 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-2130809002 [2,0,0,0,0,0|1,0,1]=4 2224 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-3881338264 [2,0,0,0,0,0|1,0,1]=4 2225 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-4324375667 [2,0,0,0,0,0|1,0,1]=4 2226 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-5900761307 [2,0,0,0,0,0|1,0,1]=4 2227 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-6007209179 [2,0,0,0,0,0|1,0,1]=4 2228 B7R1.2 O=C1CC(CN1)O MCULE-8498039777 [2,0,0,0,0,0|0,0,1]=3 2229 B7R1.2 O=C1CC(CN1)S MCULE-3257609096 [2,0,0,0,0,0|0,1,1]=4 2230 B7R1.2 O=C1CC(CO1)O MCULE-3779919332 [2,0,0,0,0,0|1,0,1]=4 2231 B7R1.2 O=C1CC(CO1)O MCULE-5609071664 [2,0,0,0,0,0|1,0,1]=4 2232 B7R1.2 O=C1CCC(C1)O MCULE-8500536547 [2,0,0,0,0,0|1,0,1]=4 2233 B7R1.2 O=C1C[C@@H](CN1)O MCULE-2016792324 [2,0,0,0,0,0|0,0,1]=3 2234 B7R1.2 O=C1C[C@@H](CN1)O MCULE-9756194758 [2,0,0,0,0,0|0,0,1]=3 2235 B7R1.2 O=C1C[C@@H](CO1)O MCULE-1467506377 [2,0,0,0,0,0|1,0,1]=4 2236 B7R1.2 O=C1C[C@@H](CO1)O MCULE-3668466479 [2,0,0,0,0,0|1,0,1]=4 2237 B7R1.2 O=C1C[C@H](CN1)O MCULE-2017150152 [2,0,0,0,0,0|0,0,1]=3 2238 B7R1.2 O=C1C[C@H](CN1)O MCULE-5168961542 [2,0,0,0,0,0|0,0,1]=3 2239 B7R1.2 O=C1C[C@H](CN1)S MCULE-6980612759 [2,0,0,0,0,0|0,1,1]=4 2240 B7R1.2 O=C1C[C@H](CN1)S MCULE-7205538285 [2,0,0,0,0,0|0,1,1]=4 2241 B7R1.2 O=C1C[C@H](CO1)O MCULE-5756899897 [2,0,0,0,0,0|1,0,1]=4 2242 B7R1.2 O=C1C[C@H](CO1)O MCULE-6247095672 [2,0,0,0,0,0|1,0,1]=4 2243 B7R1.2 OC1C=CC(C1)O MCULE-9792113599 [2,0,0,0,0,0|1,0,1]=4 2244 B7R1.2 OC1CCC(C1)O MCULE-2799846813 [2,0,0,0,0,0|1,0,0]=3 2245 B7R1.2 OC1CCC(O1)O MCULE-8012370358 [2,0,0,0,0,0|2,0,0]=4 2246 B7R1.2 O[C@@H]1C=C[C@@H](C1)O MCULE-7187295032 [2,0,0,0,0,0|1,0,1]=4 2247 B7R1.2 O[C@@H]1CC[C@H](C1)O MCULE-4481324218 [2,0,0,0,0,0|1,0,0]=3 2248 B7R1.2 O[C@@H]1CC[C@H](C1)O MCULE-6560672131 [2,0,0,0,0,0|1,0,0]=3 2249 B7R1.2 O[C@H]1CC[C@H](C1)O MCULE-4640874873 [2,0,0,0,0,0|1,0,0]=3 2250 B7R1.2 [C@@H]1(CC[C@@H](C1)O)N MCULE-3137346382 [2,0,0,0,0,0|2,0,0]=4 2251 B7R1.2 [C@@H]1(CC[C@@H](C1)O)N MCULE-9954737796 [2,0,0,0,0,0|2,0,0]=4 2252 B7R1.2 [C@H]1(CC[C@H](C1)O)O MCULE-4834858159 [2,0,0,0,0,0|1,0,0]=3 2253 B7R1.2 [C@H]1(CN[C@@H](C1)C)O MCULE-1916837136 [2,0,0,0,0,0|0,0,1]=3 2254 B7R1.2 [C@H]1(CN[C@@H](C1)C)O MCULE-8263093896 [2,0,0,0,0,0|0,0,1]=3 2255 B7R1.2 [C@H]1(CN[C@H](C1)C)O MCULE-9065610836 [2,0,0,0,0,0|0,0,1]=3 2256 B7R1.2 [C@H]1(CN[C@H](C1)C)O MCULE-9910248291 [2,0,0,0,0,0|0,0,1]=3 2257 B9R0.7 CC(C)CCC(C)C(=O)O MCULE-8295273403 [0,1,1,0,0,0|2,0,0]=4 2258 B9R0.7 CC(C)COC(C)C(=O)O MCULE-1125012565 [0,1,1,0,0,0|2,0,0]=4 2259 B9R0.7 CC(CCC(=O)O)C(=O)O MCULE-1523371907 [0,1,1,0,0,0|1,0,1]=4 2260 B9R0.7 CC(CCC(=O)O)C(=O)O MCULE-1939523418 [0,1,1,0,0,0|1,0,1]=4 2261 B9R0.7 CC(NCC(=O)O)C(=O)O MCULE-1111290878 [0,1,1,0,0,0|0,0,1]=3 2262 B9R0.7 CC(NCC(=O)O)C(=O)O MCULE-6569987660 [0,1,1,0,0,0|0,0,1]=3 2263 B9R0.7 CC(SCC(=O)O)C(=O)O MCULE-8523268796 [0,1,1,0,0,0|1,0,1]=4 2264 B9R0.7 C[C@@H](CCC(=O)O)C(=O)O MCULE-7515023265 [0,1,1,0,0,0|1,0,1]=4 2265 B9R0.7 C[C@H](CCC(=O)O)C(=O)O MCULE-8441860655 [0,1,1,0,0,0|1,0,1]=4 2266 B9R0.7 C[C@H](CCC(=O)O)C(=O)O MCULE-9071150671 [0,1,1,0,0,0|1,0,1]=4 2267 B9R0.7 C[C@H](NCC(=O)O)C(=O)O MCULE-1511229567 [0,1,1,0,0,0|0,0,1]=3 2268 B9R0.7 C[C@H](NCC(=O)O)C(=O)O MCULE-4530562082 [0,1,1,0,0,0|0,0,1]=3 2269 B9R0.8 CCCNC(C)C(=O)OC MCULE-6800510102 [0,1,1,0,0,0|1,0,0]=3 2270 B9R0.8 COC(=O)C(C)NCCF MCULE-3281749935 [0,1,1,0,0,0|1,0,0]=3 2271 B9R0.8 COC(=O)N(C)CCCO MCULE-4886206070 [0,1,1,0,0,0|2,0,0]=4 2272 B9R0.13 CCC(OCCO)C(=O)O MCULE-6934668694 [0,1,1,0,0,0|1,0,0]=3 2273 B9R0.13 CCCCC(CC)C(=O)O MCULE-5686478683 [0,1,1,0,0,0|2,0,0]=4 2274 B9R0.13 CCCCC(CN)C(=O)O MCULE-6509321720 [0,1,1,0,0,0|2,0,0]=4 2275 B9R0.13 CCCCC(CO)C(=O)O MCULE-7586035948 [0,1,1,0,0,0|2,0,0]=4 2276 B9R0.13 CCCCC(NC)C(=O)O MCULE-1290797295 [0,1,1,0,0,0|2,0,0]=4 2277 B9R0.13 CCCCC(OC)C(=O)O MCULE-4251070702 [0,1,1,0,0,0|2,0,0]=4 2278 B9R0.13 CCCC[C@@H](CC)C(=O)O MCULE-3017621334 [0,1,1,0,0,0|2,0,0]=4 2279 B9R0.13 CCCC[C@@H](CC)C(=O)O MCULE-9782965208 [0,1,1,0,0,0|2,0,0]=4 2280 B9R0.13 CCCC[C@@H](CN)C(=O)O MCULE-8769717308 [0,1,1,0,0,0|2,0,0]=4 2281 B9R0.13 CCCC[C@@H](CO)C(=O)O MCULE-4035754044 [0,1,1,0,0,0|2,0,0]=4 2282 B9R0.13 CCCC[C@H](CC)C(=O)O MCULE-7435371149 [0,1,1,0,0,0|2,0,0]=4 2283 B9R0.13 CCCC[C@H](CN)C(=O)O MCULE-3507398764 [0,1,1,0,0,0|2,0,0]=4 2284 B9R0.13 CCCC[C@H](CO)C(=O)O MCULE-1956509117 [0,1,1,0,0,0|2,0,0]=4 2285 B9R0.13 CCCC[C@H](CO)C(=O)O MCULE-3776577040 [0,1,1,0,0,0|2,0,0]=4 2286 B9R0.13 CCCC[C@H](NC)C(=O)O MCULE-2734051077 [0,1,1,0,0,0|2,0,0]=4 2287 B9R0.13 CCCC[C@H](NC)C(=O)O MCULE-3251368399 [0,1,1,0,0,0|2,0,0]=4 2288 B9R0.13 CCCC[C@H](NC)C(=O)O MCULE-5821422660 [0,1,1,0,0,0|2,0,0]=4 2289 B9R0.13 CCCC[C@H](NC)C(=O)O MCULE-6933942099 [0,1,1,0,0,0|2,0,0]=4 2290 B9R0.13 CN[C@@H](CCCN)C(=O)O MCULE-3425842174 [0,1,1,0,0,0|2,0,0]=4 2291 B9R0.13 CN[C@@H](CCCN)C(=O)O MCULE-5957010617 [0,1,1,0,0,0|2,0,0]=4 2292 B9R0.42 CC(CO)CC(N)C(=O)O MCULE-1659842949 [0,1,1,0,0,0|2,0,0]=4 2293 B9R0.42 CC(NC(=O)CCl)C(=O)O MCULE-6899086052 [0,1,1,0,0,0|1,0,1]=4 2294 B9R0.42 CC(NC(=O)CN)C(=O)O MCULE-2027405418 [0,1,1,0,0,0|1,0,1]=4 2295 B9R0.42 CCC(=O)NC(C)C(=O)O MCULE-5488194337 [0,1,1,0,0,0|1,0,1]=4 2296 B9R0.42 CCC(=O)N[C@@H](C)C(=O)O MCULE-5552061501 [0,1,1,0,0,0|1,0,1]=4 2297 B9R0.42 CCC(C)CC(C)C(=O)O MCULE-6856405301 [0,1,1,0,0,0|2,0,0]=4 2298 B9R0.42 C[C@H](NC(=O)CBr)C(=O)O MCULE-2038149065 [0,1,1,0,0,0|1,0,1]=4 2299 B9R0.42 C[C@H](NC(=O)CCl)C(=O)O MCULE-3478867157 [0,1,1,0,0,0|1,0,1]=4 2300 B9R0.42 C[C@H](NC(=O)CCl)C(=O)O MCULE-8272505742 [0,1,1,0,0,0|1,0,1]=4 2301 B9R0.42 C[C@H](NC(=O)CN)C(=O)O MCULE-2496637228 [0,1,1,0,0,0|1,0,1]=4 2302 B9R0.42 [C@@H](C)(NC(=O)CN)C(=O)O MCULE-7578084271 [0,1,1,0,0,0|1,0,1]=4 2303 B9R0.47 C=CCCNC(C)C(=O)O MCULE-2164423879 [0,1,1,0,0,0|1,0,0]=3 2304 B9R0.47 C=CCCOC(C)C(=O)O MCULE-4921869592 [0,1,1,0,0,0|2,0,0]=4 2305 B9R0.47 CC(CSCCN)C(=O)O MCULE-8181129041 [0,1,1,0,0,0|2,0,0]=4 2306 B9R0.47 CC(CSCCN)C(=O)O MCULE-9927031234 [0,1,1,0,0,0|2,0,0]=4 2307 B9R0.47 CC(NCCC#N)C(=O)O MCULE-7314407236 [0,1,1,0,0,0|1,0,0]=3 2308 B9R0.47 CCCCCC(C)C(=O)O MCULE-3831811055 [0,1,1,0,0,0|2,0,0]=4 2309 B9R0.47 CCCCOC(C)C(=O)O MCULE-2711768240 [0,1,1,0,0,0|2,0,0]=4 2310 B9R0.47 CCCCSC(C)C(=O)O MCULE-1538375330 [0,1,1,0,0,0|2,0,0]=4 2311 B9R0.47 COCCCC(C)C(=O)O MCULE-7159772792 [0,1,1,0,0,0|1,0,0]=3 2312 B9R0.47 COCCNC(C)C(=O)N MCULE-1475869974 [0,1,1,0,0,0|1,0,0]=3 2313 B9R0.47 COCCNC(C)C(=O)N MCULE-3132916689 [0,1,1,0,0,0|1,0,0]=3 2314 B9R0.47 COCCNC(C)C(=O)O MCULE-1762428923 [0,1,1,0,0,0|0,0,0]=2 2315 B9R0.47 COCCNC(C)C(=O)O MCULE-8532368084 [0,1,1,0,0,0|0,0,0]=2 2316 B9R0.47 COCCOC(C)C(=O)O MCULE-5271320344 [0,1,1,0,0,0|1,0,0]=3 2317 B9R0.47 CSCCOC(C)C(=O)O MCULE-2180057271 [0,1,1,0,0,0|1,1,0]=4 2318 B9R0.47 NC(CCCCO)C(=O)O MCULE-7372730935 [0,1,1,0,0,0|2,0,0]=4 2319 B9R0.47 NC(CSCCO)C(=O)O MCULE-9765321939 [0,1,1,0,0,0|2,0,0]=4 2320 B9R0.47 N[C@@H](CCCCO)C(=O)O MCULE-1855458643 [0,1,1,0,0,0|2,0,0]=4 2321 B9R0.47 N[C@@H](CCCCO)C(=O)O MCULE-3280637244 [0,1,1,0,0,0|2,0,0]=4 2322 B9R0.47 N[C@@H](CCCNO)C(=O)O MCULE-2690192301 [0,1,1,0,0,0|2,0,0]=4 2323 B9R0.47 N[C@@H](CCCNO)C(=O)O MCULE-8331389811 [0,1,1,0,0,0|2,0,0]=4 2324 B9R0.47 N[C@@H](CCCNO)C(=O)O MCULE-9071251692 [0,1,1,0,0,0|2,0,0]=4 2325 B9R0.47 N[C@@H](CCCNO)C(=O)O MCULE-9613387165 [0,1,1,0,0,0|2,0,0]=4 2326 B9R0.47 N[C@@H](CSCCO)C(=O)O MCULE-4219102659 [0,1,1,0,0,0|2,0,0]=4 2327 B9R0.47 N[C@H](CSCCO)C(=O)O MCULE-6379323435 [0,1,1,0,0,0|2,0,0]=4 2328 B9R0.51 CC(C)(CCCO)C(=O)O MCULE-8432032551 [0,1,1,0,0,0|1,0,0]=3 2329 B9R0.51 CC(C)(CCCO)C(=O)[O-] MCULE-7948640149 [0,1,1,0,0,0|1,0,1]=4 2330 B9R0.51 CC(C)(OCCO)C(=O)O MCULE-7350629526 [0,1,1,0,0,0|1,0,0]=3 2331 B9R0.51 CC(N)(CCCN)C(=O)O MCULE-3848172930 [0,1,1,0,0,0|2,0,0]=4 2332 B9R0.51 CC(N)(CCCN)C(=O)O MCULE-8569683447 [0,1,1,0,0,0|2,0,0]=4 2333 B9R0.51 CCCCC(C)(C)C(=O)O MCULE-6533628152 [0,1,1,0,0,0|2,0,0]=4 2334 B9R0.51 CCCCC(C)(F)C(=O)O MCULE-3264455202 [0,1,1,0,0,0|2,0,0]=4 2335 B9R0.51 CCCCC(C)(O)C(=O)O MCULE-4036610380 [0,1,1,0,0,0|2,0,0]=4 2336 B9R0.23 CCC(C)C(N)CC(=O)O MCULE-4327977098 [0,1,1,0,0,0|2,0,0]=4 2337 B9R0.23 CCC(C)C(N)CC(=O)O MCULE-9731178196 [0,1,1,0,0,0|2,0,0]=4 2338 B9R0.23 CC[C@@H](C)[C@H](N)CC(=O)O MCULE-3497593262 [0,1,1,0,0,0|2,0,0]=4 2339 B9R0.23 CC[C@@H](C)[C@H](N)CC(=O)O MCULE-4155901879 [0,1,1,0,0,0|2,0,0]=4 2340 B9R0.23 CC[C@@H](C)[C@H](N)CC(=O)O MCULE-8221314475 [0,1,1,0,0,0|2,0,0]=4 2341 B9R0.23 CC[C@@H](C)[C@H](N)CC(=O)O MCULE-9196761404 [0,1,1,0,0,0|2,0,0]=4 2342 B9R0.23 CC[C@H](C)[C@@H](N)CC(=O)O MCULE-2430009158 [0,1,1,0,0,0|2,0,0]=4 2343 B9R0.23 CC[C@H](C)[C@@H](N)CC(=O)O MCULE-9647386489 [0,1,1,0,0,0|2,0,0]=4 2344 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O MCULE-2618743733 [0,1,1,0,0,0|2,0,0]=4 2345 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O MCULE-5773439736 [0,1,1,0,0,0|2,0,0]=4 2346 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O MCULE-6590436922 [0,1,1,0,0,0|2,0,0]=4 2347 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O MCULE-9722049324 [0,1,1,0,0,0|2,0,0]=4 2348 B9R0.23 O=C(O)C[C@@H](O)[C@@H](O)CO MCULE-5394522095 [0,1,1,0,0,0|1,0,0]=3 2349 B9R0.23 O=C(O)C[C@H](O)[C@H](O)CO MCULE-2704229472 [0,1,1,0,0,0|1,0,0]=3 2350 B9R0.24 CCC(N)CCC(=O)OC MCULE-8096200173 [0,1,1,0,0,0|2,0,0]=4 2351 B9R0.24 CCC(N)CCC(=O)OC MCULE-9735533305 [0,1,1,0,0,0|2,0,0]=4 2352 B9R0.24 CCC(O)CCC(=O)NN MCULE-1166870258 [0,1,1,0,0,0|2,0,0]=4 2353 B9R0.24 COC(=O)CCC(=O)CN MCULE-7356254100 [0,1,1,0,0,0|0,0,2]=4 2354 B9R0.24 COC(=O)CCC(=O)CN MCULE-8571939531 [0,1,1,0,0,0|0,0,2]=4 2355 B9R0.43 CCC(CC)CCC(=O)O MCULE-3619246107 [0,1,1,0,0,0|2,0,0]=4 2356 B9R0.43 CCC(CO)CCC(=O)C MCULE-7352596779 [0,1,1,0,0,0|2,0,0]=4 2357 B9R0.48 CCCC(C)CCC(=O)O MCULE-2307170636 [0,1,1,0,0,0|2,0,0]=4 2358 B9R0.48 CCCC(N)CCC(=O)O MCULE-2596842997 [0,1,1,0,0,0|2,0,0]=4 2359 B9R0.48 CCCC(N)CCC(=O)O MCULE-4723059719 [0,1,1,0,0,0|2,0,0]=4 2360 B9R0.64 NCP(=O)(O)CCC(=O)O MCULE-8895842344 [0,1,1,0,0,0|1,0,0]=3 2361 B9R0.12 C=CCC(NC)C(=O)OC MCULE-2627043783 [0,1,1,0,0,0|1,0,1]=4 2362 B9R0.12 C=CCC(NC)C(=O)OC MCULE-9141678175 [0,1,1,0,0,0|1,0,1]=4 2363 B9R0.12 CCCC(NC)C(=O)OC MCULE-1157341941 [0,1,1,0,0,0|1,0,0]=3 2364 B9R0.12 CNC(=O)C(CCO)NC MCULE-9412548333 [0,1,1,0,0,0|1,0,0]=3 2365 B9R0.12 CNC(CCN)C(=O)OC MCULE-7848551324 [0,1,1,0,0,0|1,0,0]=3 2366 B9R0.12 CNC(COC)C(=O)OC MCULE-6909479011 [0,1,1,0,0,0|2,0,0]=4 2367 B9R0.12 COC(=O)C(CCN)OC MCULE-4716419095 [0,1,1,0,0,0|2,0,0]=4 2368 B9R0.15 CCCC(CCC)C(=O)O MCULE-7136317196 [0,1,1,0,0,0|2,0,0]=4 2369 B9R0.15 CCCC(NC=O)C(=O)O MCULE-7516123408 [0,1,1,0,0,0|1,0,1]=4 2370 B9R0.15 CCCC(OCC)C(=O)O MCULE-7197686501 [0,1,1,0,0,0|2,0,0]=4 2371 B9R0.15 CCNC(CCN)C(=O)N MCULE-3086906812 [0,1,1,0,0,0|2,0,0]=4 2372 B9R0.15 NCCC(CCN)C(=O)O MCULE-3747615668 [0,1,1,0,0,0|2,0,0]=4 2373 B9R0.15 NCCC(CCN)C(=O)O MCULE-8055618051 [0,1,1,0,0,0|2,0,0]=4 2374 B9R0.29 CCC(C)C(NC)C(=O)O MCULE-1957885665 [0,1,1,0,0,0|1,0,0]=3 2375 B9R0.29 CCC(C)C(OC)C(=O)O MCULE-7966384544 [0,1,1,0,0,0|2,0,0]=4 2376 B9R0.29 CC[C@@H](C)[C@H](NC)C(=O)O MCULE-8364477291 [0,1,1,0,0,0|1,0,0]=3 2377 B9R0.29 CC[C@H](C)[C@@H](NC)C(=O)O MCULE-6136891317 [0,1,1,0,0,0|1,0,0]=3 2378 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O MCULE-1871065287 [0,1,1,0,0,0|1,0,0]=3 2379 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O MCULE-3891615565 [0,1,1,0,0,0|1,0,0]=3 2380 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O MCULE-9489341112 [0,1,1,0,0,0|1,0,0]=3 2381 B9R0.29 [C@H](C)(CC)[C@H](NC)C(=O)O MCULE-1663789159 [0,1,1,0,0,0|1,0,0]=3 2382 B9R0.33 C=CCC(C(=O)O)N(C)C MCULE-4850155708 [0,1,1,0,0,0|1,0,1]=4 2383 B9R0.33 CC(C)C(CCN)C(=O)O MCULE-5177043751 [0,1,1,0,0,0|2,0,0]=4 2384 B9R0.33 CC(C)C(CCN)C(=O)O MCULE-7075545898 [0,1,1,0,0,0|2,0,0]=4 2385 B9R0.33 CCCC(C(=O)N)N(C)C MCULE-4951647411 [0,1,1,0,0,0|2,0,0]=4 2386 B9R0.33 CCCC(C(=O)O)C(C)C MCULE-9298455866 [0,1,1,0,0,0|2,0,0]=4 2387 B9R0.33 CCCC(C(=O)O)N(C)C MCULE-1361270877 [0,1,1,0,0,0|1,0,0]=3 2388 B9R0.33 CCC[C@@H](C(=O)O)N(C)C MCULE-5821588618 [0,1,1,0,0,0|1,0,0]=3 2389 B9R0.33 CCC[C@@H](C(=O)O)N(C)C MCULE-6045614611 [0,1,1,0,0,0|1,0,0]=3 2390 B9R0.33 CCC[C@H](C(=O)O)N(C)C MCULE-3627937276 [0,1,1,0,0,0|1,0,0]=3 2391 B9R0.33 CCC[C@H](C(=O)O)N(C)C MCULE-6264285545 [0,1,1,0,0,0|1,0,0]=3 2392 B9R0.33 CN(C)C(CCN)C(=O)N MCULE-2767580456 [0,1,1,0,0,0|2,0,0]=4 2393 B9R0.33 CN(C)C(CCN)C(=O)O MCULE-8339128470 [0,1,1,0,0,0|1,0,0]=3 2394 B9R0.33 CN(C)[C@@H](CCN)C(=O)O MCULE-1062850066 [0,1,1,0,0,0|1,0,0]=3 2395 B9R0.33 CN(C)[C@@H](CCN)C(=O)O MCULE-3495896981 [0,1,1,0,0,0|1,0,0]=3 2396 B9R0.33 CN(C)[C@@H](CCO)C(=O)O MCULE-5311348966 [0,1,1,0,0,0|0,0,0]=2 2397 B9R0.33 COCC(C(=O)O)N(C)C MCULE-4810605036 [0,1,1,0,0,0|2,0,0]=4 2398 B9R0.33 COCC(C(=O)O)N(C)C MCULE-7502849046 [0,1,1,0,0,0|2,0,0]=4 2399 B9R0.39 CCC(CC(=O)O)C(=O)O MCULE-6275256194 [0,1,1,0,0,0|1,0,1]=4 2400 B9R0.39 CCC(CC(C)C)C(=O)O MCULE-5215518236 [0,1,1,0,0,0|2,0,0]=4 2401 B9R0.39 CCC(CC(F)F)C(=O)O MCULE-2440123997 [0,1,1,0,0,0|2,0,0]=4 2402 B9R0.39 CNC(CC(=O)O)C(=O)O MCULE-5049531079 [0,1,1,0,0,0|0,0,1]=3 2403 B9R0.39 CNC(CC(C)C)C(=O)O MCULE-4940999271 [0,1,1,0,0,0|1,0,0]=3 2404 B9R0.39 CNC(CC(C)C)C(=O)O MCULE-7266045564 [0,1,1,0,0,0|1,0,0]=3 2405 B9R0.39 CN[C@@H](CC(=O)N)C(=O)O MCULE-2449462396 [0,1,1,0,0,0|0,0,2]=4 2406 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O MCULE-4725692041 [0,1,1,0,0,0|0,0,1]=3 2407 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O MCULE-6356483886 [0,1,1,0,0,0|0,0,1]=3 2408 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O MCULE-9428412153 [0,1,1,0,0,0|0,0,1]=3 2409 B9R0.39 CN[C@@H](CC(C)C)C(=O)N MCULE-7907533997 [0,1,1,0,0,0|2,0,0]=4 2410 B9R0.39 CN[C@@H](CC(C)C)C(=O)N MCULE-8591020499 [0,1,1,0,0,0|2,0,0]=4 2411 B9R0.39 CN[C@@H](CC(C)C)C(=O)O MCULE-2758691344 [0,1,1,0,0,0|1,0,0]=3 2412 B9R0.39 CN[C@@H](CC(C)C)C(=O)O MCULE-3349649810 [0,1,1,0,0,0|1,0,0]=3 2413 B9R0.39 CN[C@@H](CC(C)C)C(=O)O MCULE-4487326533 [0,1,1,0,0,0|1,0,0]=3 2414 B9R0.39 CN[C@@H](CC(C)C)C(=O)O MCULE-7740057854 [0,1,1,0,0,0|1,0,0]=3 2415 B9R0.39 CN[C@H](CC(=O)N)C(=O)O MCULE-2092394249 [0,1,1,0,0,0|0,0,2]=4 2416 B9R0.39 CN[C@H](CC(=O)O)C(=O)O MCULE-1405442072 [0,1,1,0,0,0|0,0,1]=3 2417 B9R0.39 CN[C@H](CC(=O)O)C(=O)O MCULE-8611804669 [0,1,1,0,0,0|0,0,1]=3 2418 B9R0.39 CN[C@H](CC(=O)O)C(=O)O MCULE-9080466863 [0,1,1,0,0,0|0,0,1]=3 2419 B9R0.39 CN[C@H](CC(C)C)C(=O)O MCULE-2279011654 [0,1,1,0,0,0|1,0,0]=3 2420 B9R0.39 CN[C@H](CC(C)C)C(=O)O MCULE-2290136385 [0,1,1,0,0,0|1,0,0]=3 2421 B9R0.39 CN[C@H](CC(C)C)C(=O)O MCULE-2552934491 [0,1,1,0,0,0|1,0,0]=3 2422 B9R0.39 CN[C@H](CC(C)C)C(=O)O MCULE-8319051174 [0,1,1,0,0,0|1,0,0]=3 2423 B9R0.39 COC(CC(=O)O)C(=O)O MCULE-3778948045 [0,1,1,0,0,0|1,0,1]=4 2424 B9R0.39 COC(CC(C)C)C(=O)O MCULE-4497994493 [0,1,1,0,0,0|2,0,0]=4 2425 B9R0.74 CCCC(C)(CC)C(=O)O MCULE-2557760328 [0,1,1,0,0,0|2,0,0]=4 2426 B9R0.74 CCCC(N)(CC)C(=O)O MCULE-2758260935 [0,1,1,0,0,0|2,0,0]=4 2427 B9R0.74 CCCC(N)(CC)C(=O)O MCULE-6297600490 [0,1,1,0,0,0|2,0,0]=4 2428 B9R0.74 CNC(C)(COC)C(=O)O MCULE-1951800408 [0,1,1,0,0,0|2,0,0]=4 2429 B9R0.74 CNC(C)(COC)C(=O)O MCULE-6037506715 [0,1,1,0,0,0|2,0,0]=4 2430 B9R0.10 CC(C)CC(N)S(=O)(=O)O MCULE-1533349603 [0,1,1,0,0,0|2,0,0]=4 2431 B9R0.10 CC(C)C[C@@H](N)P(=O)(O)O MCULE-4058698477 [0,1,1,0,0,0|2,0,0]=4 2432 B9R0.11 CC(C)CC(C)(C)C(=O)O MCULE-1527618443 [0,1,1,0,0,0|2,0,0]=4 2433 B9R0.11 CC(C)CC(C)(F)C(=O)O MCULE-9239880064 [0,1,1,0,0,0|2,0,0]=4 2434 B9R0.11 CC(C)CC(C)(N)C(=O)N MCULE-8569516764 [0,1,1,0,0,0|2,0,0]=4 2435 B9R0.11 CC(C)CC(C)(N)C(=O)O MCULE-4257632982 [0,1,1,0,0,0|1,0,0]=3 2436 B9R0.11 CC(C)CC(C)(N)C(=O)O MCULE-6991659149 [0,1,1,0,0,0|1,0,0]=3 2437 B9R0.11 CC(C)CC(C)(O)C(=O)O MCULE-6600862818 [0,1,1,0,0,0|2,0,0]=4 2438 B9R0.11 CC(C)C[C@@](C)(N)C(=O)O MCULE-4712290479 [0,1,1,0,0,0|1,0,0]=3 2439 B9R0.11 CC(C)C[C@@](C)(N)C(=O)O MCULE-9085844136 [0,1,1,0,0,0|1,0,0]=3 2440 B9R0.11 CC(C)C[C@](C)(N)C(=O)O MCULE-6073129801 [0,1,1,0,0,0|1,0,0]=3 2441 B9R0.11 CC(C)C[C@](C)(N)C(=O)O MCULE-7162987343 [0,1,1,0,0,0|1,0,0]=3 2442 B9R0.11 CC(N)(CC(=O)O)C(=O)O MCULE-3390093551 [0,1,1,0,0,0|1,0,1]=4 2443 B9R0.11 CC(N)(CC(=O)O)C(=O)O MCULE-4137717341 [0,1,1,0,0,0|1,0,1]=4 2444 B9R0.11 CN(C)CC(C)(N)C(=O)O MCULE-4857565953 [0,1,1,0,0,0|2,0,0]=4 2445 B9R0.11 C[C@@](N)(CC(=O)O)C(=O)O MCULE-5803003392 [0,1,1,0,0,0|1,0,1]=4 2446 B9R0.11 C[C@@](N)(CC(=O)O)C(=O)O MCULE-7987571569 [0,1,1,0,0,0|1,0,1]=4 2447 B9R0.11 C[C@](N)(CC(=O)O)C(=O)O MCULE-4314292616 [0,1,1,0,0,0|1,0,1]=4 2448 B9R0.57 CC(C)(C)CC(N)C(=O)O MCULE-1846409149 [0,1,1,0,0,0|1,0,0]=3 2449 B9R0.57 CC(C)(C)CC(N)C(=O)O MCULE-6496394437 [0,1,1,0,0,0|1,0,0]=3 2450 B9R0.57 CC(C)(C)CC(N)C(=O)O MCULE-6507277407 [0,1,1,0,0,0|1,0,0]=3 2451 B9R0.57 CC(C)(C)CC(O)C(=O)O MCULE-2158861127 [0,1,1,0,0,0|2,0,0]=4 2452 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O MCULE-6215032420 [0,1,1,0,0,0|1,0,0]=3 2453 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O MCULE-8005575699 [0,1,1,0,0,0|1,0,0]=3 2454 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O MCULE-1515081556 [0,1,1,0,0,0|1,0,0]=3 2455 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O MCULE-3358775275 [0,1,1,0,0,0|1,0,0]=3 2456 B9R0.57 CC(C)(F)CC(N)C(=O)O MCULE-2499553394 [0,1,1,0,0,0|1,0,0]=3 2457 B9R0.57 CC(C)(F)C[C@H](N)C(=O)O MCULE-2670827731 [0,1,1,0,0,0|1,0,0]=3 2458 B9R0.57 CC(C)(F)C[C@H](N)C(=O)O MCULE-7946625431 [0,1,1,0,0,0|1,0,0]=3 2459 B9R0.57 CC(C)(O)CC(N)C(=O)[O-] MCULE-2378112153 [0,1,1,0,0,0|0,0,1]=3 2460 B9R0.57 CC(C)(O)CC(N)C(=O)[O-] MCULE-2969041989 [0,1,1,0,0,0|0,0,1]=3 2461 B9R0.57 CC(CC(C)(C)C)C(=O)O MCULE-1654401215 [0,1,1,0,0,0|2,0,0]=4 2462 B9R0.57 CC(CC(C)(C)N)C(=O)O MCULE-2497907613 [0,1,1,0,0,0|2,0,0]=4 2463 B9R0.57 CC(CC(C)(C)N)C(=O)O MCULE-7900482158 [0,1,1,0,0,0|2,0,0]=4 2464 B9R0.57 CS(=O)(=O)C[C@H](N)C(=O)O MCULE-1117561111 [0,1,1,0,0,0|1,0,1]=4 2465 B9R0.57 CS(=O)(=O)C[C@H](N)C(=O)O MCULE-3044564695 [0,1,1,0,0,0|1,0,1]=4 2466 B9R0.57 C[Si](C)(C)C[C@H](N)C(=O)O MCULE-5057039244 [0,1,1,0,0,0|1,1,0]=4 2467 B9R0.57 NC(CC(F)(F)F)C(=O)O MCULE-4670432872 [0,1,1,0,0,0|2,0,0]=4 2468 B9R0.57 NC(CC(F)(F)F)C(=O)O MCULE-7906484739 [0,1,1,0,0,0|2,0,0]=4 2469 B9R0.57 NC(CP(=O)(O)O)C(=O)O MCULE-3742656954 [0,1,1,0,0,0|2,0,0]=4 2470 B9R0.57 NC(CS(=O)(=O)O)C(=O)O MCULE-3360025136 [0,1,1,0,0,0|2,0,0]=4 2471 B9R0.57 NC(CS(=O)(=O)O)C(=O)O MCULE-4680118250 [0,1,1,0,0,0|2,0,0]=4 2472 B9R0.57 N[C@@H](CC(F)(F)F)C(=O)O MCULE-3474800558 [0,1,1,0,0,0|2,0,0]=4 2473 B9R0.57 N[C@@H](CC(F)(F)F)C(=O)O MCULE-5230934404 [0,1,1,0,0,0|2,0,0]=4 2474 B9R0.57 N[C@@H](CC(F)(F)F)C(=O)O MCULE-6065207677 [0,1,1,0,0,0|2,0,0]=4 2475 B9R0.57 N[C@@H](CC(F)(F)F)C(=O)O MCULE-6989845390 [0,1,1,0,0,0|2,0,0]=4 2476 B9R0.57 N[C@@H](CP(=O)(O)O)C(=O)O MCULE-6935567843 [0,1,1,0,0,0|2,0,0]=4 2477 B9R0.57 N[C@@H](CS(=O)(=O)O)C(=O)O MCULE-1558128725 [0,1,1,0,0,0|2,0,0]=4 2478 B9R0.57 N[C@@H](CS(=O)(=O)O)C(=O)O MCULE-6109276112 [0,1,1,0,0,0|2,0,0]=4 2479 B9R0.57 N[C@H](CC(F)(F)F)C(=O)O MCULE-1211212478 [0,1,1,0,0,0|2,0,0]=4 2480 B9R0.57 N[C@H](CC(F)(F)F)C(=O)O MCULE-1864367361 [0,1,1,0,0,0|2,0,0]=4 2481 B9R0.57 N[C@H](CC(F)(F)F)C(=O)O MCULE-4616647635 [0,1,1,0,0,0|2,0,0]=4 2482 B9R0.57 N[C@H](CC(F)(F)F)C(=O)O MCULE-6212697927 [0,1,1,0,0,0|2,0,0]=4 2483 B9R0.79 CC(C(=O)O)C(N)C(=O)O MCULE-7699599383 [0,1,1,0,0,0|1,0,1]=4 2484 B9R0.79 CC(C(=O)O)[C@H](N)C(=O)O MCULE-1516476673 [0,1,1,0,0,0|1,0,1]=4 2485 B9R0.79 CC(C)C(O)C(N)C(=O)O MCULE-8766263714 [0,1,1,0,0,0|1,0,0]=3 2486 B9R0.79 CC(C)C(O)[C@H](N)C(=O)O MCULE-5332720895 [0,1,1,0,0,0|1,0,0]=3 2487 B9R0.79 CC(C)[C@@H](O)[C@@H](C)C(=O)O MCULE-5667397461 [0,1,1,0,0,0|2,0,0]=4 2488 B9R0.79 CC(C)[C@@H](O)[C@@H](N)C(=O)O MCULE-2425417830 [0,1,1,0,0,0|1,0,0]=3 2489 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-5438285037 [0,1,1,0,0,0|1,0,0]=3 2490 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-6278820254 [0,1,1,0,0,0|1,0,0]=3 2491 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-7542741263 [0,1,1,0,0,0|1,0,0]=3 2492 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-8101644962 [0,1,1,0,0,0|1,0,0]=3 2493 B9R0.79 CC(C)[C@H](O)[C@@H](N)C(=O)O MCULE-6429723072 [0,1,1,0,0,0|1,0,0]=3 2494 B9R0.79 CC(C)[C@H](O)[C@@H](N)C(=O)O MCULE-8455636907 [0,1,1,0,0,0|1,0,0]=3 2495 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O MCULE-9657202987 [0,1,1,0,0,0|1,0,0]=3 2496 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O MCULE-9762128000 [0,1,1,0,0,0|1,0,0]=3 2497 B9R0.79 CC(O)C(C)C(N)C(=O)O MCULE-2897656809 [0,1,1,0,0,0|0,0,0]=2 2498 B9R0.79 CC(O)[C@H](C)[C@H](N)C(=O)O MCULE-6535308910 [0,1,1,0,0,0|0,0,0]=2 2499 B9R0.79 CC(O)[C@H](C)[C@H](N)C(=O)O MCULE-8450789997 [0,1,1,0,0,0|0,0,0]=2 2500 B9R0.79 C[C@H](C(=O)O)[C@@H](N)C(=O)O MCULE-1232463081 [0,1,1,0,0,0|1,0,1]=4 2501 B9R0.79 C[C@H](C(=O)O)[C@H](N)C(=O)O MCULE-3277052139 [0,1,1,0,0,0|1,0,1]=4 2502 B9R0.79 C[C@H](O)[C@H](C)[C@H](N)C(=O)O MCULE-1376333194 [0,1,1,0,0,0|0,0,0]=2 2503 B9R0.79 C[C@H](O)[C@H](C)[C@H](N)C(=O)O MCULE-4005119004 [0,1,1,0,0,0|0,0,0]=2 2504 B9R0.79 NC(C(=O)O)C(N)C(=O)O MCULE-8316230798 [0,1,1,0,0,0|1,0,1]=4 2505 B9R0.79 NC(C(=O)O)C(O)C(=O)O MCULE-9532787420 [0,1,1,0,0,0|1,0,1]=4 2506 B9R0.79 N[C@@H](C(=O)O)[C@@H](F)C(=O)O MCULE-2171226271 [0,1,1,0,0,0|1,0,1]=4 2507 B9R0.79 N[C@H](C(=O)O)[C@@H](N)C(=O)O MCULE-6540811499 [0,1,1,0,0,0|1,0,1]=4 2508 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O MCULE-1913101511 [0,1,1,0,0,0|1,0,1]=4 2509 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O MCULE-9488918896 [0,1,1,0,0,0|1,0,1]=4 2510 B9R0.79 [C@@H](N)(C(=O)O)[C@@H](C)C(C)O MCULE-7488780154 [0,1,1,0,0,0|0,0,0]=2 2511 B9R0.1 CCC(C)CCCC(=O)O MCULE-5124776736 [0,1,1,0,0,0|2,0,0]=4 2512 B9R0.1 COC(=O)CNCC(=O)O MCULE-2471794774 [0,1,1,0,0,0|0,0,2]=4 2513 B9R0.1 COC(=O)CNCC(C)C MCULE-6522627999 [0,1,1,0,0,0|1,0,0]=3 2514 B9R0.1 O=C(O)CCCC(O)CO MCULE-8338266320 [0,1,1,0,0,0|1,0,0]=3 2515 B9R0.53 CC(C)CC(C)CC(=O)O MCULE-6189870651 [0,1,1,0,0,0|2,0,0]=4 2516 B9R0.53 CC(C)CC(N)CC(=O)O MCULE-3491123553 [0,1,1,0,0,0|2,0,0]=4 2517 B9R0.53 CC(C)CC(N)CC(=O)O MCULE-4917004131 [0,1,1,0,0,0|2,0,0]=4 2518 B9R0.53 CC(C)CC(N)CC(=O)O MCULE-9751191377 [0,1,1,0,0,0|2,0,0]=4 2519 B9R0.53 CC(C)CC(O)CC(=O)O MCULE-2536433460 [0,1,1,0,0,0|2,0,0]=4 2520 B9R0.53 CC(C)C[C@@H](N)CC(=O)O MCULE-1906257031 [0,1,1,0,0,0|2,0,0]=4 2521 B9R0.53 CC(C)C[C@@H](N)CC(=O)O MCULE-5676550364 [0,1,1,0,0,0|2,0,0]=4 2522 B9R0.53 CC(C)C[C@@H](N)CC(=O)O MCULE-8752852377 [0,1,1,0,0,0|2,0,0]=4 2523 B9R0.53 CC(C)C[C@@H](N)CC(=O)O MCULE-9926372034 [0,1,1,0,0,0|2,0,0]=4 2524 B9R0.53 CC(C)C[C@H](N)CC(=O)O MCULE-5502640895 [0,1,1,0,0,0|2,0,0]=4 2525 B9R0.53 CC(C)C[C@H](N)CC(=O)O MCULE-5602246196 [0,1,1,0,0,0|2,0,0]=4 2526 B9R0.53 CC(C)C[C@H](N)CC(=O)O MCULE-6522397846 [0,1,1,0,0,0|2,0,0]=4 2527 B9R0.53 CC(C)C[C@H](N)CC(=O)O MCULE-8594791252 [0,1,1,0,0,0|2,0,0]=4 2528 B9R0.53 CC(O)CN(C)CC(C)O MCULE-9058207509 [0,1,1,0,0,0|1,0,1]=4 2529 B9R0.53 CC(O)CN(O)CC(C)O MCULE-1746966957 [0,1,1,0,0,0|1,0,1]=4 2530 B9R0.53 CN(CC(=O)O)CC(=O)O MCULE-6535937676 [0,1,1,0,0,0|1,0,1]=4 2531 B9R0.53 CN(CC(=O)O)CC(=O)O MCULE-9119313390 [0,1,1,0,0,0|1,0,1]=4 2532 B9R0.53 NN(CC(=O)O)CC(=O)O MCULE-6707699178 [0,1,1,0,0,0|1,0,1]=4 2533 B9R0.56 CC(C)(C)CCCC(=O)O MCULE-2659832762 [0,1,1,0,0,0|2,0,0]=4 2534 B9R0.56 CC(C)(C)CNCC(=O)O MCULE-1268208354 [0,1,1,0,0,0|1,0,0]=3 2535 B9R0.56 CC(C)(C)CNCC(=O)O MCULE-5430860345 [0,1,1,0,0,0|1,0,0]=3 2536 B9R0.56 CC(C)(N)COCC(=O)O MCULE-6736911202 [0,1,1,0,0,0|2,0,0]=4 2537 B9R0.56 O=C(O)CNCC(F)(F)F MCULE-4901432382 [0,1,1,0,0,0|2,0,0]=4 2538 B9R0.56 O=C(O)CNCC(F)(F)F MCULE-8079486959 [0,1,1,0,0,0|2,0,0]=4 2539 B9R0.56 O=C(O)CNCP(=O)(O)O MCULE-3308266821 [0,1,1,0,0,0|2,0,0]=4 2540 B9R1.7 COCC1CC(CN1)O MCULE-1719796553 [1,1,0,0,0,0|0,0,1]=3 2541 B9R1.7 COCC1CC(CN1)O MCULE-2828004706 [1,1,0,0,0,0|0,0,1]=3 2542 B9R1.7 COC[C@@H]1C[C@@H](CN1)O MCULE-4903855773 [1,1,0,0,0,0|0,0,1]=3 2543 B9R1.7 COC[C@@H]1C[C@@H](CN1)O MCULE-5035930973 [1,1,0,0,0,0|0,0,1]=3 2544 B9R1.7 COC[C@@H]1C[C@H](CN1)O MCULE-1656210028 [1,1,0,0,0,0|0,0,1]=3 2545 B9R1.7 COC[C@@H]1C[C@H](CN1)O MCULE-8717772588 [1,1,0,0,0,0|0,0,1]=3 2546 B9R1.7 COC[C@H]1C[C@H](CN1)O MCULE-7483280166 [1,1,0,0,0,0|0,0,1]=3 2547 B9R1.7 COC[C@H]1C[C@H](CN1)O MCULE-7672691308 [1,1,0,0,0,0|0,0,1]=3 2548 B9R1.21 CO[C@H]1CN[C@@H](C1)CO MCULE-2365069332 [1,1,0,0,0,0|0,0,1]=3 2549 B9R1.21 OCC1CNC(C1)CO MCULE-7672485489 [1,1,0,0,0,0|0,0,1]=3 2550 B9R1.21 OCC1CNC(C1)CO MCULE-7965706550 [1,1,0,0,0,0|0,0,1]=3 2551 B9R1.22 CN1CC(CC1CN)O MCULE-7600471860 [1,1,0,0,0,0|1,0,1]=4 2552 B9R1.22 CN1CC(CC1CO)N MCULE-1845795343 [1,1,0,0,0,0|1,0,1]=4 2553 B9R1.22 CN1CC(CC1CO)O MCULE-2631177865 [1,1,0,0,0,0|0,0,1]=3 2554 B9R1.22 CN1CC(CC1CO)O MCULE-7941036683 [1,1,0,0,0,0|0,0,1]=3 2555 B9R1.22 CN1C[C@@H](C[C@H]1CO)F MCULE-3142904022 [1,1,0,0,0,0|1,0,1]=4 2556 B9R1.22 CN1C[C@@H](C[C@H]1CO)F MCULE-4168126464 [1,1,0,0,0,0|1,0,1]=4 2557 B9R1.22 CN1C[C@@H](C[C@H]1CO)N MCULE-6364925454 [1,1,0,0,0,0|1,0,1]=4 2558 B9R1.22 CN1C[C@@H](C[C@H]1CO)N MCULE-7340998334 [1,1,0,0,0,0|1,0,1]=4 2559 B9R1.22 CN1C[C@@H](C[C@H]1CO)O MCULE-6835957451 [1,1,0,0,0,0|0,0,1]=3 2560 B9R1.22 CN1C[C@@H](C[C@H]1CO)O MCULE-6937864936 [1,1,0,0,0,0|0,0,1]=3 2561 B9R1.22 CN1C[C@@H](C[C@H]1CO)O MCULE-7885385401 [1,1,0,0,0,0|0,0,1]=3 2562 B9R1.22 CN1C[C@@H](C[C@H]1CO)O MCULE-9581024864 [1,1,0,0,0,0|0,0,1]=3 2563 B9R1.22 CN1C[C@H](C[C@H]1CO)F MCULE-4625607347 [1,1,0,0,0,0|1,0,1]=4 2564 B9R1.22 CN1C[C@H](C[C@H]1CO)F MCULE-8259673538 [1,1,0,0,0,0|1,0,1]=4 2565 B9R1.22 CN1C[C@H](C[C@H]1CO)N MCULE-1031920182 [1,1,0,0,0,0|1,0,1]=4 2566 B9R1.22 CN1C[C@H](C[C@H]1CO)N MCULE-5184140250 [1,1,0,0,0,0|1,0,1]=4 2567 B9R1.22 CN1C[C@H](C[C@H]1CO)O MCULE-6254507858 [1,1,0,0,0,0|0,0,1]=3 2568 B9R1.23 OCC1CC(C(O1)O)O MCULE-1894937679 [1,1,0,0,0,0|1,0,1]=4 2569 B9R1.125 CC1(CC(CN1)O)CO MCULE-2899118253 [1,1,0,0,0,0|0,0,1]=3 2570 B9R1.125 CC1(CC(CN1)O)CO MCULE-8954323319 [1,1,0,0,0,0|0,0,1]=3 2571 B9R1.132 OCC1NCC(C1O)O MCULE-7093172739 [1,1,0,0,0,0|0,0,1]=3 2572 B9R1.132 OCC1NCC(C1O)O MCULE-9377849443 [1,1,0,0,0,0|0,0,1]=3 2573 B9R1.132 OCC1OCC(C1O)O MCULE-6035918255 [1,1,0,0,0,0|1,0,1]=4 2574 B9R1.132 OC[C@@H]1OC[C@H]([C@H]1O)O MCULE-5977248366 [1,1,0,0,0,0|1,0,1]=4 2575 B9R1.132 OC[C@H]1NC[C@@H]([C@@H]1O)O MCULE-1707860323 [1,1,0,0,0,0|0,0,1]=3 2576 B9R1.132 OC[C@H]1NC[C@@H]([C@@H]1O)O MCULE-3279393618 [1,1,0,0,0,0|0,0,1]=3 2577 B9R1.132 OC[C@H]1NC[C@@H]([C@@H]1O)O MCULE-8001939489 [1,1,0,0,0,0|0,0,1]=3 2578 B9R1.132 OC[C@H]1NC[C@@H]([C@@H]1O)O MCULE-9735967120 [1,1,0,0,0,0|0,0,1]=3 2579 B9R1.132 OC[C@H]1NC[C@H]([C@@H]1O)O MCULE-2264267716 [1,1,0,0,0,0|0,0,1]=3 2580 B9R1.132 OC[C@H]1NC[C@H]([C@@H]1O)O MCULE-3690741497 [1,1,0,0,0,0|0,0,1]=3 2581 B9R1.132 OC[C@H]1NC[C@H]([C@H]1O)O MCULE-1695946114 [1,1,0,0,0,0|0,0,1]=3 2582 B9R1.132 OC[C@H]1NC[C@H]([C@H]1O)O MCULE-4767198765 [1,1,0,0,0,0|0,0,1]=3 2583 B9R1.132 OC[C@H]1NC[C@H]([C@H]1O)O MCULE-7740799111 [1,1,0,0,0,0|0,0,1]=3 2584 B9R1.132 OC[C@H]1NC[C@H]([C@H]1O)O MCULE-9816210484 [1,1,0,0,0,0|0,0,1]=3 2585 B9R1.132 OC[C@H]1OC[C@@H]([C@@H]1O)O MCULE-2426542638 [1,1,0,0,0,0|1,0,1]=4 2586 B9R1.132 OC[C@H]1OC[C@@H]([C@H]1O)O MCULE-2697830391 [1,1,0,0,0,0|1,0,1]=4 2587 B9R1.132 OC[C@H]1OC[C@@H]([C@H]1O)O MCULE-3664631398 [1,1,0,0,0,0|1,0,1]=4 2588 B9R1.132 OC[C@H]1SC[C@@H]([C@@H]1O)O MCULE-5460809648 [1,1,0,0,0,0|1,0,1]=4 2589 B9R1.133 C1(CC(CN1)(F)F)CO MCULE-4519700340 [1,1,0,0,0,0|1,0,1]=4 2590 B9R1.133 C1(CC(CN1)(F)F)CO MCULE-8208172101 [1,1,0,0,0,0|1,0,1]=4 2591 B9R1.133 CC1(CNC(C1)CO)C MCULE-2739458307 [1,1,0,0,0,0|1,0,1]=4 2592 B9R1.133 CC1(CNC(C1)CO)C MCULE-7568309276 [1,1,0,0,0,0|1,0,1]=4 2593 B9R1.133 CC1(CNC(C1)CO)C MCULE-9200652792 [1,1,0,0,0,0|1,0,1]=4 2594 B9R1.133 CC1(CN[C@@H](C1)CO)C MCULE-4354389531 [1,1,0,0,0,0|1,0,1]=4 2595 B9R1.133 CC1(CN[C@@H](C1)CO)C MCULE-5413661873 [1,1,0,0,0,0|1,0,1]=4 2596 B9R1.133 CC1(CN[C@@H](C1)CO)C MCULE-6122345231 [1,1,0,0,0,0|1,0,1]=4 2597 B9R1.133 CC1(CN[C@@H](C1)CO)C MCULE-6219822782 [1,1,0,0,0,0|1,0,1]=4 2598 B9R1.133 CC1(CN[C@H](C1)CO)C MCULE-5894469523 [1,1,0,0,0,0|1,0,1]=4 2599 B9R1.133 CC1(CN[C@H](C1)CO)C MCULE-8665542622 [1,1,0,0,0,0|1,0,1]=4 2600 B9R1.133 O=CC1CCC(C1)(F)F MCULE-5329563589 [1,1,0,0,0,0|2,0,0]=4 2601 B9R1.133 OCC1CC(CN1)(F)F MCULE-2428727626 [1,1,0,0,0,0|1,0,1]=4 2602 B9R1.133 OCC1CC(CN1)(F)F MCULE-3661500291 [1,1,0,0,0,0|1,0,1]=4 2603 B9R1.133 OC[C@@H]1CC(CN1)(F)F MCULE-1065687078 [1,1,0,0,0,0|1,0,1]=4 2604 B9R1.133 OC[C@@H]1CC(CN1)(F)F MCULE-1385870482 [1,1,0,0,0,0|1,0,1]=4 2605 B9R1.133 OC[C@@H]1CC(CN1)(F)F MCULE-2384042076 [1,1,0,0,0,0|1,0,1]=4 2606 B9R1.133 OC[C@@H]1CC(CN1)(F)F MCULE-6283288203 [1,1,0,0,0,0|1,0,1]=4 2607 B9R1.133 OC[C@H]1CC(CN1)(F)F MCULE-5851362765 [1,1,0,0,0,0|1,0,1]=4 2608 B9R1.133 OC[C@H]1CC(CN1)(F)F MCULE-7938627949 [1,1,0,0,0,0|1,0,1]=4 2609 B9R1.133 OC[C@H]1CC(CN1)(F)F MCULE-8789515582 [1,1,0,0,0,0|1,0,1]=4 2610 B9R1.133 OC[C@H]1CC(CN1)(F)F MCULE-8852053847 [1,1,0,0,0,0|1,0,1]=4 2611 B9R1.11 C1(CCNC1)C(=O)OC MCULE-6356797990 [1,1,0,0,0,0|2,0,0]=4 2612 B9R1.11 C1(CCNC1)C(=O)OC MCULE-7101201723 [1,1,0,0,0,0|2,0,0]=4 2613 B9R1.11 C1(CCNC1)C(=O)OC MCULE-8951983412 [1,1,0,0,0,0|2,0,0]=4 2614 B9R1.11 C1(CCOC1)C(=O)OC MCULE-6831054690 [1,1,0,0,0,0|2,0,0]=4 2615 B9R1.11 CCC(=O)C1CCCC1 MCULE-4431631098 [1,1,0,0,0,0|2,0,0]=4 2616 B9R1.11 CCC(=O)[C@@H]1CCCN1 MCULE-1661804964 [1,1,0,0,0,0|1,0,0]=3 2617 B9R1.11 CCC(=O)[C@@H]1CCCN1 MCULE-8456135152 [1,1,0,0,0,0|1,0,0]=3 2618 B9R1.11 CNC(=O)C1CCCC1 MCULE-1170525718 [1,1,0,0,0,0|2,0,0]=4 2619 B9R1.11 CNC(=O)C1CCCN1 MCULE-1783490658 [1,1,0,0,0,0|1,0,0]=3 2620 B9R1.11 CNC(=O)C1CCCN1 MCULE-5014608316 [1,1,0,0,0,0|1,0,0]=3 2621 B9R1.11 CNC(=O)[C@@H]1CCCN1 MCULE-3668444015 [1,1,0,0,0,0|1,0,0]=3 2622 B9R1.11 CNC(=O)[C@@H]1CCCN1 MCULE-7344672390 [1,1,0,0,0,0|1,0,0]=3 2623 B9R1.11 CNC(=O)[C@@H]1CCCN1 MCULE-7586915644 [1,1,0,0,0,0|1,0,0]=3 2624 B9R1.11 CNC(=O)[C@@H]1CCCN1 MCULE-8093231474 [1,1,0,0,0,0|1,0,0]=3 2625 B9R1.11 CNC(=O)[C@@H]1CCCN1 MCULE-9455499550 [1,1,0,0,0,0|1,0,0]=3 2626 B9R1.11 CNC(=O)[C@H]1CCCN1 MCULE-1131638831 [1,1,0,0,0,0|1,0,0]=3 2627 B9R1.11 CNC(=O)[C@H]1CCCN1 MCULE-4056775238 [1,1,0,0,0,0|1,0,0]=3 2628 B9R1.11 CNC(=O)[C@H]1CCCN1 MCULE-4223546600 [1,1,0,0,0,0|1,0,0]=3 2629 B9R1.11 CNC(=O)[C@H]1CCCN1 MCULE-6583071684 [1,1,0,0,0,0|1,0,0]=3 2630 B9R1.11 COC(=N)C1CCCC1 MCULE-3923627958 [1,1,0,0,0,0|2,0,0]=4 2631 B9R1.11 COC(=N)C1CCCC1 MCULE-5894752285 [1,1,0,0,0,0|2,0,0]=4 2632 B9R1.11 COC(=O)C1=CCCC1 MCULE-3606282792 [1,1,0,0,0,0|1,0,1]=4 2633 B9R1.11 COC(=O)C1C=CCN1 MCULE-5230080312 [1,1,0,0,0,0|0,0,2]=4 2634 B9R1.11 COC(=O)C1C=CCN1 MCULE-8144796741 [1,1,0,0,0,0|0,0,2]=4 2635 B9R1.11 COC(=O)C1CCCC1 MCULE-6212031690 [1,1,0,0,0,0|1,0,0]=3 2636 B9R1.11 COC(=O)C1CCCN1 MCULE-3132842932 [1,1,0,0,0,0|0,0,0]=2 2637 B9R1.11 COC(=O)C1CCCN1 MCULE-5268897425 [1,1,0,0,0,0|0,0,0]=2 2638 B9R1.11 COC(=O)C1CCCN1 MCULE-6168730709 [1,1,0,0,0,0|0,0,0]=2 2639 B9R1.11 COC(=O)C1CCCN1 MCULE-8316785654 [1,1,0,0,0,0|0,0,0]=2 2640 B9R1.11 COC(=O)C1CCCO1 MCULE-2538391455 [1,1,0,0,0,0|1,0,0]=3 2641 B9R1.11 COC(=O)C1CCCS1 MCULE-8875125328 [1,1,0,0,0,0|1,0,0]=3 2642 B9R1.11 COC(=O)C1CCNC1 MCULE-1630900792 [1,1,0,0,0,0|2,0,0]=4 2643 B9R1.11 COC(=O)C1CCNC1 MCULE-5845908055 [1,1,0,0,0,0|2,0,0]=4 2644 B9R1.11 COC(=O)C1CCNC1 MCULE-8849407954 [1,1,0,0,0,0|2,0,0]=4 2645 B9R1.11 COC(=O)C1CCOC1 MCULE-8088199992 [1,1,0,0,0,0|2,0,0]=4 2646 B9R1.11 COC(=O)C1CSCN1 MCULE-5351052142 [1,1,0,0,0,0|1,0,0]=3 2647 B9R1.11 COC(=O)C1CSCN1 MCULE-9093296447 [1,1,0,0,0,0|1,0,0]=3 2648 B9R1.11 COC(=O)C1NCCS1 MCULE-8142325663 [1,1,0,0,0,0|1,0,0]=3 2649 B9R1.11 COC(=O)C1[NH2+]CCS1 MCULE-5863059145 [1,1,0,0,0,0|1,0,1]=4 2650 B9R1.11 COC(=O)N1CCCC1 MCULE-1240116216 [1,1,0,0,0,0|2,0,0]=4 2651 B9R1.11 COC(=O)[C@@H]1C=CCN1 MCULE-1869723316 [1,1,0,0,0,0|0,0,2]=4 2652 B9R1.11 COC(=O)[C@@H]1C=CCN1 MCULE-5370163237 [1,1,0,0,0,0|0,0,2]=4 2653 B9R1.11 COC(=O)[C@@H]1C=CCN1 MCULE-5818736163 [1,1,0,0,0,0|0,0,2]=4 2654 B9R1.11 COC(=O)[C@@H]1C=CCN1 MCULE-7249261083 [1,1,0,0,0,0|0,0,2]=4 2655 B9R1.11 COC(=O)[C@@H]1CCCN1 MCULE-1981658590 [1,1,0,0,0,0|0,0,0]=2 2656 B9R1.11 COC(=O)[C@@H]1CCCN1 MCULE-6907716746 [1,1,0,0,0,0|0,0,0]=2 2657 B9R1.11 COC(=O)[C@@H]1CCCN1 MCULE-8031793722 [1,1,0,0,0,0|0,0,0]=2 2658 B9R1.11 COC(=O)[C@@H]1CCCN1 MCULE-9787777328 [1,1,0,0,0,0|0,0,0]=2 2659 B9R1.11 COC(=O)[C@@H]1CCNC1 MCULE-3233941315 [1,1,0,0,0,0|2,0,0]=4 2660 B9R1.11 COC(=O)[C@@H]1CCNC1 MCULE-4138957644 [1,1,0,0,0,0|2,0,0]=4 2661 B9R1.11 COC(=O)[C@@H]1CCNC1 MCULE-5401828810 [1,1,0,0,0,0|2,0,0]=4 2662 B9R1.11 COC(=O)[C@@H]1CCNC1 MCULE-6948701888 [1,1,0,0,0,0|2,0,0]=4 2663 B9R1.11 COC(=O)[C@@H]1CCNC1 MCULE-7639173642 [1,1,0,0,0,0|2,0,0]=4 2664 B9R1.11 COC(=O)[C@@H]1CCNC1 MCULE-9871868573 [1,1,0,0,0,0|2,0,0]=4 2665 B9R1.11 COC(=O)[C@@H]1CCOC1 MCULE-2786445237 [1,1,0,0,0,0|2,0,0]=4 2666 B9R1.11 COC(=O)[C@@H]1CCOC1 MCULE-6419806426 [1,1,0,0,0,0|2,0,0]=4 2667 B9R1.11 COC(=O)[C@@H]1CSCN1 MCULE-5459284567 [1,1,0,0,0,0|1,0,0]=3 2668 B9R1.11 COC(=O)[C@@H]1CSCN1 MCULE-6009801924 [1,1,0,0,0,0|1,0,0]=3 2669 B9R1.11 COC(=O)[C@H]1CCCN1 MCULE-1925865650 [1,1,0,0,0,0|0,0,0]=2 2670 B9R1.11 COC(=O)[C@H]1CCCN1 MCULE-3950222089 [1,1,0,0,0,0|0,0,0]=2 2671 B9R1.11 COC(=O)[C@H]1CCCN1 MCULE-4251030243 [1,1,0,0,0,0|0,0,0]=2 2672 B9R1.11 COC(=O)[C@H]1CCCN1 MCULE-8974101732 [1,1,0,0,0,0|0,0,0]=2 2673 B9R1.11 COC(=O)[C@H]1CCNC1 MCULE-3002947292 [1,1,0,0,0,0|2,0,0]=4 2674 B9R1.11 COC(=O)[C@H]1CCNC1 MCULE-4023088392 [1,1,0,0,0,0|2,0,0]=4 2675 B9R1.11 COC(=O)[C@H]1CCNC1 MCULE-5206857621 [1,1,0,0,0,0|2,0,0]=4 2676 B9R1.11 COC(=O)[C@H]1CCNC1 MCULE-7688050113 [1,1,0,0,0,0|2,0,0]=4 2677 B9R1.11 COC(=O)[C@H]1CCNC1 MCULE-7976156203 [1,1,0,0,0,0|2,0,0]=4 2678 B9R1.11 COC(=O)[C@H]1CCNC1 MCULE-9431553560 [1,1,0,0,0,0|2,0,0]=4 2679 B9R1.11 COC(=O)[C@H]1CCOC1 MCULE-4215481469 [1,1,0,0,0,0|2,0,0]=4 2680 B9R1.11 COC(=O)[C@H]1CCOC1 MCULE-9152113033 [1,1,0,0,0,0|2,0,0]=4 2681 B9R1.11 N/C(=N\O)/C1CCCC1 MCULE-6643830969 [1,1,0,0,0,0|2,0,0]=4 2682 B9R1.11 N/C(=N\O)/C1CCCO1 MCULE-2644350923 [1,1,0,0,0,0|2,0,0]=4 2683 B9R1.11 NCC(=O)C1CCCC1 MCULE-2498486150 [1,1,0,0,0,0|2,0,0]=4 2684 B9R1.11 NCC(=O)C1CCCC1 MCULE-5406973286 [1,1,0,0,0,0|2,0,0]=4 2685 B9R1.11 NNC(=O)C1CCCC1 MCULE-5436769120 [1,1,0,0,0,0|2,0,0]=4 2686 B9R1.11 NNC(=O)C1CCCO1 MCULE-7320789673 [1,1,0,0,0,0|2,0,0]=4 2687 B9R1.11 NNC(=O)C1CCCO1 MCULE-9371435722 [1,1,0,0,0,0|2,0,0]=4 2688 B9R1.11 NNC(=O)C1CCCS1 MCULE-3948986935 [1,1,0,0,0,0|2,0,0]=4 2689 B9R1.11 NNC(=O)[C@@H]1CCCO1 MCULE-4678621422 [1,1,0,0,0,0|2,0,0]=4 2690 B9R1.11 NNC(=O)[C@H]1CCCO1 MCULE-2795201954 [1,1,0,0,0,0|2,0,0]=4 2691 B9R1.11 O=C(CBr)C1CCCC1 MCULE-4985111490 [1,1,0,0,0,0|2,0,0]=4 2692 B9R1.11 O=C(CBr)C1CCCO1 MCULE-9978996372 [1,1,0,0,0,0|2,0,0]=4 2693 B9R1.11 O=C(CCl)C1CCCC1 MCULE-7395779538 [1,1,0,0,0,0|2,0,0]=4 2694 B9R1.11 O=C(CCl)C1CCCN1 MCULE-3650713124 [1,1,0,0,0,0|1,0,0]=3 2695 B9R1.11 O=C(CCl)C1CCCO1 MCULE-4619044936 [1,1,0,0,0,0|2,0,0]=4 2696 B9R1.11 O=C(CO)N1CCCC1 MCULE-6227389604 [1,1,0,0,0,0|2,0,0]=4 2697 B9R1.11 O=C(NO)C1=CCCC1 MCULE-3789818826 [1,1,0,0,0,0|1,0,1]=4 2698 B9R1.11 O=C(NO)C1CCCC1 MCULE-3511706426 [1,1,0,0,0,0|1,0,0]=3 2699 B9R1.19 CC(C)(O)C1CCCN1 MCULE-3058549783 [1,1,0,0,0,0|1,0,1]=4 2700 B9R1.19 CC(C)(O)C1CCCN1 MCULE-7282873348 [1,1,0,0,0,0|1,0,1]=4 2701 B9R1.19 CC(C)(O)[C@@H]1CCCN1 MCULE-2324069180 [1,1,0,0,0,0|1,0,1]=4 2702 B9R1.19 CC(C)(O)[C@@H]1CCCN1 MCULE-3595619735 [1,1,0,0,0,0|1,0,1]=4 2703 B9R1.19 CC(C)(O)[C@@H]1CCCN1 MCULE-3842553890 [1,1,0,0,0,0|1,0,1]=4 2704 B9R1.19 CC(C)(O)[C@H]1CCCN1 MCULE-1082062321 [1,1,0,0,0,0|1,0,1]=4 2705 B9R1.19 CC(C)(O)[C@H]1CCCN1 MCULE-5364741590 [1,1,0,0,0,0|1,0,1]=4 2706 B9R1.19 CC(C)(O)[C@H]1CCCN1 MCULE-8737105400 [1,1,0,0,0,0|1,0,1]=4 2707 B9R1.19 CC(C)(O)[C@H]1CCCN1 MCULE-9021200021 [1,1,0,0,0,0|1,0,1]=4 2708 B9R1.19 O=P(O)(O)C1CCCN1 MCULE-1507527616 [1,1,0,0,0,0|1,0,0]=3 2709 B9R1.19 O=P(O)(O)C1CCCN1 MCULE-9994872613 [1,1,0,0,0,0|1,0,0]=3 2710 B9R1.19 O=S(=O)(O)C1CCCC1 MCULE-7644931575 [1,1,0,0,0,0|2,0,0]=4 2711 B9R1.41 C1(CCCN1C)C(=O)O MCULE-7988130618 [1,1,0,0,0,0|0,0,0]=2 2712 B9R1.41 CC(=O)C1CCCC1=O MCULE-8152440536 [1,1,0,0,0,0|2,0,0]=4 2713 B9R1.41 CC(O)C1CCCN1C MCULE-1709841217 [1,1,0,0,0,0|1,0,1]=4 2714 B9R1.41 CC1=C(CCC1)C(=O)O MCULE-4166872703 [1,1,0,0,0,0|1,0,1]=4 2715 B9R1.41 CC1CCCC1C(=O)O MCULE-5150428001 [1,1,0,0,0,0|1,0,0]=3 2716 B9R1.41 CC1CCNC1C(=O)O MCULE-3835684911 [1,1,0,0,0,0|0,0,0]=2 2717 B9R1.41 CC1CCNC1C(=O)O MCULE-8361777649 [1,1,0,0,0,0|0,0,0]=2 2718 B9R1.41 CC1CNCC1C(=O)O MCULE-1581522558 [1,1,0,0,0,0|2,0,0]=4 2719 B9R1.41 CC1CNCC1C(=O)O MCULE-6848551085 [1,1,0,0,0,0|2,0,0]=4 2720 B9R1.41 CC1NCCC1C(=O)O MCULE-5042669811 [1,1,0,0,0,0|2,0,0]=4 2721 B9R1.41 CC1NCCC1C(=O)O MCULE-8546677468 [1,1,0,0,0,0|2,0,0]=4 2722 B9R1.41 CC1OCCC1C(=O)O MCULE-4181521736 [1,1,0,0,0,0|2,0,0]=4 2723 B9R1.41 CN1CC=CC1C(=O)O MCULE-5525753116 [1,1,0,0,0,0|0,0,2]=4 2724 B9R1.41 CN1CC=CC1C(=O)O MCULE-8585806688 [1,1,0,0,0,0|0,0,2]=4 2725 B9R1.41 CN1CCCC1C(=O)N MCULE-1474656837 [1,1,0,0,0,0|1,0,0]=3 2726 B9R1.41 CN1CCCC1C(=O)O MCULE-4884381644 [1,1,0,0,0,0|0,0,0]=2 2727 B9R1.41 CN1CCCC1C(=O)O MCULE-6241162207 [1,1,0,0,0,0|0,0,0]=2 2728 B9R1.41 CN1CCCC1C(=O)O MCULE-7232060205 [1,1,0,0,0,0|0,0,0]=2 2729 B9R1.41 CN1CCC[C@@H]1C(=O)N MCULE-1129223179 [1,1,0,0,0,0|1,0,0]=3 2730 B9R1.41 CN1CCC[C@@H]1C(=O)N MCULE-1418743058 [1,1,0,0,0,0|1,0,0]=3 2731 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-3947573313 [1,1,0,0,0,0|0,0,0]=2 2732 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-4168419254 [1,1,0,0,0,0|0,0,0]=2 2733 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-6504349835 [1,1,0,0,0,0|0,0,0]=2 2734 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-9943329201 [1,1,0,0,0,0|0,0,0]=2 2735 B9R1.41 CN1CCC[C@H]1C(=O)N MCULE-1155656545 [1,1,0,0,0,0|1,0,0]=3 2736 B9R1.41 CN1CCC[C@H]1C(=O)N MCULE-5987152150 [1,1,0,0,0,0|1,0,0]=3 2737 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-1661156416 [1,1,0,0,0,0|0,0,0]=2 2738 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-2535799805 [1,1,0,0,0,0|0,0,0]=2 2739 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-3283459585 [1,1,0,0,0,0|0,0,0]=2 2740 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-5506159927 [1,1,0,0,0,0|0,0,0]=2 2741 B9R1.41 CN1CSCC1C(=O)O MCULE-6053778396 [1,1,0,0,0,0|1,0,0]=3 2742 B9R1.41 CN1CSCC1C(=O)O MCULE-8768199445 [1,1,0,0,0,0|1,0,0]=3 2743 B9R1.41 CN1CSC[C@@H]1C(=O)O MCULE-9390031358 [1,1,0,0,0,0|1,0,0]=3 2744 B9R1.41 CN1CSC[C@H]1C(=O)O MCULE-2295281512 [1,1,0,0,0,0|1,0,0]=3 2745 B9R1.41 CN1CSC[C@H]1C(=O)O MCULE-3344236668 [1,1,0,0,0,0|1,0,0]=3 2746 B9R1.41 CN1CSC[C@H]1C(=O)O MCULE-6116857567 [1,1,0,0,0,0|1,0,0]=3 2747 B9R1.41 CN1CSC[C@H]1C(=O)O MCULE-7315008971 [1,1,0,0,0,0|1,0,0]=3 2748 B9R1.41 C[C@@H]1CCN[C@@H]1C(=O)O MCULE-6239309390 [1,1,0,0,0,0|0,0,0]=2 2749 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O MCULE-1608471752 [1,1,0,0,0,0|0,0,0]=2 2750 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O MCULE-2896759092 [1,1,0,0,0,0|0,0,0]=2 2751 B9R1.41 C[C@@H]1CCO[C@H]1C(=O)O MCULE-5338216485 [1,1,0,0,0,0|1,0,0]=3 2752 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O MCULE-3425733853 [1,1,0,0,0,0|2,0,0]=4 2753 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O MCULE-5424989009 [1,1,0,0,0,0|2,0,0]=4 2754 B9R1.41 C[C@@H]1NCC[C@@H]1C(=O)O MCULE-1674735474 [1,1,0,0,0,0|2,0,0]=4 2755 B9R1.41 C[C@@H]1NCC[C@H]1C(=O)O MCULE-8959062032 [1,1,0,0,0,0|2,0,0]=4 2756 B9R1.41 C[C@@H]1NCC[C@H]1C(=O)O MCULE-9340754868 [1,1,0,0,0,0|2,0,0]=4 2757 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O MCULE-4624227681 [1,1,0,0,0,0|2,0,0]=4 2758 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O MCULE-4653588182 [1,1,0,0,0,0|2,0,0]=4 2759 B9R1.41 C[C@H](O)[C@@H]1CCCN1C MCULE-3481136719 [1,1,0,0,0,0|1,0,1]=4 2760 B9R1.41 C[C@H](O)[C@@H]1CCCN1C MCULE-8355283874 [1,1,0,0,0,0|1,0,1]=4 2761 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O MCULE-1694933393 [1,1,0,0,0,0|0,0,0]=2 2762 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O MCULE-9088637113 [1,1,0,0,0,0|0,0,0]=2 2763 B9R1.41 C[C@H]1CCN[C@H]1C(=O)O MCULE-1449988566 [1,1,0,0,0,0|0,0,0]=2 2764 B9R1.41 C[C@H]1NCC[C@@H]1C(=O)O MCULE-3190006541 [1,1,0,0,0,0|2,0,0]=4 2765 B9R1.41 C[C@H]1NCC[C@@H]1C(=O)O MCULE-7835079063 [1,1,0,0,0,0|2,0,0]=4 2766 B9R1.41 C[C@H]1NCC[C@H]1C(=O)O MCULE-1189864899 [1,1,0,0,0,0|2,0,0]=4 2767 B9R1.41 C[C@H]1NCC[C@H]1C(=O)O MCULE-8012665255 [1,1,0,0,0,0|2,0,0]=4 2768 B9R1.41 NC(=O)C1CCCC1=O MCULE-2399127943 [1,1,0,0,0,0|2,0,0]=4 2769 B9R1.41 NC(=O)C1CCCC1N MCULE-5593863466 [1,1,0,0,0,0|2,0,0]=4 2770 B9R1.41 NC(=O)C1CCCC1N MCULE-7208597206 [1,1,0,0,0,0|2,0,0]=4 2771 B9R1.41 NC(=O)C1NCCC1O MCULE-1947851170 [1,1,0,0,0,0|1,0,0]=3 2772 B9R1.41 NC(=O)C1NCCC1O MCULE-8983481897 [1,1,0,0,0,0|1,0,0]=3 2773 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-1275176642 [1,1,0,0,0,0|2,0,0]=4 2774 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-2107283008 [1,1,0,0,0,0|2,0,0]=4 2775 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-2865532845 [1,1,0,0,0,0|2,0,0]=4 2776 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-3874121291 [1,1,0,0,0,0|2,0,0]=4 2777 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1O MCULE-7290076922 [1,1,0,0,0,0|2,0,0]=4 2778 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O MCULE-1119399523 [1,1,0,0,0,0|1,0,0]=3 2779 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O MCULE-4733398267 [1,1,0,0,0,0|1,0,0]=3 2780 B9R1.41 NC(=O)[C@H]1NCC[C@H]1O MCULE-8085547151 [1,1,0,0,0,0|1,0,0]=3 2781 B9R1.41 NC(=O)[C@H]1NCC[C@H]1O MCULE-8491779714 [1,1,0,0,0,0|1,0,0]=3 2782 B9R1.41 NC1=C(CCC1)C(=O)O MCULE-9287668193 [1,1,0,0,0,0|1,0,1]=4 2783 B9R1.41 NC1CCCC1C(=O)O MCULE-4916984038 [1,1,0,0,0,0|1,0,0]=3 2784 B9R1.41 NC1CCCC1C(=O)O MCULE-7220342321 [1,1,0,0,0,0|1,0,0]=3 2785 B9R1.41 NC1CCNC1C(=O)O MCULE-3789976956 [1,1,0,0,0,0|0,0,0]=2 2786 B9R1.41 NC1CCNC1C(=O)O MCULE-5356536056 [1,1,0,0,0,0|0,0,0]=2 2787 B9R1.41 NC1CNCC1C(=O)O MCULE-1244086282 [1,1,0,0,0,0|2,0,0]=4 2788 B9R1.41 NC1COCC1C(=O)O MCULE-7325840275 [1,1,0,0,0,0|2,0,0]=4 2789 B9R1.41 NC1COCC1C(=O)O MCULE-9068897815 [1,1,0,0,0,0|2,0,0]=4 2790 B9R1.41 NN1CCCC1C(=O)O MCULE-1374834183 [1,1,0,0,0,0|0,0,0]=2 2791 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-3446631182 [1,1,0,0,0,0|1,0,0]=3 2792 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-4537266002 [1,1,0,0,0,0|1,0,0]=3 2793 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-9091292908 [1,1,0,0,0,0|1,0,0]=3 2794 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-9780104108 [1,1,0,0,0,0|1,0,0]=3 2795 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-1397305924 [1,1,0,0,0,0|1,0,0]=3 2796 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-5447983159 [1,1,0,0,0,0|1,0,0]=3 2797 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-6345808896 [1,1,0,0,0,0|1,0,0]=3 2798 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-7658809060 [1,1,0,0,0,0|1,0,0]=3 2799 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-1080605796 [1,1,0,0,0,0|0,0,0]=2 2800 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-5666272526 [1,1,0,0,0,0|0,0,0]=2 2801 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-5723263979 [1,1,0,0,0,0|0,0,0]=2 2802 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-6574312344 [1,1,0,0,0,0|0,0,0]=2 2803 B9R1.41 N[C@@H]1COC[C@@H]1C(=O)O MCULE-9833243208 [1,1,0,0,0,0|2,0,0]=4 2804 B9R1.41 N[C@@H]1COC[C@H]1C(=O)O MCULE-7323429960 [1,1,0,0,0,0|2,0,0]=4 2805 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-5128495564 [1,1,0,0,0,0|1,0,0]=3 2806 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-7721875754 [1,1,0,0,0,0|1,0,0]=3 2807 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-8287396944 [1,1,0,0,0,0|1,0,0]=3 2808 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9470915806 [1,1,0,0,0,0|1,0,0]=3 2809 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9776724097 [1,1,0,0,0,0|1,0,0]=3 2810 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9997148303 [1,1,0,0,0,0|1,0,0]=3 2811 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-1768949677 [1,1,0,0,0,0|1,0,0]=3 2812 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-2999200875 [1,1,0,0,0,0|1,0,0]=3 2813 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-4735278058 [1,1,0,0,0,0|1,0,0]=3 2814 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-7501259126 [1,1,0,0,0,0|1,0,0]=3 2815 B9R1.41 N[C@H]1COC[C@@H]1C(=O)O MCULE-4396526735 [1,1,0,0,0,0|2,0,0]=4 2816 B9R1.41 N[C@H]1COC[C@@H]1C(=O)O MCULE-9025415433 [1,1,0,0,0,0|2,0,0]=4 2817 B9R1.41 N[C@H]1COC[C@H]1C(=O)O MCULE-2956846972 [1,1,0,0,0,0|2,0,0]=4 2818 B9R1.41 N[C@H]1COC[C@H]1C(=O)O MCULE-3321988270 [1,1,0,0,0,0|2,0,0]=4 2819 B9R1.41 O=C(Cl)C1CCCC1=O MCULE-1186628152 [1,1,0,0,0,0|2,0,0]=4 2820 B9R1.41 O=C(O)C1=C(CCC1)Cl MCULE-4349801654 [1,1,0,0,0,0|1,0,1]=4 2821 B9R1.41 O=C(O)C1CCCC1=O MCULE-9500236289 [1,1,0,0,0,0|1,0,0]=3 2822 B9R1.41 O=C(O)C1CCCC1O MCULE-5519958446 [1,1,0,0,0,0|1,0,0]=3 2823 B9R1.41 O=C(O)C1CCNC1=O MCULE-3110303122 [1,1,0,0,0,0|2,0,0]=4 2824 B9R1.41 O=C(O)C1CCOC1=O MCULE-1545162383 [1,1,0,0,0,0|2,0,0]=4 2825 B9R1.41 O=C(O)C1CNCC1O MCULE-4948062518 [1,1,0,0,0,0|2,0,0]=4 2826 B9R1.41 O=C(O)C1CNCC1O MCULE-8113161890 [1,1,0,0,0,0|2,0,0]=4 2827 B9R1.41 O=C(O)C1COCC1F MCULE-8830875984 [1,1,0,0,0,0|2,0,0]=4 2828 B9R1.41 O=C(O)C1CSCC1=O MCULE-2401489071 [1,1,0,0,0,0|2,0,0]=4 2829 B9R1.41 O=C(O)C1NCCC1F MCULE-2108063646 [1,1,0,0,0,0|0,0,0]=2 2830 B9R1.41 O=C(O)C1NCCC1F MCULE-6901343291 [1,1,0,0,0,0|0,0,0]=2 2831 B9R1.41 O=C(O)C1NCCC1O MCULE-3415911467 [1,1,0,0,0,0|0,0,0]=2 2832 B9R1.41 O=C(O)C1NCCC1O MCULE-3678949962 [1,1,0,0,0,0|0,0,0]=2 2833 B9R1.41 O=C(O)C1NCCC1O MCULE-6594922763 [1,1,0,0,0,0|0,0,0]=2 2834 B9R1.41 O=C(O)[C@@H]1CCNC1=O MCULE-2092808645 [1,1,0,0,0,0|2,0,0]=4 2835 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F MCULE-3174474393 [1,1,0,0,0,0|0,0,0]=2 2836 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F MCULE-5151888407 [1,1,0,0,0,0|0,0,0]=2 2837 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-1216340314 [1,1,0,0,0,0|0,0,0]=2 2838 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-1564327038 [1,1,0,0,0,0|0,0,0]=2 2839 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-8208546333 [1,1,0,0,0,0|0,0,0]=2 2840 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-9489383113 [1,1,0,0,0,0|0,0,0]=2 2841 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-9999937302 [1,1,0,0,0,0|0,0,0]=2 2842 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F MCULE-7001095632 [1,1,0,0,0,0|0,0,0]=2 2843 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F MCULE-7931619369 [1,1,0,0,0,0|0,0,0]=2 2844 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-1637514285 [1,1,0,0,0,0|0,0,0]=2 2845 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-7041138309 [1,1,0,0,0,0|0,0,0]=2 2846 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-9174140225 [1,1,0,0,0,0|0,0,0]=2 2847 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-9867563873 [1,1,0,0,0,0|0,0,0]=2 2848 B9R1.41 O=C(O)[C@@H]1[NH2+]CC[C@@H]1O MCULE-4350473030 [1,1,0,0,0,0|0,0,1]=3 2849 B9R1.41 O=C(O)[C@H]1CCC[C@H]1O MCULE-7220456005 [1,1,0,0,0,0|1,0,0]=3 2850 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-1175817797 [1,1,0,0,0,0|0,0,0]=2 2851 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-5823079222 [1,1,0,0,0,0|0,0,0]=2 2852 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-6437141041 [1,1,0,0,0,0|0,0,0]=2 2853 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-8496599400 [1,1,0,0,0,0|0,0,0]=2 2854 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O MCULE-1891620706 [1,1,0,0,0,0|0,0,0]=2 2855 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O MCULE-2757873569 [1,1,0,0,0,0|0,0,0]=2 2856 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O MCULE-2760733859 [1,1,0,0,0,0|0,0,0]=2 2857 B9R1.41 O=C(O)[C@H]1NCC[C@H]1F MCULE-8117073613 [1,1,0,0,0,0|0,0,0]=2 2858 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-2253713572 [1,1,0,0,0,0|0,0,0]=2 2859 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-4523708371 [1,1,0,0,0,0|0,0,0]=2 2860 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-6240521801 [1,1,0,0,0,0|0,0,0]=2 2861 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-6709232399 [1,1,0,0,0,0|0,0,0]=2 2862 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-6746975985 [1,1,0,0,0,0|0,0,0]=2 2863 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-8268334758 [1,1,0,0,0,0|0,0,0]=2 2864 B9R1.41 [C@@H]1(CCN[C@H]1C(=O)O)O MCULE-2060265421 [1,1,0,0,0,0|0,0,0]=2 2865 B9R1.41 [C@@H]1(NCC[C@H]1O)C(=O)O MCULE-1208236317 [1,1,0,0,0,0|0,0,0]=2 2866 B9R1.41 [C@H]1(CCN[C@H]1C(=O)O)O MCULE-3906438921 [1,1,0,0,0,0|0,0,0]=2 2867 B9R1.163 CC(=O)C1(CCCC1)C MCULE-7946764519 [1,1,0,0,0,0|2,0,0]=4 2868 B9R1.163 CC(=O)C1(CCCC1)N MCULE-1766488888 [1,1,0,0,0,0|2,0,0]=4 2869 B9R1.163 CC(=O)C1(CCCC1)N MCULE-2390313394 [1,1,0,0,0,0|2,0,0]=4 2870 B9R1.163 CC(=O)C1(CCCC1)O MCULE-4607553416 [1,1,0,0,0,0|2,0,0]=4 2871 B9R1.163 CC(=O)C1(CCCO1)C MCULE-3832225855 [1,1,0,0,0,0|2,0,0]=4 2872 B9R1.163 CC1(C=CCC1)C(=O)O MCULE-5900825388 [1,1,0,0,0,0|1,0,1]=4 2873 B9R1.163 CC1(CCCC1)C(=O)Cl MCULE-6905026517 [1,1,0,0,0,0|2,0,0]=4 2874 B9R1.163 CC1(CCCC1)C(=O)O MCULE-8150530718 [1,1,0,0,0,0|1,0,0]=3 2875 B9R1.163 CC1(CCCN1)C(=O)N MCULE-1073156492 [1,1,0,0,0,0|1,0,0]=3 2876 B9R1.163 CC1(CCCN1)C(=O)N MCULE-4207908355 [1,1,0,0,0,0|1,0,0]=3 2877 B9R1.163 CC1(CCCN1)C(=O)N MCULE-5102556329 [1,1,0,0,0,0|1,0,0]=3 2878 B9R1.163 CC1(CCCN1)C(=O)O MCULE-2669113714 [1,1,0,0,0,0|0,0,0]=2 2879 B9R1.163 CC1(CCCN1)C(=O)O MCULE-3184723558 [1,1,0,0,0,0|0,0,0]=2 2880 B9R1.163 CC1(CCCN1)C(=O)O MCULE-5494365974 [1,1,0,0,0,0|0,0,0]=2 2881 B9R1.163 CC1(CCCN1)C(=O)O MCULE-9532642299 [1,1,0,0,0,0|0,0,0]=2 2882 B9R1.163 CC1(CCCN1)C(=O)O MCULE-9805069526 [1,1,0,0,0,0|0,0,0]=2 2883 B9R1.163 CC1(CCCO1)C(=O)O MCULE-9576233735 [1,1,0,0,0,0|1,0,0]=3 2884 B9R1.163 CC1(CCCS1)C(=O)O MCULE-3409370715 [1,1,0,0,0,0|1,0,0]=3 2885 B9R1.163 CC1(CCNC1)C(=O)O MCULE-2715430873 [1,1,0,0,0,0|2,0,0]=4 2886 B9R1.163 CC1(CCNC1)C(=O)O MCULE-4084355022 [1,1,0,0,0,0|2,0,0]=4 2887 B9R1.163 CC1(CCOC1)C(=O)O MCULE-6893882009 [1,1,0,0,0,0|2,0,0]=4 2888 B9R1.163 CC1(NCCS1)C(=O)O MCULE-3303237869 [1,1,0,0,0,0|1,0,0]=3 2889 B9R1.163 CC1(OCCO1)C(=O)O MCULE-6576803543 [1,1,0,0,0,0|2,0,0]=4 2890 B9R1.163 C[C@@]1(CCCN1)C(=O)O MCULE-2607591453 [1,1,0,0,0,0|0,0,0]=2 2891 B9R1.163 C[C@@]1(CCCN1)C(=O)O MCULE-6141960789 [1,1,0,0,0,0|0,0,0]=2 2892 B9R1.163 C[C@@]1(CCCN1)C(=O)O MCULE-7011144386 [1,1,0,0,0,0|0,0,0]=2 2893 B9R1.163 C[C@@]1(CCCN1)C(=O)O MCULE-8922118927 [1,1,0,0,0,0|0,0,0]=2 2894 B9R1.163 C[C@@]1(CCCO1)C(=O)O MCULE-5169117592 [1,1,0,0,0,0|1,0,0]=3 2895 B9R1.163 C[C@@]1(CCNC1)C(=O)O MCULE-3070355045 [1,1,0,0,0,0|2,0,0]=4 2896 B9R1.163 C[C@@]1(CCNC1)C(=O)O MCULE-3719506215 [1,1,0,0,0,0|2,0,0]=4 2897 B9R1.163 C[C@@]1(CCOC1)C(=O)O MCULE-5585882923 [1,1,0,0,0,0|2,0,0]=4 2898 B9R1.163 C[C@]1(CCCN1)C(=O)N MCULE-4783754920 [1,1,0,0,0,0|1,0,0]=3 2899 B9R1.163 C[C@]1(CCCN1)C(=O)N MCULE-7441682522 [1,1,0,0,0,0|1,0,0]=3 2900 B9R1.163 C[C@]1(CCCN1)C(=O)N MCULE-8011663424 [1,1,0,0,0,0|1,0,0]=3 2901 B9R1.163 C[C@]1(CCCN1)C(=O)O MCULE-6724020872 [1,1,0,0,0,0|0,0,0]=2 2902 B9R1.163 C[C@]1(CCCN1)C(=O)O MCULE-7675502884 [1,1,0,0,0,0|0,0,0]=2 2903 B9R1.163 C[C@]1(CCCN1)C(=O)O MCULE-8343149548 [1,1,0,0,0,0|0,0,0]=2 2904 B9R1.163 C[C@]1(CCCN1)C(=O)O MCULE-9260269719 [1,1,0,0,0,0|0,0,0]=2 2905 B9R1.163 C[C@]1(CCCO1)C(=O)O MCULE-3910400790 [1,1,0,0,0,0|1,0,0]=3 2906 B9R1.163 C[C@]1(CCNC1)C(=O)O MCULE-1423230640 [1,1,0,0,0,0|2,0,0]=4 2907 B9R1.163 C[C@]1(CCNC1)C(=O)O MCULE-7327407576 [1,1,0,0,0,0|2,0,0]=4 2908 B9R1.163 NC(=O)C1(CCCC1)N MCULE-1603183997 [1,1,0,0,0,0|2,0,0]=4 2909 B9R1.163 NC(=O)C1(CCCC1)N MCULE-6535833155 [1,1,0,0,0,0|2,0,0]=4 2910 B9R1.163 NC(=O)C1(CCCC1)O MCULE-7750018506 [1,1,0,0,0,0|2,0,0]=4 2911 B9R1.163 NC1(CCCC1)C(=O)O MCULE-6366286422 [1,1,0,0,0,0|1,0,0]=3 2912 B9R1.163 NC1(CCNC1)C(=O)O MCULE-1061035749 [1,1,0,0,0,0|2,0,0]=4 2913 B9R1.163 NC1(CCOC1)C(=O)O MCULE-1020331216 [1,1,0,0,0,0|2,0,0]=4 2914 B9R1.163 NC1(CCOC1)C(=O)O MCULE-3239849151 [1,1,0,0,0,0|2,0,0]=4 2915 B9R1.163 NC1(CCOC1)C(=O)O MCULE-7635316557 [1,1,0,0,0,0|2,0,0]=4 2916 B9R1.163 NC1(CCSC1)C(=O)O MCULE-2866413498 [1,1,0,0,0,0|2,0,0]=4 2917 B9R1.163 NC1(CCSC1)C(=O)O MCULE-3077570702 [1,1,0,0,0,0|2,0,0]=4 2918 B9R1.163 N[C@@]1(CCOC1)C(=O)O MCULE-4940789798 [1,1,0,0,0,0|2,0,0]=4 2919 B9R1.163 N[C@@]1(CCOC1)C(=O)O MCULE-9120207414 [1,1,0,0,0,0|2,0,0]=4 2920 B9R1.163 N[C@@]1(CCSC1)C(=O)O MCULE-3449072625 [1,1,0,0,0,0|2,0,0]=4 2921 B9R1.163 N[C@@]1(CCSC1)C(=O)O MCULE-6533506498 [1,1,0,0,0,0|2,0,0]=4 2922 B9R1.163 N[C@]1(CCNC1)C(=O)O MCULE-5112163951 [1,1,0,0,0,0|2,0,0]=4 2923 B9R1.163 N[C@]1(CCNC1)C(=O)O MCULE-7065442028 [1,1,0,0,0,0|2,0,0]=4 2924 B9R1.163 N[C@]1(CCOC1)C(=O)O MCULE-6757422211 [1,1,0,0,0,0|2,0,0]=4 2925 B9R1.163 N[C@]1(CCOC1)C(=O)O MCULE-8786481856 [1,1,0,0,0,0|2,0,0]=4 2926 B9R1.163 N[C@]1(CCSC1)C(=O)O MCULE-1832449395 [1,1,0,0,0,0|2,0,0]=4 2927 B9R1.163 N[C@]1(CCSC1)C(=O)O MCULE-1974139646 [1,1,0,0,0,0|2,0,0]=4 2928 B9R1.163 O=C(O)C1(CCCC1)Br MCULE-3131005284 [1,1,0,0,0,0|1,0,0]=3 2929 B9R1.163 O=C(O)C1(CCCC1)F MCULE-4282263280 [1,1,0,0,0,0|1,0,0]=3 2930 B9R1.163 O=C(O)C1(CCCC1)O MCULE-2147028492 [1,1,0,0,0,0|1,0,0]=3 2931 B9R1.163 O=C(O)C1(CCNC1)F MCULE-3943818123 [1,1,0,0,0,0|2,0,0]=4 2932 B9R1.163 O=C(O)C1(CCNC1)F MCULE-9385624346 [1,1,0,0,0,0|2,0,0]=4 2933 B9R1.163 O=C(O)C1(CCNC1)O MCULE-5890399768 [1,1,0,0,0,0|2,0,0]=4 2934 B9R1.163 O=C(O)C1(CCNC1)O MCULE-5910869185 [1,1,0,0,0,0|2,0,0]=4 2935 B9R1.163 O=C(O)C1(CCOC1)F MCULE-5718551369 [1,1,0,0,0,0|2,0,0]=4 2936 B9R1.163 O=C(O)C1(CCOC1)O MCULE-8834969992 [1,1,0,0,0,0|2,0,0]=4 2937 B9R1.163 O=C(O)C1(CCSC1)O MCULE-7477879136 [1,1,0,0,0,0|2,0,0]=4 2938 B9R1.163 O=C(O)[C@@]1(CCNC1)F MCULE-8296048165 [1,1,0,0,0,0|2,0,0]=4 2939 B9R1.51 CS(=O)(=O)[C@H]1C[C@H](C1)O MCULE-2287818132 [0,1,0,0,1,0|1,0,1]=4 2940 B9R1.82 C=C1CC(C1)C(=O)OC MCULE-8011797750 [0,1,0,0,1,0|1,0,1]=4 2941 B9R1.82 CNC(=O)C1CC(C1)O MCULE-1529186751 [0,1,0,0,1,0|1,0,0]=3 2942 B9R1.82 CNC(=O)[C@H]1C[C@@H](C1)N MCULE-3215603880 [0,1,0,0,1,0|2,0,0]=4 2943 B9R1.82 CNC(=O)[C@H]1C[C@@H](C1)N MCULE-3341472859 [0,1,0,0,1,0|2,0,0]=4 2944 B9R1.82 CNC(=O)[C@H]1C[C@H](C1)N MCULE-3774449818 [0,1,0,0,1,0|2,0,0]=4 2945 B9R1.82 CNC(=O)[C@H]1C[C@H](C1)N MCULE-8074211920 [0,1,0,0,1,0|2,0,0]=4 2946 B9R1.82 CNC(=O)[C@H]1C[C@H](C1)O MCULE-8028192648 [0,1,0,0,1,0|1,0,0]=3 2947 B9R1.82 COC(=O)C1CC(=O)C1 MCULE-8671943269 [0,1,0,0,1,0|0,0,2]=4 2948 B9R1.82 COC(=O)C1CC(C1)Br MCULE-6919888743 [0,1,0,0,1,0|1,0,0]=3 2949 B9R1.82 COC(=O)C1CC(C1)C MCULE-6294133796 [0,1,0,0,1,0|1,0,0]=3 2950 B9R1.82 COC(=O)C1CC(C1)Cl MCULE-6335137966 [0,1,0,0,1,0|1,0,0]=3 2951 B9R1.82 COC(=O)C1CC(C1)F MCULE-7350931097 [0,1,0,0,1,0|1,0,0]=3 2952 B9R1.82 COC(=O)C1CC(C1)I MCULE-7700167011 [0,1,0,0,1,0|1,0,0]=3 2953 B9R1.82 COC(=O)C1CC(C1)N MCULE-6848727495 [0,1,0,0,1,0|1,0,0]=3 2954 B9R1.82 COC(=O)C1CC(C1)N MCULE-7901580981 [0,1,0,0,1,0|1,0,0]=3 2955 B9R1.82 COC(=O)C1CC(C1)O MCULE-3261368737 [0,1,0,0,1,0|0,0,0]=2 2956 B9R1.82 COC(=O)N1CC(C1)N MCULE-3368044261 [0,1,0,0,1,0|2,0,0]=4 2957 B9R1.82 COC(=O)N1CC(C1)N MCULE-7551675210 [0,1,0,0,1,0|2,0,0]=4 2958 B9R1.82 COC(=O)N1CC(C1)O MCULE-1842609121 [0,1,0,0,1,0|1,0,0]=3 2959 B9R1.82 COC(=O)[C@H]1C[C@@H](C1)Br MCULE-9276010203 [0,1,0,0,1,0|1,0,0]=3 2960 B9R1.82 COC(=O)[C@H]1C[C@@H](C1)N MCULE-7126562831 [0,1,0,0,1,0|1,0,0]=3 2961 B9R1.82 COC(=O)[C@H]1C[C@@H](C1)N MCULE-9087679760 [0,1,0,0,1,0|1,0,0]=3 2962 B9R1.82 COC(=O)[C@H]1C[C@@H](C1)O MCULE-8119011760 [0,1,0,0,1,0|0,0,0]=2 2963 B9R1.82 COC(=O)[C@H]1C[C@H](C1)N MCULE-1208738380 [0,1,0,0,1,0|1,0,0]=3 2964 B9R1.82 COC(=O)[C@H]1C[C@H](C1)N MCULE-4735817474 [0,1,0,0,1,0|1,0,0]=3 2965 B9R1.82 COC(=O)[C@H]1C[C@H](C1)O MCULE-5931352731 [0,1,0,0,1,0|0,0,0]=2 2966 B9R1.82 N/C(=N\O)/C1CC(C1)O MCULE-5026357649 [0,1,0,0,1,0|1,0,0]=3 2967 B9R1.82 O=C(CCl)N1CC(C1)O MCULE-3044662085 [0,1,0,0,1,0|2,0,0]=4 2968 B9R1.95 C#C[C@H]1C[C@H](C1)C(=O)C MCULE-2118662994 [0,1,0,0,1,0|2,0,0]=4 2969 B9R1.95 CC(=O)N1CC(C1)CO MCULE-9848922086 [0,1,0,0,1,0|2,0,0]=4 2970 B9R1.95 CCC1CC(C1)C(=O)O MCULE-4399154195 [0,1,0,0,1,0|1,0,0]=3 2971 B9R1.95 CCC1CC(C1)C(=O)O MCULE-6408590394 [0,1,0,0,1,0|1,0,0]=3 2972 B9R1.95 CCN1CC(C1)C(=O)O MCULE-3132525132 [0,1,0,0,1,0|2,0,0]=4 2973 B9R1.95 CNC1CC(C1)C(=O)O MCULE-1477649750 [0,1,0,0,1,0|1,0,0]=3 2974 B9R1.95 CNC1CC(C1)C(=O)O MCULE-2034598338 [0,1,0,0,1,0|1,0,0]=3 2975 B9R1.95 COC1CC(C1)C(=O)C MCULE-5091337590 [0,1,0,0,1,0|1,0,0]=3 2976 B9R1.95 COC1CC(C1)C(=O)O MCULE-8232247707 [0,1,0,0,1,0|0,0,0]=2 2977 B9R1.95 COC1CN(C1)C(=O)Cl MCULE-4154655930 [0,1,0,0,1,0|2,0,0]=4 2978 B9R1.95 CO[C@H]1C[C@@H](C1)C(=O)O MCULE-4399635730 [0,1,0,0,1,0|0,0,0]=2 2979 B9R1.95 CO[C@H]1C[C@H](C1)C(=O)O MCULE-1315313306 [0,1,0,0,1,0|0,0,0]=2 2980 B9R1.95 N#CC1CC(C1)C(=O)O MCULE-9043105457 [0,1,0,0,1,0|1,0,0]=3 2981 B9R1.95 NCC1CC(C1)C(=O)O MCULE-5139246766 [0,1,0,0,1,0|1,0,0]=3 2982 B9R1.95 NCC1CC(C1)C(=O)O MCULE-9472863522 [0,1,0,0,1,0|1,0,0]=3 2983 B9R1.95 NC[C@H]1C[C@H](C1)C(=O)O MCULE-5593414975 [0,1,0,0,1,0|1,0,0]=3 2984 B9R1.95 NC[C@H]1C[C@H](C1)C(=O)O MCULE-9152509638 [0,1,0,0,1,0|1,0,0]=3 2985 B9R1.95 O=C(O)C1CC(C1)CBr MCULE-6774883657 [0,1,0,0,1,0|1,0,0]=3 2986 B9R1.95 O=C(O)C1CC(C1)CF MCULE-2946863798 [0,1,0,0,1,0|1,0,0]=3 2987 B9R1.95 O=C(O)C1CC(C1)CO MCULE-8568823768 [0,1,0,0,1,0|0,0,0]=2 2988 B9R1.95 O=C(O)[C@H]1C[C@@H](C1)CO MCULE-5347571520 [0,1,0,0,1,0|0,0,0]=2 2989 B9R1.95 O=C(O)[C@H]1C[C@H](C1)CO MCULE-6623890968 [0,1,0,0,1,0|0,0,0]=2 2990 B9R1.95 O=C([O-])[C@H]1C[C@@H](C1)CO MCULE-8717273234 [0,1,0,0,1,0|0,0,1]=3 2991 B9R1.152 C=C1CC(C1)(C)C(=O)O MCULE-7205894158 [0,1,0,0,1,0|1,0,1]=4 2992 B9R1.152 C=C1CC(C1)(O)C(=O)O MCULE-9531189314 [0,1,0,0,1,0|1,0,1]=4 2993 B9R1.152 CC1(CC(=O)C1)C(=O)O MCULE-5766836727 [0,1,0,0,1,0|0,0,2]=4 2994 B9R1.152 CC1(CC(C1)N)C(=O)O MCULE-2576475336 [0,1,0,0,1,0|1,0,0]=3 2995 B9R1.152 CC1(CC(C1)N)C(=O)O MCULE-6535558159 [0,1,0,0,1,0|1,0,0]=3 2996 B9R1.152 CC1CC(C1)(C)C(=O)O MCULE-6119301322 [0,1,0,0,1,0|1,0,0]=3 2997 B9R1.152 CN1CC(C1)(C)C(=O)O MCULE-4633405499 [0,1,0,0,1,0|2,0,0]=4 2998 B9R1.152 C[C@@]1(C[C@@H](C1)N)C(=O)O MCULE-4599601598 [0,1,0,0,1,0|1,0,0]=3 2999 B9R1.152 C[C@@]1(C[C@@H](C1)N)C(=O)O MCULE-4763611062 [0,1,0,0,1,0|1,0,0]=3 3000 B9R1.152 C[C@@]1(C[C@H](C1)N)C(=O)O MCULE-2054460365 [0,1,0,0,1,0|1,0,0]=3 3001 B9R1.152 C[C@@]1(C[C@H](C1)N)C(=O)O MCULE-8615255294 [0,1,0,0,1,0|1,0,0]=3 3002 B9R1.152 C[C@H]1C[C@@](C1)(N)C(=O)O MCULE-7807418833 [0,1,0,0,1,0|1,0,0]=3 3003 B9R1.152 C[C@H]1C[C@](C1)(N)C(=O)O MCULE-2634950955 [0,1,0,0,1,0|1,0,0]=3 3004 B9R1.152 NC1(CC(C1)F)C(=O)O MCULE-5206815009 [0,1,0,0,1,0|1,0,0]=3 3005 B9R1.152 NC1(CC(C1)F)C(=O)O MCULE-9944960595 [0,1,0,0,1,0|1,0,0]=3 3006 B9R1.152 NC1(CC(C1)O)C(=O)O MCULE-8304595021 [0,1,0,0,1,0|0,0,0]=2 3007 B9R1.152 NC1(CC(C1)O)C(=O)O MCULE-8353432396 [0,1,0,0,1,0|0,0,0]=2 3008 B9R1.152 NC1CC(C1)(F)C(=O)O MCULE-8174066741 [0,1,0,0,1,0|1,0,0]=3 3009 B9R1.152 N[C@@]1(C[C@@H](C1)F)C(=O)O MCULE-3535102578 [0,1,0,0,1,0|1,0,0]=3 3010 B9R1.152 N[C@@]1(C[C@@H](C1)O)C(=O)O MCULE-3919423791 [0,1,0,0,1,0|0,0,0]=2 3011 B9R1.152 N[C@@]1(C[C@H](C1)F)C(=O)O MCULE-4417403698 [0,1,0,0,1,0|1,0,0]=3 3012 B9R1.152 O=C(O)C1(CC(C1)O)O MCULE-4321795643 [0,1,0,0,1,0|0,0,0]=2 3013 B9R1.152 O=C(O)[C@@]1(C[C@@H](C1)O)F MCULE-1599041261 [0,1,0,0,1,0|0,0,0]=2 3014 B9R1.152 O=C(O)[C@@]1(C[C@@H](C1)O)O MCULE-3005775021 [0,1,0,0,1,0|0,0,0]=2 3015 B9R1.152 O=C(O)[C@@]1(C[C@H](C1)O)F MCULE-8929901678 [0,1,0,0,1,0|0,0,0]=2 3016 B9R1.152 O=C(O)[C@@]1(C[C@H](C1)O)O MCULE-2152193030 [0,1,0,0,1,0|0,0,0]=2 3017 B9R1.164 CC(=O)C1CC(C1)(F)F MCULE-1677593135 [0,1,0,0,1,0|2,0,0]=4 3018 B9R1.164 CC1(CC(C1)C(=O)Cl)C MCULE-8399715648 [0,1,0,0,1,0|2,0,0]=4 3019 B9R1.164 CC1(CC(C1)C(=O)N)C MCULE-1074701777 [0,1,0,0,1,0|2,0,0]=4 3020 B9R1.164 CC1(CC(C1)C(=O)O)C MCULE-2113829273 [0,1,0,0,1,0|1,0,0]=3 3021 B9R1.164 CC1(CC(C1)C(=O)O)F MCULE-6709976888 [0,1,0,0,1,0|1,0,0]=3 3022 B9R1.164 CC1(CC(C1)C(=O)O)O MCULE-2222519984 [0,1,0,0,1,0|0,0,0]=2 3023 B9R1.164 C[C@@]1(C[C@@H](C1)C(=O)O)F MCULE-5383135274 [0,1,0,0,1,0|1,0,0]=3 3024 B9R1.164 C[C@@]1(C[C@@H](C1)C(=O)O)O MCULE-4467958139 [0,1,0,0,1,0|0,0,0]=2 3025 B9R1.164 C[C@@]1(C[C@@H](C1)C(=O)[O-])O MCULE-4335271280 [0,1,0,0,1,0|0,0,1]=3 3026 B9R1.164 C[C@@]1(C[C@H](C1)C(=O)O)F MCULE-3132782538 [0,1,0,0,1,0|1,0,0]=3 3027 B9R1.164 C[C@@]1(C[C@H](C1)C(=O)O)O MCULE-3757447768 [0,1,0,0,1,0|0,0,0]=2 3028 B9R1.164 NC(=O)C1CC(C1)(F)F MCULE-8721897161 [0,1,0,0,1,0|2,0,0]=4 3029 B9R1.164 O=C(Cl)C1CC(C1)(F)F MCULE-4507574894 [0,1,0,0,1,0|2,0,0]=4 3030 B9R1.164 O=C(O)C1CC(C1)(F)F MCULE-2201483659 [0,1,0,0,1,0|1,0,0]=3 3031 B9R1.164 O=C(O)C1CS(=O)(=O)C1 MCULE-7280424141 [0,1,0,0,1,0|1,0,1]=4 3032 B9R1.52 CC1CN(C1C(=O)O)C MCULE-8572324743 [0,1,0,0,1,0|1,0,0]=3 3033 B9R1.52 CC1CN([C@@H]1C(=O)O)C MCULE-1157987768 [0,1,0,0,1,0|1,0,0]=3 3034 B9R1.52 CC1CN([C@@H]1C(=O)O)C MCULE-2203210701 [0,1,0,0,1,0|1,0,0]=3 3035 B9R1.52 C[C@@H]1CN([C@@H]1C(=O)O)C MCULE-7173137112 [0,1,0,0,1,0|1,0,0]=3 3036 B9R1.81 COC(=O)C1CCC1N MCULE-4693145444 [0,1,0,0,1,0|2,0,0]=4 3037 B9R1.81 COC(=O)C1CCC1N MCULE-6349653007 [0,1,0,0,1,0|2,0,0]=4 3038 B9R1.81 COC(=O)C1CCC1N MCULE-9208418191 [0,1,0,0,1,0|2,0,0]=4 3039 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N MCULE-3799679764 [0,1,0,0,1,0|2,0,0]=4 3040 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N MCULE-3866135678 [0,1,0,0,1,0|2,0,0]=4 3041 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N MCULE-5783135311 [0,1,0,0,1,0|2,0,0]=4 3042 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N MCULE-7358443789 [0,1,0,0,1,0|2,0,0]=4 3043 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N MCULE-7787337160 [0,1,0,0,1,0|2,0,0]=4 3044 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N MCULE-9352998200 [0,1,0,0,1,0|2,0,0]=4 3045 B9R1.81 COC(=O)[C@@H]1CC[C@H]1N MCULE-5985438267 [0,1,0,0,1,0|2,0,0]=4 3046 B9R1.81 COC(=O)[C@@H]1CC[C@H]1N MCULE-6739441737 [0,1,0,0,1,0|2,0,0]=4 3047 B9R1.81 COC(=O)[C@@H]1CC[C@H]1N MCULE-8406342632 [0,1,0,0,1,0|2,0,0]=4 3048 B9R1.81 COC(=O)[C@@H]1CC[C@H]1N MCULE-8945046053 [0,1,0,0,1,0|2,0,0]=4 3049 B9R1.81 COC(=O)[C@H]1CC[C@H]1N MCULE-7383295864 [0,1,0,0,1,0|2,0,0]=4 3050 B9R1.96 C1(NCC1CC)C(=O)O MCULE-9517338987 [0,1,0,0,1,0|1,0,0]=3 3051 B9R1.96 CCC1CNC1C(=O)O MCULE-5561702986 [0,1,0,0,1,0|1,0,0]=3 3052 B9R1.96 CCC1CN[C@@H]1C(=O)O MCULE-1585063492 [0,1,0,0,1,0|1,0,0]=3 3053 B9R1.96 CCC1CN[C@@H]1C(=O)O MCULE-7143773936 [0,1,0,0,1,0|1,0,0]=3 3054 B9R1.96 N#CC1CCC1C(=O)O MCULE-1939970378 [0,1,0,0,1,0|2,0,0]=4 3055 B9R1.96 O=C(O)C1CCC1CO MCULE-9648982851 [0,1,0,0,1,0|1,0,0]=3 3056 B9R1.96 O=C([O-])C1CCC1CO MCULE-8666321081 [0,1,0,0,1,0|1,0,1]=4 3057 B9R1.166 C1(NCC1(C)C)C(=O)O MCULE-8091738282 [0,1,0,0,1,0|1,0,0]=3 3058 B9R1.166 CC1(CCC1C(=O)O)C MCULE-4099946993 [0,1,0,0,1,0|2,0,0]=4 3059 B9R1.166 CC1(CNC1C(=O)O)C MCULE-8386082188 [0,1,0,0,1,0|1,0,0]=3 3060 B9R1.166 CC1(CNC1C(=O)O)C MCULE-9067770862 [0,1,0,0,1,0|1,0,0]=3 3061 B9R1.166 CC1(CN[C@@H]1C(=O)O)C MCULE-3707363843 [0,1,0,0,1,0|1,0,0]=3 3062 B9R1.166 CC1(CN[C@@H]1C(=O)O)C MCULE-5671349948 [0,1,0,0,1,0|1,0,0]=3 3063 B9R1.166 CC1(CN[C@H]1C(=O)O)C MCULE-3480839319 [0,1,0,0,1,0|1,0,0]=3 3064 B9R1.166 O=C(O)C1CCC1(F)F MCULE-5646109920 [0,1,0,0,1,0|2,0,0]=4 3065 B9R1.166 O=C(O)[C@@H]1CCC1(F)F MCULE-1777760238 [0,1,0,0,1,0|2,0,0]=4 3066 B9R1.166 O=C(O)[C@H]1CCC1(F)F MCULE-9140397233 [0,1,0,0,1,0|2,0,0]=4 3067 B11R1.3 CCC1CCC(CC1)C(=O)O MCULE-3132418894 [0,1,0,0,0,1|2,0,0]=4 3068 B11R1.3 CC[C@H]1CC[C@@H](CC1)C(=O)O MCULE-6485034715 [0,1,0,0,0,1|2,0,0]=4 3069 B11R1.3 CNC1CCC(CC1)C(=O)O MCULE-4991563635 [0,1,0,0,0,1|2,0,0]=4 3070 B11R1.3 CNC1CCC(CC1)C(=O)O MCULE-7459674895 [0,1,0,0,0,1|2,0,0]=4 3071 B11R1.3 CN[C@H]1CC[C@@H](CC1)C(=O)O MCULE-2685872520 [0,1,0,0,0,1|2,0,0]=4 3072 B11R1.3 CN[C@H]1CC[C@@H](CC1)C(=O)O MCULE-8829935799 [0,1,0,0,0,1|2,0,0]=4 3073 B11R1.3 CN[C@H]1CC[C@H](CC1)C(=O)O MCULE-6088017598 [0,1,0,0,0,1|2,0,0]=4 3074 B11R1.3 CN[C@H]1CC[C@H](CC1)C(=O)O MCULE-7349966563 [0,1,0,0,0,1|2,0,0]=4 3075 B11R1.3 COC1CC=C(CC1)C(=O)O MCULE-1751731943 [0,1,0,0,0,1|1,0,1]=4 3076 B11R1.3 COC1CCC(CC1)C(=O)Cl MCULE-2869287615 [0,1,0,0,0,1|2,0,0]=4 3077 B11R1.3 COC1CCC(CC1)C(=O)O MCULE-7855539599 [0,1,0,0,0,1|1,0,0]=3 3078 B11R1.3 CON1CCC(CC1)C(=O)O MCULE-3896995710 [0,1,0,0,0,1|2,0,0]=4 3079 B11R1.3 CON1CCC(CC1)C(=O)O MCULE-6764383714 [0,1,0,0,0,1|2,0,0]=4 3080 B11R1.3 CO[C@H]1CC[C@H](CC1)C(=O)O MCULE-8120957519 [0,1,0,0,0,1|1,0,0]=3 3081 B11R1.3 N#CC1CCC(CC1)C(=O)O MCULE-8347063154 [0,1,0,0,0,1|2,0,0]=4 3082 B11R1.3 N#C[C@H]1CC[C@@H](CC1)C(=O)O MCULE-3703985963 [0,1,0,0,0,1|2,0,0]=4 3083 B11R1.3 NCC1CCC(CC1)C(=O)O MCULE-6116475175 [0,1,0,0,0,1|2,0,0]=4 3084 B11R1.3 NC[C@H]1CC[C@@H](CC1)C(=O)O MCULE-6087008336 [0,1,0,0,0,1|2,0,0]=4 3085 B11R1.3 NC[C@H]1CC[C@H](CC1)C(=O)O MCULE-1914632389 [0,1,0,0,0,1|2,0,0]=4 3086 B11R1.3 NC[C@H]1CC[C@H](CC1)C(=O)O MCULE-6012248882 [0,1,0,0,0,1|2,0,0]=4 3087 B11R1.3 O=C(O)C1CCC(CC1)CBr MCULE-1483354720 [0,1,0,0,0,1|2,0,0]=4 3088 B11R1.3 O=C(O)C1CCC(CC1)CO MCULE-2678326595 [0,1,0,0,0,1|1,0,0]=3 3089 B11R1.3 O=C(O)[C@H]1CC[C@@H](CC1)CO MCULE-5678408450 [0,1,0,0,0,1|1,0,0]=3 3090 B11R1.3 O=C(O)[C@H]1CC[C@H](CC1)CO MCULE-8982391334 [0,1,0,0,0,1|1,0,0]=3 3091 B11R1.3 [C@@H]1(CC[C@@H](CC1)C(=O)O)OC MCULE-7032796402 [0,1,0,0,0,1|1,0,0]=3 3092 B11R1.21 CC1CCC(CC1C)C(=O)O MCULE-5819111297 [0,1,0,0,0,1|2,0,0]=4 3093 B11R1.21 CC1CCC(CC1N)C(=O)O MCULE-3503061214 [0,1,0,0,0,1|2,0,0]=4 3094 B11R1.21 CC1SCC(NC1=O)C(=O)O MCULE-5715274470 [0,1,0,0,0,1|1,0,1]=4 3095 B11R1.21 CN1CC(NCC1=O)C(=O)O MCULE-1476207345 [0,1,0,0,0,1|0,0,2]=4 3096 B11R1.21 CN1CC(NCC1=O)C(=O)O MCULE-7602151554 [0,1,0,0,0,1|0,0,2]=4 3097 B11R1.21 N[C@H]1CC[C@H](C[C@@H]1O)C(=O)O MCULE-5165144051 [0,1,0,0,0,1|2,0,0]=4 3098 B11R1.21 N[C@H]1CC[C@H](C[C@@H]1O)C(=O)O MCULE-9735389419 [0,1,0,0,0,1|2,0,0]=4 3099 B11R1.21 N[C@H]1C[C@@H](CC[C@@H]1O)C(=O)O MCULE-8546749927 [0,1,0,0,0,1|1,0,0]=3 3100 B11R1.21 N[C@H]1C[C@@H](CC[C@@H]1O)C(=O)O MCULE-9445334860 [0,1,0,0,0,1|1,0,0]=3 3101 B11R1.22 CNC(=O)[C@H]1CC[C@@H](CC1)O MCULE-1562789029 [0,1,0,0,0,1|2,0,0]=4 3102 B11R1.22 COC(=O)C1CCC(CC1)N MCULE-5482396714 [0,1,0,0,0,1|2,0,0]=4 3103 B11R1.22 COC(=O)C1CCC(CC1)N MCULE-6230504256 [0,1,0,0,0,1|2,0,0]=4 3104 B11R1.22 COC(=O)C1CCC(CC1)O MCULE-2490755485 [0,1,0,0,0,1|1,0,0]=3 3105 B11R1.22 COC(=O)C1CCC(CN1)O MCULE-9174504804 [0,1,0,0,0,1|0,0,0]=2 3106 B11R1.22 COC(=O)C1CCC(NC1)C MCULE-1103691698 [0,1,0,0,0,1|2,0,0]=4 3107 B11R1.22 COC(=O)C1CCC(NC1)C MCULE-4066328394 [0,1,0,0,0,1|2,0,0]=4 3108 B11R1.22 COC(=O)C1CCC(NC1)C MCULE-7905998970 [0,1,0,0,0,1|2,0,0]=4 3109 B11R1.22 COC(=O)C1CNC(=O)CN1 MCULE-1207411341 [0,1,0,0,0,1|0,0,2]=4 3110 B11R1.22 COC(=O)C1CNC(=O)CN1 MCULE-3150881124 [0,1,0,0,0,1|0,0,2]=4 3111 B11R1.22 COC(=O)C1CNC(=O)CN1 MCULE-9361727201 [0,1,0,0,0,1|0,0,2]=4 3112 B11R1.22 COC(=O)C1CNC(CN1)C MCULE-2760554111 [0,1,0,0,0,1|1,0,0]=3 3113 B11R1.22 COC(=O)N1CCC(CC1)O MCULE-6751945083 [0,1,0,0,0,1|2,0,0]=4 3114 B11R1.22 COC(=O)[C@@H]1CC[C@@H](CN1)O MCULE-1608906161 [0,1,0,0,0,1|0,0,0]=2 3115 B11R1.22 COC(=O)[C@@H]1CC[C@@H](CN1)O MCULE-7535687002 [0,1,0,0,0,1|0,0,0]=2 3116 B11R1.22 COC(=O)[C@@H]1CC[C@@H](CN1)O MCULE-7886608473 [0,1,0,0,0,1|0,0,0]=2 3117 B11R1.22 COC(=O)[C@@H]1CC[C@@H](NC1)C MCULE-1999660404 [0,1,0,0,0,1|2,0,0]=4 3118 B11R1.22 COC(=O)[C@@H]1CC[C@@H](NC1)C MCULE-2455994251 [0,1,0,0,0,1|2,0,0]=4 3119 B11R1.22 COC(=O)[C@@H]1CC[C@@H](NC1)C MCULE-2976201730 [0,1,0,0,0,1|2,0,0]=4 3120 B11R1.22 COC(=O)[C@@H]1CC[C@@H](NC1)C MCULE-3782740676 [0,1,0,0,0,1|2,0,0]=4 3121 B11R1.22 COC(=O)[C@@H]1CC[C@@H](NC1)C MCULE-6464990394 [0,1,0,0,0,1|2,0,0]=4 3122 B11R1.22 COC(=O)[C@@H]1CC[C@H](CN1)O MCULE-1537696189 [0,1,0,0,0,1|0,0,0]=2 3123 B11R1.22 COC(=O)[C@@H]1CC[C@H](CN1)O MCULE-3334344307 [0,1,0,0,0,1|0,0,0]=2 3124 B11R1.22 COC(=O)[C@@H]1CC[C@H](NC1)C MCULE-1654286744 [0,1,0,0,0,1|2,0,0]=4 3125 B11R1.22 COC(=O)[C@@H]1CC[C@H](NC1)C MCULE-2389055337 [0,1,0,0,0,1|2,0,0]=4 3126 B11R1.22 COC(=O)[C@@H]1CC[C@H](NC1)C MCULE-3268300078 [0,1,0,0,0,1|2,0,0]=4 3127 B11R1.22 COC(=O)[C@@H]1CC[C@H](NC1)C MCULE-5032774144 [0,1,0,0,0,1|2,0,0]=4 3128 B11R1.22 COC(=O)[C@@H]1CNC(=O)CN1 MCULE-1663377634 [0,1,0,0,0,1|0,0,2]=4 3129 B11R1.22 COC(=O)[C@@H]1CNC(=O)CN1 MCULE-5733180811 [0,1,0,0,0,1|0,0,2]=4 3130 B11R1.22 COC(=O)[C@H]1CC[C@@H](CC1)N MCULE-4855710087 [0,1,0,0,0,1|2,0,0]=4 3131 B11R1.22 COC(=O)[C@H]1CC[C@@H](CC1)N MCULE-9225140469 [0,1,0,0,0,1|2,0,0]=4 3132 B11R1.22 COC(=O)[C@H]1CC[C@@H](CC1)O MCULE-8951158493 [0,1,0,0,0,1|1,0,0]=3 3133 B11R1.22 COC(=O)[C@H]1CC[C@@H](CN1)O MCULE-2977287737 [0,1,0,0,0,1|0,0,0]=2 3134 B11R1.22 COC(=O)[C@H]1CC[C@@H](CN1)O MCULE-3433906854 [0,1,0,0,0,1|0,0,0]=2 3135 B11R1.22 COC(=O)[C@H]1CC[C@@H](NC1)C MCULE-4324818722 [0,1,0,0,0,1|2,0,0]=4 3136 B11R1.22 COC(=O)[C@H]1CC[C@@H](NC1)C MCULE-5137006001 [0,1,0,0,0,1|2,0,0]=4 3137 B11R1.22 COC(=O)[C@H]1CC[C@@H](NC1)C MCULE-9584865102 [0,1,0,0,0,1|2,0,0]=4 3138 B11R1.22 COC(=O)[C@H]1CC[C@H](CC1)N MCULE-3165114207 [0,1,0,0,0,1|2,0,0]=4 3139 B11R1.22 COC(=O)[C@H]1CC[C@H](CC1)N MCULE-7537634861 [0,1,0,0,0,1|2,0,0]=4 3140 B11R1.22 COC(=O)[C@H]1CC[C@H](CC1)O MCULE-4794376608 [0,1,0,0,0,1|1,0,0]=3 3141 B11R1.22 COC(=O)[C@H]1CC[C@H](CN1)O MCULE-4862825259 [0,1,0,0,0,1|0,0,0]=2 3142 B11R1.22 COC(=O)[C@H]1CC[C@H](CN1)O MCULE-8270495818 [0,1,0,0,0,1|0,0,0]=2 3143 B11R1.22 COC(=O)[C@H]1CC[C@H](NC1)C MCULE-1064182684 [0,1,0,0,0,1|2,0,0]=4 3144 B11R1.22 COC(=O)[C@H]1CC[C@H](NC1)C MCULE-5686053466 [0,1,0,0,0,1|2,0,0]=4 3145 B11R1.22 COC(=O)[C@H]1CC[C@H](NC1)C MCULE-7329517559 [0,1,0,0,0,1|2,0,0]=4 3146 B11R1.22 COC(=O)[C@H]1CC[C@H](NC1)C MCULE-7669213048 [0,1,0,0,0,1|2,0,0]=4 3147 B11R1.22 COC(=O)[C@H]1CC[C@H](NC1)C MCULE-8006054967 [0,1,0,0,0,1|2,0,0]=4 3148 B11R1.22 COC(=O)[C@H]1CNC(=O)CN1 MCULE-1475020895 [0,1,0,0,0,1|0,0,2]=4 3149 B11R1.22 [C@H]1(CC[C@H](CN1)C(=O)OC)C MCULE-3786752577 [0,1,0,0,0,1|2,0,0]=4 3150 B11R1.166 CC1CCC(C(C1)C)C(=O)O MCULE-4443353151 [0,1,0,0,0,1|2,0,0]=4 3151 B11R1.166 CC1CNC(C(O1)C)C(=O)O MCULE-8279243440 [0,1,0,0,0,1|1,0,0]=3 3152 B11R1.166 CC1CNC(C(O1)C)C(=O)O MCULE-9957606244 [0,1,0,0,0,1|1,0,0]=3 3153 B11R1.166 C[C@@H]1C[C@@H](CC[C@@H]1C(=O)O)N MCULE-1369859957 [0,1,0,0,0,1|2,0,0]=4 3154 B11R1.166 C[C@@H]1C[C@@H](CC[C@@H]1C(=O)O)N MCULE-8513246239 [0,1,0,0,0,1|2,0,0]=4 3155 B11R1.220 CC1(CCC(CC1)O)C(=O)O MCULE-4694168525 [0,1,0,0,0,1|1,0,0]=3 3156 B11R1.220 CC1CCC(CC1)(C)C(=O)O MCULE-7822016719 [0,1,0,0,0,1|2,0,0]=4 3157 B11R1.220 CC1CCC(CC1)(F)C(=O)O MCULE-8829791353 [0,1,0,0,0,1|2,0,0]=4 3158 B11R1.220 CC1CCC(CC1)(N)C(=O)O MCULE-7735898604 [0,1,0,0,0,1|2,0,0]=4 3159 B11R1.220 CC1CCC(CC1)(O)C(=O)O MCULE-2392362320 [0,1,0,0,0,1|2,0,0]=4 3160 B11R1.220 C[C@@]1(CC[C@@H](CC1)O)C(=O)O MCULE-5793928535 [0,1,0,0,0,1|1,0,0]=3 3161 B11R1.220 NC1CCC(CC1)(O)C(=O)O MCULE-8309786604 [0,1,0,0,0,1|2,0,0]=4 3162 B11R1.727 CC1(CCC(CC1)C(=O)O)C MCULE-4077940511 [0,1,0,0,0,1|2,0,0]=4 3163 B11R1.727 CC1(CCC(CC1)C(=O)O)O MCULE-4857156703 [0,1,0,0,0,1|1,0,0]=3 3164 B11R1.727 CC1(CCC(CO1)C(=O)O)C MCULE-6004318139 [0,1,0,0,0,1|2,0,0]=4 3165 B11R1.727 CC1(CCC(OC1)C(=O)O)C MCULE-4564560513 [0,1,0,0,0,1|2,0,0]=4 3166 B11R1.727 CC1(CNC(CO1)C(=O)O)C MCULE-4256075993 [0,1,0,0,0,1|1,0,0]=3 3167 B11R1.727 CC1(CNC(CO1)C(=O)O)C MCULE-7885479811 [0,1,0,0,0,1|1,0,0]=3 3168 B11R1.727 CC1(CN[C@@H](CO1)C(=O)O)C MCULE-4507731051 [0,1,0,0,0,1|1,0,0]=3 3169 B11R1.727 CC1(CN[C@@H](CO1)C(=O)O)C MCULE-6942026456 [0,1,0,0,0,1|1,0,0]=3 3170 B11R1.727 CC1(CN[C@@H](CO1)C(=O)O)C MCULE-8456032294 [0,1,0,0,0,1|1,0,0]=3 3171 B11R1.727 CC1(CN[C@@H](CO1)C(=O)O)C MCULE-9879183937 [0,1,0,0,0,1|1,0,0]=3 3172 B11R1.727 CC1(CN[C@H](CO1)C(=O)O)C MCULE-1777900508 [0,1,0,0,0,1|1,0,0]=3 3173 B11R1.727 CC1(CN[C@H](CO1)C(=O)O)C MCULE-3103501136 [0,1,0,0,0,1|1,0,0]=3 3174 B11R1.727 CC1(CN[C@H](CO1)C(=O)O)C MCULE-3507812849 [0,1,0,0,0,1|1,0,0]=3 3175 B11R1.727 CC1(CN[C@H](CO1)C(=O)O)C MCULE-7408744740 [0,1,0,0,0,1|1,0,0]=3 3176 B11R1.727 CC1(COC(CN1)C(=O)O)C MCULE-4924802724 [0,1,0,0,0,1|2,0,0]=4 3177 B11R1.727 CC1(COC(CN1)C(=O)O)C MCULE-8615912536 [0,1,0,0,0,1|2,0,0]=4 3178 B11R1.727 CC1(COC(CO1)C(=O)O)C MCULE-2956860789 [0,1,0,0,0,1|2,0,0]=4 3179 B11R1.727 O=C(O)C1CCC(CC1)(F)F MCULE-1527222921 [0,1,0,0,0,1|2,0,0]=4 3180 B11R1.727 O=C(O)C1CCC(CN1)(F)F MCULE-5193548537 [0,1,0,0,0,1|1,0,0]=3 3181 B11R1.727 O=C(O)C1CCC(CO1)(F)F MCULE-7251941830 [0,1,0,0,0,1|2,0,0]=4 3182 B11R1.727 O=C(O)[C@@H]1CCC(CN1)(F)F MCULE-7313789029 [0,1,0,0,0,1|1,0,0]=3 3183 B11R1.39 COC(=O)CC1CCC(C1)O MCULE-9379799773 [0,1,0,0,0,1|1,0,0]=3 3184 B11R1.39 COC(=O)C[C@@H]1C=C[C@H](C1)O MCULE-2710565886 [0,1,0,0,0,1|1,0,1]=4 3185 B11R1.39 COC(=O)C[C@@H]1CC[C@@H](C1)O MCULE-6958645109 [0,1,0,0,0,1|1,0,0]=3 3186 B11R1.39 COC(=O)C[C@@H]1CC[C@H](C1)O MCULE-5743866291 [0,1,0,0,0,1|1,0,0]=3 3187 B11R1.39 COC(=O)C[C@@H]1CC[C@H](C1)O MCULE-9442451073 [0,1,0,0,0,1|1,0,0]=3 3188 B11R1.39 COC(=O)C[C@H]1C=C[C@H](C1)O MCULE-8440079209 [0,1,0,0,0,1|1,0,1]=4 3189 B11R1.39 COC(=O)C[C@H]1CC[C@H](C1)O MCULE-9303774221 [0,1,0,0,0,1|1,0,0]=3 3190 B11R1.43 COC1CCN(C1)CC(=O)O MCULE-8169487800 [0,1,0,0,0,1|2,0,0]=4 3191 B11R1.43 N#CC1CCC(C1)CC(=O)O MCULE-5833233724 [0,1,0,0,0,1|2,0,0]=4 3192 B11R1.43 O=C(O)CC1CCC(=NO)C1 MCULE-9991838441 [0,1,0,0,0,1|1,0,1]=4 3193 B11R1.43 O=C(O)CN1CCC(C1)CO MCULE-3062534752 [0,1,0,0,0,1|2,0,0]=4 3194 B11R1.43 O=C(O)N[C@H]1CN[C@@H](C1)CO MCULE-5452070148 [0,1,0,0,0,1|2,0,0]=4 3195 B11R1.43 O=C(O)N[C@H]1CN[C@@H](C1)CO MCULE-7337827798 [0,1,0,0,0,1|2,0,0]=4 3196 B11R1.645 O=C(O)CN1CC(CC1=O)O MCULE-3214685086 [0,1,0,0,0,1|2,0,0]=4 3197 B11R1.645 O=C(O)CN1CC(CC1=O)O MCULE-9078700993 [0,1,0,0,0,1|2,0,0]=4 3198 B11R1.645 O=C(O)CN1C[C@H](CC1=O)O MCULE-3576151184 [0,1,0,0,0,1|2,0,0]=4 3199 B11R1.645 O=C(O)CN1C[C@H](CC1=O)O MCULE-5254432893 [0,1,0,0,0,1|2,0,0]=4 3200 B11R1.710 CC1(COC(C1)CC(=O)O)C MCULE-9149987188 [0,1,0,0,0,1|2,0,0]=4 3201 B11R1.710 O=C(O)CC1CCC(C1)(F)F MCULE-3568136562 [0,1,0,0,0,1|2,0,0]=4 3202 B11R1.23 CNC(=O)C1CNCC(C1)C MCULE-9576431849 [0,1,0,0,0,1|2,0,0]=4 3203 B11R1.23 COC(=O)C1CC(=O)CCN1 MCULE-2957789839 [0,1,0,0,0,1|0,0,2]=4 3204 B11R1.23 COC(=O)C1CC(=O)CCN1 MCULE-7628754673 [0,1,0,0,0,1|0,0,2]=4 3205 B11R1.23 COC(=O)C1CC(CCN1)C MCULE-1457564964 [0,1,0,0,0,1|1,0,0]=3 3206 B11R1.23 COC(=O)C1CC(CCN1)C MCULE-2332457766 [0,1,0,0,0,1|1,0,0]=3 3207 B11R1.23 COC(=O)C1CC(CCN1)O MCULE-1497004684 [0,1,0,0,0,1|0,0,0]=2 3208 B11R1.23 COC(=O)C1CC(CCN1)O MCULE-7170666495 [0,1,0,0,0,1|0,0,0]=2 3209 B11R1.23 COC(=O)C1CC=CC(C1)O MCULE-2728065324 [0,1,0,0,0,1|1,0,1]=4 3210 B11R1.23 COC(=O)C1CCCC(C1)C MCULE-4272190031 [0,1,0,0,0,1|2,0,0]=4 3211 B11R1.23 COC(=O)C1CCCC(C1)N MCULE-2634773813 [0,1,0,0,0,1|2,0,0]=4 3212 B11R1.23 COC(=O)C1CCCC(C1)N MCULE-5676579524 [0,1,0,0,0,1|2,0,0]=4 3213 B11R1.23 COC(=O)C1CCCC(C1)O MCULE-7531952837 [0,1,0,0,0,1|1,0,0]=3 3214 B11R1.23 COC(=O)C1CCNC(C1)C MCULE-1767850198 [0,1,0,0,0,1|2,0,0]=4 3215 B11R1.23 COC(=O)C1CCNC(C1)C MCULE-4654958614 [0,1,0,0,0,1|2,0,0]=4 3216 B11R1.23 COC(=O)C1CN(CCN1)C MCULE-4547246021 [0,1,0,0,0,1|2,0,0]=4 3217 B11R1.23 COC(=O)C1CN(CCN1)C MCULE-8755175940 [0,1,0,0,0,1|2,0,0]=4 3218 B11R1.23 COC(=O)C1CNCC(C1)C MCULE-6792476382 [0,1,0,0,0,1|1,0,0]=3 3219 B11R1.23 COC(=O)C1CNCC(C1)C MCULE-7677037243 [0,1,0,0,0,1|1,0,0]=3 3220 B11R1.23 COC(=O)C1CNCC(C1)F MCULE-1891281041 [0,1,0,0,0,1|1,0,0]=3 3221 B11R1.23 COC(=O)C1CNCC(C1)O MCULE-8962874525 [0,1,0,0,0,1|0,0,0]=2 3222 B11R1.23 COC(=O)C1CNCC(C1)O MCULE-9903585063 [0,1,0,0,0,1|0,0,0]=2 3223 B11R1.23 COC(=O)C1COCC(C1)O MCULE-1450615868 [0,1,0,0,0,1|1,0,0]=3 3224 B11R1.23 COC(=O)N1CCCC(C1)O MCULE-2922700960 [0,1,0,0,0,1|2,0,0]=4 3225 B11R1.23 COC(=O)[C@@H]1CC(=O)CCN1 MCULE-2526553506 [0,1,0,0,0,1|0,0,2]=4 3226 B11R1.23 COC(=O)[C@@H]1CC(=O)CCN1 MCULE-6095368090 [0,1,0,0,0,1|0,0,2]=4 3227 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](C1)C MCULE-1409445255 [0,1,0,0,0,1|2,0,0]=4 3228 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](C1)N MCULE-1032335921 [0,1,0,0,0,1|2,0,0]=4 3229 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](C1)N MCULE-4186486646 [0,1,0,0,0,1|2,0,0]=4 3230 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](C1)N MCULE-4922382608 [0,1,0,0,0,1|2,0,0]=4 3231 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](C1)N MCULE-6734699447 [0,1,0,0,0,1|2,0,0]=4 3232 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](C1)O MCULE-2826570915 [0,1,0,0,0,1|1,0,0]=3 3233 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](C1)O MCULE-5275681878 [0,1,0,0,0,1|1,0,0]=3 3234 B11R1.23 COC(=O)[C@@H]1CCC[C@H](C1)N MCULE-2795807911 [0,1,0,0,0,1|2,0,0]=4 3235 B11R1.23 COC(=O)[C@@H]1CCC[C@H](C1)N MCULE-4127929384 [0,1,0,0,0,1|2,0,0]=4 3236 B11R1.23 COC(=O)[C@@H]1CCC[C@H](C1)N MCULE-4717498053 [0,1,0,0,0,1|2,0,0]=4 3237 B11R1.23 COC(=O)[C@@H]1CCC[C@H](C1)N MCULE-9372091760 [0,1,0,0,0,1|2,0,0]=4 3238 B11R1.23 COC(=O)[C@@H]1CCC[C@H](C1)O MCULE-1752010928 [0,1,0,0,0,1|1,0,0]=3 3239 B11R1.23 COC(=O)[C@@H]1CCC[C@H](C1)O MCULE-3751397536 [0,1,0,0,0,1|1,0,0]=3 3240 B11R1.23 COC(=O)[C@@H]1CCN[C@@H](C1)C MCULE-1187786030 [0,1,0,0,0,1|2,0,0]=4 3241 B11R1.23 COC(=O)[C@@H]1CCN[C@@H](C1)C MCULE-1554892534 [0,1,0,0,0,1|2,0,0]=4 3242 B11R1.23 COC(=O)[C@@H]1CCN[C@@H](C1)C MCULE-5013221855 [0,1,0,0,0,1|2,0,0]=4 3243 B11R1.23 COC(=O)[C@@H]1CCN[C@@H](C1)C MCULE-9993392560 [0,1,0,0,0,1|2,0,0]=4 3244 B11R1.23 COC(=O)[C@@H]1CNC[C@@H](O1)C MCULE-1023461283 [0,1,0,0,0,1|2,0,0]=4 3245 B11R1.23 COC(=O)[C@@H]1CNC[C@@H](O1)C MCULE-8404158859 [0,1,0,0,0,1|2,0,0]=4 3246 B11R1.23 COC(=O)[C@@H]1C[C@@H](CCN1)O MCULE-1560155771 [0,1,0,0,0,1|0,0,0]=2 3247 B11R1.23 COC(=O)[C@@H]1C[C@@H](CCN1)O MCULE-4264457030 [0,1,0,0,0,1|0,0,0]=2 3248 B11R1.23 COC(=O)[C@@H]1C[C@@H](CCN1)O MCULE-6232000722 [0,1,0,0,0,1|0,0,0]=2 3249 B11R1.23 COC(=O)[C@@H]1C[C@@H](CCN1)O MCULE-8711787558 [0,1,0,0,0,1|0,0,0]=2 3250 B11R1.23 COC(=O)[C@@H]1C[C@H](CCN1)O MCULE-4467656117 [0,1,0,0,0,1|0,0,0]=2 3251 B11R1.23 COC(=O)[C@@H]1C[C@H](CCN1)O MCULE-5992101405 [0,1,0,0,0,1|0,0,0]=2 3252 B11R1.23 COC(=O)[C@@H]1C[C@H](CCN1)O MCULE-6317611644 [0,1,0,0,0,1|0,0,0]=2 3253 B11R1.23 COC(=O)[C@@H]1C[C@H](CCN1)O MCULE-6996533131 [0,1,0,0,0,1|0,0,0]=2 3254 B11R1.23 COC(=O)[C@H]1CC=C[C@H](C1)O MCULE-9306178186 [0,1,0,0,0,1|1,0,1]=4 3255 B11R1.23 COC(=O)[C@H]1CCC[C@@H](C1)C MCULE-8236622513 [0,1,0,0,0,1|2,0,0]=4 3256 B11R1.23 COC(=O)[C@H]1CCC[C@@H](C1)N MCULE-2543113082 [0,1,0,0,0,1|2,0,0]=4 3257 B11R1.23 COC(=O)[C@H]1CCC[C@@H](C1)N MCULE-6222782588 [0,1,0,0,0,1|2,0,0]=4 3258 B11R1.23 COC(=O)[C@H]1CCC[C@@H](C1)N MCULE-6374651784 [0,1,0,0,0,1|2,0,0]=4 3259 B11R1.23 COC(=O)[C@H]1CCC[C@@H](C1)N MCULE-9189210669 [0,1,0,0,0,1|2,0,0]=4 3260 B11R1.23 COC(=O)[C@H]1CCC[C@@H](C1)O MCULE-1036732191 [0,1,0,0,0,1|1,0,0]=3 3261 B11R1.23 COC(=O)[C@H]1CCC[C@@H](C1)O MCULE-7022445698 [0,1,0,0,0,1|1,0,0]=3 3262 B11R1.23 COC(=O)[C@H]1CCC[C@H](C1)N MCULE-1272125797 [0,1,0,0,0,1|2,0,0]=4 3263 B11R1.23 COC(=O)[C@H]1CCC[C@H](C1)N MCULE-3188707822 [0,1,0,0,0,1|2,0,0]=4 3264 B11R1.23 COC(=O)[C@H]1CCC[C@H](C1)N MCULE-4975583110 [0,1,0,0,0,1|2,0,0]=4 3265 B11R1.23 COC(=O)[C@H]1CCC[C@H](C1)N MCULE-8631497838 [0,1,0,0,0,1|2,0,0]=4 3266 B11R1.23 COC(=O)[C@H]1CCC[C@H](C1)O MCULE-2298116384 [0,1,0,0,0,1|1,0,0]=3 3267 B11R1.23 COC(=O)[C@H]1CCC[C@H](C1)O MCULE-4413710460 [0,1,0,0,0,1|1,0,0]=3 3268 B11R1.23 COC(=O)[C@H]1CCC[C@H](C1)O MCULE-9938371951 [0,1,0,0,0,1|1,0,0]=3 3269 B11R1.23 COC(=O)[C@H]1CCN[C@H](C1)C MCULE-3661641129 [0,1,0,0,0,1|2,0,0]=4 3270 B11R1.23 COC(=O)[C@H]1CCN[C@H](C1)C MCULE-4187055827 [0,1,0,0,0,1|2,0,0]=4 3271 B11R1.23 COC(=O)[C@H]1CNC[C@@H](C1)C MCULE-5522834072 [0,1,0,0,0,1|1,0,0]=3 3272 B11R1.23 COC(=O)[C@H]1CNC[C@@H](C1)C MCULE-7069305041 [0,1,0,0,0,1|1,0,0]=3 3273 B11R1.23 COC(=O)[C@H]1CNC[C@@H](C1)C MCULE-8819293670 [0,1,0,0,0,1|1,0,0]=3 3274 B11R1.23 COC(=O)[C@H]1CNC[C@H](C1)C MCULE-1230934148 [0,1,0,0,0,1|1,0,0]=3 3275 B11R1.23 COC(=O)[C@H]1CNC[C@H](C1)C MCULE-4518893761 [0,1,0,0,0,1|1,0,0]=3 3276 B11R1.23 COC(=O)[C@H]1CNC[C@H](C1)C MCULE-6242107437 [0,1,0,0,0,1|1,0,0]=3 3277 B11R1.23 COC(=O)[C@H]1CNC[C@H](C1)C MCULE-6759485266 [0,1,0,0,0,1|1,0,0]=3 3278 B11R1.23 COC(=O)[C@H]1CNC[C@H](C1)C MCULE-7286083039 [0,1,0,0,0,1|1,0,0]=3 3279 B11R1.23 COC(=O)[C@H]1CNC[C@H](C1)C MCULE-8529284501 [0,1,0,0,0,1|1,0,0]=3 3280 B11R1.23 COC(=O)[C@H]1C[C@@H](CCN1)O MCULE-3855809627 [0,1,0,0,0,1|0,0,0]=2 3281 B11R1.23 COC(=O)[C@H]1C[C@@H](CCN1)O MCULE-9652933218 [0,1,0,0,0,1|0,0,0]=2 3282 B11R1.23 COC(=O)[C@H]1C[C@H](CCN1)O MCULE-5894001253 [0,1,0,0,0,1|0,0,0]=2 3283 B11R1.23 COC(=O)[C@H]1C[C@H](CCN1)O MCULE-7416859347 [0,1,0,0,0,1|0,0,0]=2 3284 B11R1.23 COC(=O)[C@H]1C[C@H](CCN1)O MCULE-7542782600 [0,1,0,0,0,1|0,0,0]=2 3285 B11R1.23 COC(=O)[C@H]1C[C@H](CCN1)O MCULE-7582287818 [0,1,0,0,0,1|0,0,0]=2 3286 B11R1.23 COC(=O)[C@H]1C[C@H](CCN1)O MCULE-8181619832 [0,1,0,0,0,1|0,0,0]=2 3287 B11R1.23 COC(=O)[C@H]1C[C@H](CCN1)O MCULE-9706236638 [0,1,0,0,0,1|0,0,0]=2 3288 B11R1.23 [C@H]1(CCN[C@H](C1)C(=O)OC)O MCULE-1156229977 [0,1,0,0,0,1|0,0,0]=2 3289 B11R1.23 [C@H]1(CCN[C@H](C1)C(=O)OC)O MCULE-8722743074 [0,1,0,0,0,1|0,0,0]=2 3290 B11R1.23 [C@H]1(C[C@@H](CCN1)C(=O)OC)C MCULE-1747332778 [0,1,0,0,0,1|2,0,0]=4 3291 B11R1.23 [C@H]1(C[C@@H](CCN1)C(=O)OC)C MCULE-7292173126 [0,1,0,0,0,1|2,0,0]=4 3292 B11R1.74 CC1CC(CC(C1)C(=O)O)C MCULE-4414065035 [0,1,0,0,0,1|2,0,0]=4 3293 B11R1.74 CC1CC(CC(O1)C)C(=O)O MCULE-8718069513 [0,1,0,0,0,1|2,0,0]=4 3294 B11R1.74 CC1CC(NC(=S)N1)C(=O)O MCULE-6244565305 [0,1,0,0,0,1|1,0,1]=4 3295 B11R1.74 CC1CN(CC(O1)C(=O)O)C MCULE-1120383485 [0,1,0,0,0,1|2,0,0]=4 3296 B11R1.74 CC1CN(CC(O1)C(=O)O)C MCULE-4331152110 [0,1,0,0,0,1|2,0,0]=4 3297 B11R1.74 C[C@@H]1CC(C[C@@H](C1)C)C(=O)O MCULE-8476320504 [0,1,0,0,0,1|2,0,0]=4 3298 B11R1.74 C[C@@H]1C[C@@H](C[C@@H](C1)C)C(=O)O MCULE-7313940085 [0,1,0,0,0,1|2,0,0]=4 3299 B11R1.74 C[C@@H]1C[C@H](NC(=S)N1)C(=O)O MCULE-3527131237 [0,1,0,0,0,1|1,0,1]=4 3300 B11R1.74 C[C@@H]1C[C@H](NC(=S)N1)C(=O)O MCULE-5042056278 [0,1,0,0,0,1|1,0,1]=4 3301 B11R1.74 C[C@H]1CC(C[C@H](N1)C)C(=O)O MCULE-2237943409 [0,1,0,0,0,1|2,0,0]=4 3302 B11R1.74 C[C@H]1CC(C[C@H](N1)C)C(=O)O MCULE-4813276637 [0,1,0,0,0,1|2,0,0]=4 3303 B11R1.74 C[C@H]1CC(C[C@H](O1)C)C(=O)O MCULE-3337799083 [0,1,0,0,0,1|2,0,0]=4 3304 B11R1.167 CN1CCN(C(C1)C(=O)O)C MCULE-6290479918 [0,1,0,0,0,1|2,0,0]=4 3305 B11R1.167 CN1CCN(C(C1)C(=O)O)C MCULE-8670086906 [0,1,0,0,0,1|2,0,0]=4 3306 B11R1.167 CN1CCN([C@@H](C1)C(=O)O)C MCULE-6955851048 [0,1,0,0,0,1|2,0,0]=4 3307 B11R1.167 CN1CCN([C@@H](C1)C(=O)O)C MCULE-7191641614 [0,1,0,0,0,1|2,0,0]=4 3308 B11R1.167 CN1CCN([C@H](C1)C(=O)O)C MCULE-3765574199 [0,1,0,0,0,1|2,0,0]=4 3309 B11R1.167 CN1CCN([C@H](C1)C(=O)O)C MCULE-6324425972 [0,1,0,0,0,1|2,0,0]=4 3310 B11R1.266 CCC1CC(CCO1)C(=O)O MCULE-2078111514 [0,1,0,0,0,1|2,0,0]=4 3311 B11R1.266 COC1CCCC(C1)C(=O)O MCULE-5456384162 [0,1,0,0,0,1|1,0,0]=3 3312 B11R1.266 COC1CCNC(C1)C(=O)O MCULE-4331709048 [0,1,0,0,0,1|0,0,0]=2 3313 B11R1.266 COC1CCNC(C1)C(=O)O MCULE-4664523841 [0,1,0,0,0,1|0,0,0]=2 3314 B11R1.266 CO[C@@H]1CCN[C@@H](C1)C(=O)O MCULE-3625899999 [0,1,0,0,0,1|0,0,0]=2 3315 B11R1.266 CO[C@@H]1CCN[C@H](C1)C(=O)O MCULE-5992517897 [0,1,0,0,0,1|0,0,0]=2 3316 B11R1.266 CO[C@H]1CCC[C@H](C1)C(=O)O MCULE-4087120684 [0,1,0,0,0,1|1,0,0]=3 3317 B11R1.266 CO[C@H]1CCN[C@@H](C1)C(=O)O MCULE-9935444947 [0,1,0,0,0,1|0,0,0]=2 3318 B11R1.266 CO[C@H]1CCN[C@H](C1)C(=O)O MCULE-1244366233 [0,1,0,0,0,1|0,0,0]=2 3319 B11R1.266 O=C(O)C1CCCC(=NO)C1 MCULE-8609222770 [0,1,0,0,0,1|1,0,1]=4 3320 B11R1.266 O=C(O)C1CCCC(C1)CO MCULE-5244716212 [0,1,0,0,0,1|1,0,0]=3 3321 B11R1.667 CC1(CC(CCO1)N)C(=O)O MCULE-4479358294 [0,1,0,0,0,1|2,0,0]=4 3322 B11R1.667 CC1(CC(CCO1)N)C(=O)O MCULE-7328807092 [0,1,0,0,0,1|2,0,0]=4 3323 B11R1.667 CC1CC(CCO1)(C)C(=O)O MCULE-8913886133 [0,1,0,0,0,1|2,0,0]=4 3324 B11R1.667 CC1CC(CCO1)(N)C(=O)O MCULE-2481658934 [0,1,0,0,0,1|2,0,0]=4 3325 B11R1.667 CC1CC(CCO1)(N)C(=O)O MCULE-5146905630 [0,1,0,0,0,1|2,0,0]=4 3326 B11R1.667 CC1CCCC(C1)(N)C(=O)O MCULE-7952794030 [0,1,0,0,0,1|2,0,0]=4 3327 B11R1.730 CC1(CC(CCN1)C(=O)O)C MCULE-8159392480 [0,1,0,0,0,1|2,0,0]=4 3328 B11R1.730 CC1(CC(CCO1)C(=O)O)C MCULE-5978480117 [0,1,0,0,0,1|2,0,0]=4 3329 B11R1.730 CC1(CCCC(C1)C(=O)O)C MCULE-1597122526 [0,1,0,0,0,1|2,0,0]=4 3330 B11R1.730 CC1(CCNC(C1)C(=O)O)C MCULE-1186852121 [0,1,0,0,0,1|1,0,0]=3 3331 B11R1.730 CC1(CCNC(C1)C(=O)O)C MCULE-5031883785 [0,1,0,0,0,1|1,0,0]=3 3332 B11R1.730 CC1(CNCC(O1)C(=O)O)C MCULE-3850941228 [0,1,0,0,0,1|2,0,0]=4 3333 B11R1.730 CC1(CNCC(O1)C(=O)O)C MCULE-4368873526 [0,1,0,0,0,1|2,0,0]=4 3334 B11R1.730 O=C(O)C1CC(CCN1)(F)F MCULE-2772004848 [0,1,0,0,0,1|1,0,0]=3 3335 B11R1.730 O=C(O)C1CC(CCN1)(F)F MCULE-5000214371 [0,1,0,0,0,1|1,0,0]=3 3336 B11R1.730 O=C(O)C1CCCC(C1)(F)F MCULE-2685730195 [0,1,0,0,0,1|2,0,0]=4 3337 B11R1.730 O=C(O)C1CNCC(C1)(F)F MCULE-1061763206 [0,1,0,0,0,1|1,0,0]=3 3338 B11R1.730 O=C(O)C1CNCC(C1)(F)F MCULE-4420284602 [0,1,0,0,0,1|1,0,0]=3 3339 B11R1.730 O=C(O)C1CS(=O)(=O)CCN1 MCULE-5588278992 [0,1,0,0,0,1|1,0,1]=4 3340 B11R1.730 O=C(O)C1CS(=O)(=O)CCN1 MCULE-6421455090 [0,1,0,0,0,1|1,0,1]=4 3341 B11R1.730 O=C(O)[C@@H]1CC(CCN1)(F)F MCULE-1496564772 [0,1,0,0,0,1|1,0,0]=3 3342 B11R1.730 O=C(O)[C@@H]1CC(CCN1)(F)F MCULE-5121648329 [0,1,0,0,0,1|1,0,0]=3 3343 B11R1.730 O=C(O)[C@@H]1CC(CCN1)(F)F MCULE-5853696607 [0,1,0,0,0,1|1,0,0]=3 3344 B11R1.730 O=C(O)[C@@H]1CC(CCN1)(F)F MCULE-8207836720 [0,1,0,0,0,1|1,0,0]=3 3345 B11R1.15 CCOC(=O)C1CC(CN1)C MCULE-3875172966 [0,2,0,0,0,0|1,0,0]=3 3346 B11R1.15 CCOC(=O)C1CC(CN1)C MCULE-4042846078 [0,2,0,0,0,0|1,0,0]=3 3347 B11R1.15 CCOC(=O)C1CC(CN1)F MCULE-5288164254 [0,2,0,0,0,0|1,0,0]=3 3348 B11R1.15 CCOC(=O)C1CC(CN1)O MCULE-5538690539 [0,2,0,0,0,0|0,0,0]=2 3349 B11R1.15 CCOC(=O)C1CC(CO1)O MCULE-8930811806 [0,2,0,0,0,0|1,0,0]=3 3350 B11R1.15 CCOC(=O)C1CCC(C1)F MCULE-2013179429 [0,2,0,0,0,0|2,0,0]=4 3351 B11R1.15 CCOC(=O)C1CCC(C1)N MCULE-5526949759 [0,2,0,0,0,0|2,0,0]=4 3352 B11R1.15 CCOC(=O)C1CCC(C1)N MCULE-7663378947 [0,2,0,0,0,0|2,0,0]=4 3353 B11R1.15 CCOC(=O)C1CCC(C1)O MCULE-6096775153 [0,2,0,0,0,0|1,0,0]=3 3354 B11R1.15 CCOC(=O)[C@@H]1CC[C@@H](C1)N MCULE-1718691646 [0,2,0,0,0,0|2,0,0]=4 3355 B11R1.15 CCOC(=O)[C@@H]1CC[C@@H](C1)N MCULE-7986492324 [0,2,0,0,0,0|2,0,0]=4 3356 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)C MCULE-5865491518 [0,2,0,0,0,0|1,0,0]=3 3357 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)C MCULE-7667159720 [0,2,0,0,0,0|1,0,0]=3 3358 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)C MCULE-8052330663 [0,2,0,0,0,0|1,0,0]=3 3359 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)C MCULE-9681214021 [0,2,0,0,0,0|1,0,0]=3 3360 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)O MCULE-1347029109 [0,2,0,0,0,0|0,0,0]=2 3361 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)O MCULE-3430696999 [0,2,0,0,0,0|0,0,0]=2 3362 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)O MCULE-5862721976 [0,2,0,0,0,0|0,0,0]=2 3363 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)O MCULE-5966513116 [0,2,0,0,0,0|0,0,0]=2 3364 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)O MCULE-7220071114 [0,2,0,0,0,0|0,0,0]=2 3365 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)O MCULE-8522141762 [0,2,0,0,0,0|0,0,0]=2 3366 B11R1.15 CCOC(=O)[C@H]1C[C@@H](CN1)C MCULE-3522163045 [0,2,0,0,0,0|1,0,0]=3 3367 B11R1.15 CCOC(=O)[C@H]1C[C@@H](CN1)F MCULE-6715751434 [0,2,0,0,0,0|1,0,0]=3 3368 B11R1.15 CCOC(=O)[C@H]1C[C@@H](CN1)F MCULE-7008683187 [0,2,0,0,0,0|1,0,0]=3 3369 B11R1.15 CCOC(=O)[C@H]1C[C@@H](CN1)F MCULE-8131644663 [0,2,0,0,0,0|1,0,0]=3 3370 B11R1.15 [NH2+]1CC(CC1C(=O)OCC)O MCULE-6930432950 [0,2,0,0,0,0|0,0,1]=3 3371 B11R1.44 C#CC1CCC(C1)C(=O)OC MCULE-9103535418 [0,2,0,0,0,0|2,0,0]=4 3372 B11R1.44 COC(=O)C1CCC(C1)C=O MCULE-4933566077 [0,2,0,0,0,0|1,0,1]=4 3373 B11R1.44 COC(=O)C1CCC(C1)CBr MCULE-4959141432 [0,2,0,0,0,0|2,0,0]=4 3374 B11R1.44 COC(=O)C1CCC(C1)CN MCULE-2495305998 [0,2,0,0,0,0|2,0,0]=4 3375 B11R1.44 COC(=O)C1CCC(C1)CN MCULE-5766901556 [0,2,0,0,0,0|2,0,0]=4 3376 B11R1.44 COC(=O)C1CCC(C1)CO MCULE-8674331081 [0,2,0,0,0,0|1,0,0]=3 3377 B11R1.44 COC(=O)C1CCC(N1)CO MCULE-1203357587 [0,2,0,0,0,0|2,0,0]=4 3378 B11R1.44 COC(=O)C1CCC(N1)CO MCULE-1340753915 [0,2,0,0,0,0|2,0,0]=4 3379 B11R1.44 COC(=O)N1CCC(C1)CO MCULE-3856580907 [0,2,0,0,0,0|2,0,0]=4 3380 B11R1.44 COC(=O)[C@@H]1C=C[C@@H](C1)CO MCULE-9022475559 [0,2,0,0,0,0|1,0,1]=4 3381 B11R1.44 COC(=O)[C@@H]1CC[C@@H](C1)CO MCULE-6652319072 [0,2,0,0,0,0|1,0,0]=3 3382 B11R1.44 COC(=O)[C@@H]1CC[C@@H](C1)CO MCULE-7077024997 [0,2,0,0,0,0|1,0,0]=3 3383 B11R1.44 COC(=O)[C@@H]1C[C@@H](CN1)C#N MCULE-7155482402 [0,2,0,0,0,0|1,0,0]=3 3384 B11R1.44 COC(=O)[C@@H]1C[C@@H](CN1)C#N MCULE-9985743306 [0,2,0,0,0,0|1,0,0]=3 3385 B11R1.44 COC(=O)[C@@H]1C[C@H](CN1)OC MCULE-1213399533 [0,2,0,0,0,0|0,0,0]=2 3386 B11R1.44 COC(=O)[C@@H]1C[C@H](CN1)OC MCULE-4610772971 [0,2,0,0,0,0|0,0,0]=2 3387 B11R1.44 COC(=O)[C@@H]1C[C@H](CN1)OC MCULE-7612864840 [0,2,0,0,0,0|0,0,0]=2 3388 B11R1.44 COC(=O)[C@@H]1C[C@H](CN1)OC MCULE-8037847987 [0,2,0,0,0,0|0,0,0]=2 3389 B11R1.44 COC(=O)[C@@H]1C[C@H](CN1)OCl MCULE-6594061970 [0,2,0,0,0,0|0,0,0]=2 3390 B11R1.44 COC(=O)[C@@H]1C[C@H](CN1)SC MCULE-2684996777 [0,2,0,0,0,0|0,1,0]=3 3391 B11R1.44 COC(=O)[C@@H]1C[C@H](CN1)SC MCULE-6533950442 [0,2,0,0,0,0|0,1,0]=3 3392 B11R1.44 COC(=O)[C@H]1C=C[C@@H](C1)CO MCULE-8356969001 [0,2,0,0,0,0|1,0,1]=4 3393 B11R1.44 COC(=O)[C@H]1CC[C@H](C1)C=O MCULE-2955473183 [0,2,0,0,0,0|1,0,1]=4 3394 B11R1.225 COC(=O)C1CC(CC1=O)C MCULE-7882316482 [0,2,0,0,0,0|2,0,0]=4 3395 B11R1.225 COC(=O)C1CC(CN1C)N MCULE-3741177385 [0,2,0,0,0,0|1,0,0]=3 3396 B11R1.225 COC(=O)C1CC(CN1C)N MCULE-7211166080 [0,2,0,0,0,0|1,0,0]=3 3397 B11R1.225 COC(=O)C1CC(CN1C)O MCULE-8276293974 [0,2,0,0,0,0|0,0,0]=2 3398 B11R1.225 COC(=O)[C@@H]1C[C@@H](CN1C)N MCULE-2835432590 [0,2,0,0,0,0|1,0,0]=3 3399 B11R1.225 COC(=O)[C@@H]1C[C@@H](CN1C)N MCULE-3472657194 [0,2,0,0,0,0|1,0,0]=3 3400 B11R1.225 COC(=O)[C@@H]1C[C@@H](CN1C)N MCULE-8344198799 [0,2,0,0,0,0|1,0,0]=3 3401 B11R1.225 COC(=O)[C@@H]1C[C@@H](CN1C)N MCULE-9598793301 [0,2,0,0,0,0|1,0,0]=3 3402 B11R1.225 COC(=O)[C@@H]1C[C@H](CN1C)N MCULE-1127187038 [0,2,0,0,0,0|1,0,0]=3 3403 B11R1.225 COC(=O)[C@@H]1C[C@H](CN1C)N MCULE-3726089079 [0,2,0,0,0,0|1,0,0]=3 3404 B11R1.225 COC(=O)[C@@H]1C[C@H](CN1C)N MCULE-5349307259 [0,2,0,0,0,0|1,0,0]=3 3405 B11R1.225 COC(=O)[C@@H]1C[C@H](CN1C)N MCULE-7804692192 [0,2,0,0,0,0|1,0,0]=3 3406 B11R1.225 COC(=O)[C@@H]1C[C@H](CN1C)O MCULE-1253994765 [0,2,0,0,0,0|0,0,0]=2 3407 B11R1.225 COC(=O)[C@@H]1C[C@H](CN1C)O MCULE-6377481743 [0,2,0,0,0,0|0,0,0]=2 3408 B11R1.226 COC(=O)[C@@H]1C[C@@H](C(=O)N1)O MCULE-1924620912 [0,2,0,0,0,0|0,0,1]=3 3409 B11R1.226 COC(=O)[C@@H]1C[C@H](C(=O)N1)O MCULE-6174114389 [0,2,0,0,0,0|0,0,1]=3 3410 B11R1.226 COC(=O)[C@@H]1C[C@H](C(=O)N1)O MCULE-7981334019 [0,2,0,0,0,0|0,0,1]=3 3411 B11R1.865 C1(NCC(C1O)O)C(O)CO MCULE-8182773216 [0,2,0,0,0,0|0,0,2]=4 3412 B11R1.865 C1(NCC(C1O)O)C(O)CO MCULE-9438696630 [0,2,0,0,0,0|0,0,2]=4 3413 B11R1.865 O=CC(O)C1OCC(C1O)O MCULE-3736817186 [0,2,0,0,0,0|1,0,1]=4 3414 B11R1.865 O=C[C@H](O)[C@H]1OC[C@H]([C@H]1O)O MCULE-7499541573 [0,2,0,0,0,0|1,0,1]=4 3415 B11R1.865 [C@@H]1(NC[C@H]([C@H]1O)O)[C@H](O)CO MCULE-6385831394 [0,2,0,0,0,0|0,0,2]=4 3416 B11R1.865 [C@@H]1(NC[C@H]([C@H]1O)O)[C@H](O)CO MCULE-7164777003 [0,2,0,0,0,0|0,0,2]=4 3417 B11R1.866 C1(CC(CN1)(F)F)C(=O)OC MCULE-3849911838 [0,2,0,0,0,0|1,0,0]=3 3418 B11R1.866 C1(CC(CN1)(F)F)C(=O)OC MCULE-9557030869 [0,2,0,0,0,0|1,0,0]=3 3419 B11R1.866 COC(=O)C1CC(CN1)(F)F MCULE-1802975643 [0,2,0,0,0,0|1,0,0]=3 3420 B11R1.866 COC(=O)C1CC(CN1)(F)F MCULE-2858211892 [0,2,0,0,0,0|1,0,0]=3 3421 B11R1.866 COC(=O)C1CC(CN1)(F)F MCULE-9815337525 [0,2,0,0,0,0|1,0,0]=3 3422 B11R1.866 COC(=O)C1CCC(C1)(F)F MCULE-9044862144 [0,2,0,0,0,0|2,0,0]=4 3423 B11R1.866 COC(=O)[C@@H]1CC(CN1)(C)C MCULE-8589256605 [0,2,0,0,0,0|1,0,0]=3 3424 B11R1.866 COC(=O)[C@@H]1CC(CN1)(C)C MCULE-9327719540 [0,2,0,0,0,0|1,0,0]=3 3425 B11R1.866 COC(=O)[C@@H]1CC(CN1)(F)F MCULE-4636876584 [0,2,0,0,0,0|1,0,0]=3 3426 B11R1.866 COC(=O)[C@@H]1CC(CN1)(F)F MCULE-5227178262 [0,2,0,0,0,0|1,0,0]=3 3427 B11R1.866 COC(=O)[C@@H]1CC(CN1)(F)F MCULE-5533226102 [0,2,0,0,0,0|1,0,0]=3 3428 B11R1.866 COC(=O)[C@@H]1CC(CN1)(F)F MCULE-6367163290 [0,2,0,0,0,0|1,0,0]=3 3429 B11R1.866 COC(=O)[C@@H]1CC(CN1)(F)F MCULE-6511123607 [0,2,0,0,0,0|1,0,0]=3 3430 B11R1.866 COC(=O)[C@@H]1CC(CN1)(F)F MCULE-8255740871 [0,2,0,0,0,0|1,0,0]=3 3431 B11R1.866 COC(=O)[C@@H]1CCC(C1)(F)F MCULE-9472140626 [0,2,0,0,0,0|2,0,0]=4 3432 B11R1.866 COC(=O)[C@H]1CC(CN1)(F)F MCULE-5059176428 [0,2,0,0,0,0|1,0,0]=3 3433 B11R1.866 COC(=O)[C@H]1CC(CN1)(F)F MCULE-6295586191 [0,2,0,0,0,0|1,0,0]=3 3434 B11R1.866 COC(=O)[C@H]1CC(CN1)(F)F MCULE-6534377059 [0,2,0,0,0,0|1,0,0]=3 3435 B11R1.866 COC(=O)[C@H]1CC(CN1)(F)F MCULE-8393773574 [0,2,0,0,0,0|1,0,0]=3 3436 B11R1.866 COC(=O)[C@H]1CCC(C1)(F)F MCULE-4233489673 [0,2,0,0,0,0|2,0,0]=4 3437 B11R1.885 COC(=O)C1(CCC(C1)N)C MCULE-4730550105 [0,2,0,0,0,0|2,0,0]=4 3438 B11R1.885 COC(=O)C1(CCC(C1)N)C MCULE-5763657508 [0,2,0,0,0,0|2,0,0]=4 3439 B11R1.885 COC(=O)[C@@]1(CC[C@H](C1)N)C MCULE-1430449084 [0,2,0,0,0,0|2,0,0]=4 3440 B11R1.885 COC(=O)[C@@]1(CC[C@H](C1)N)C MCULE-7995456134 [0,2,0,0,0,0|2,0,0]=4 3441 B11R1.50 COC1CC(N(C1)C)C(=O)O MCULE-1423425692 [0,2,0,0,0,0|0,0,0]=2 3442 B11R1.50 COC1CC(N(C1)C)C(=O)O MCULE-2959748188 [0,2,0,0,0,0|0,0,0]=2 3443 B11R1.50 CO[C@@H]1C[C@@H](N(C1)C)C(=O)O MCULE-1590152733 [0,2,0,0,0,0|0,0,0]=2 3444 B11R1.50 CO[C@@H]1C[C@@H](N(C1)C)C(=O)O MCULE-1725337520 [0,2,0,0,0,0|0,0,0]=2 3445 B11R1.50 CO[C@@H]1C[C@@H](N(C1)C)C(=O)O MCULE-4795764012 [0,2,0,0,0,0|0,0,0]=2 3446 B11R1.50 CO[C@@H]1C[C@@H](N(C1)C)C(=O)O MCULE-4979168553 [0,2,0,0,0,0|0,0,0]=2 3447 B11R1.50 CO[C@@H]1C[C@H](N(C1)C)C(=O)O MCULE-1573245897 [0,2,0,0,0,0|0,0,0]=2 3448 B11R1.50 CO[C@@H]1C[C@H](N(C1)C)C(=O)O MCULE-2703321277 [0,2,0,0,0,0|0,0,0]=2 3449 B11R1.50 CO[C@@H]1C[C@H](N(C1)C)C(=O)O MCULE-6208220513 [0,2,0,0,0,0|0,0,0]=2 3450 B11R1.50 CO[C@@H]1C[C@H](N(C1)C)C(=O)O MCULE-7440692979 [0,2,0,0,0,0|0,0,0]=2 3451 B11R1.50 CO[C@H]1C[C@@H](N(C1)C)C(=O)O MCULE-1704338327 [0,2,0,0,0,0|0,0,0]=2 3452 B11R1.50 CO[C@H]1C[C@@H](N(C1)C)C(=O)O MCULE-1877030062 [0,2,0,0,0,0|0,0,0]=2 3453 B11R1.50 CO[C@H]1C[C@@H](N(C1)C)C(=O)O MCULE-4474244565 [0,2,0,0,0,0|0,0,0]=2 3454 B11R1.50 CO[C@H]1C[C@@H](N(C1)C)C(=O)O MCULE-8920183735 [0,2,0,0,0,0|0,0,0]=2 3455 B11R1.50 CO[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-7317236292 [0,2,0,0,0,0|0,0,0]=2 3456 B11R1.50 CO[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-8577964792 [0,2,0,0,0,0|0,0,0]=2 3457 B11R1.50 CO[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-8849413165 [0,2,0,0,0,0|0,0,0]=2 3458 B11R1.50 CO[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-9195162297 [0,2,0,0,0,0|0,0,0]=2 3459 B11R1.50 [C@H]1(CN([C@H](C1)C(=O)O)C)OC MCULE-7841306971 [0,2,0,0,0,0|0,0,0]=2 3460 B11R1.50 [C@H]1(CN([C@H](C1)C(=O)O)C)OC MCULE-9935832845 [0,2,0,0,0,0|0,0,0]=2 3461 B11R1.124 C#CCC1CNC(C1)C(=O)O MCULE-1007702144 [0,2,0,0,0,0|1,0,0]=3 3462 B11R1.124 C#CCC1CNC(C1)C(=O)O MCULE-8985950522 [0,2,0,0,0,0|1,0,0]=3 3463 B11R1.124 C#CC[C@H]1CN[C@@H](C1)C(=O)O MCULE-1204374334 [0,2,0,0,0,0|1,0,0]=3 3464 B11R1.124 C#CC[C@H]1CN[C@@H](C1)C(=O)O MCULE-1775730985 [0,2,0,0,0,0|1,0,0]=3 3465 B11R1.124 C#CC[C@H]1CN[C@@H](C1)C(=O)O MCULE-2867557338 [0,2,0,0,0,0|1,0,0]=3 3466 B11R1.124 C#CC[C@H]1CN[C@@H](C1)C(=O)O MCULE-9622349016 [0,2,0,0,0,0|1,0,0]=3 3467 B11R1.124 C=CC[C@H]1CN[C@@H](C1)C(=O)O MCULE-7811782520 [0,2,0,0,0,0|1,0,0]=3 3468 B11R1.124 C=CC[C@H]1CN[C@@H](C1)C(=O)O MCULE-8003555600 [0,2,0,0,0,0|1,0,0]=3 3469 B11R1.124 [N-]=[N+]=N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-4777896289 [0,2,0,0,0,0|1,0,0]=3 3470 B11R1.124 [N-]=[N+]=N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-7254235634 [0,2,0,0,0,0|1,0,0]=3 3471 B11R1.124 [N-]=[N+]=N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-9002611696 [0,2,0,0,0,0|1,0,0]=3 3472 B11R1.124 [N-]=[N+]=N[C@@H]1CN[C@H](C1)C(=O)O MCULE-7757470668 [0,2,0,0,0,0|1,0,0]=3 3473 B11R1.124 [N-]=[N+]=N[C@@H]1C[NH2+][C@@H](C1)C(=O)O MCULE-1853617447 [0,2,0,0,0,0|1,0,1]=4 3474 B11R1.124 [N-]=[N+]=N[C@H]1CN[C@@H](C1)C(=O)O MCULE-7399082915 [0,2,0,0,0,0|1,0,0]=3 3475 B11R1.175 CN(C)C1CNC(C1)C(=O)O MCULE-4135437192 [0,2,0,0,0,0|1,0,0]=3 3476 B11R1.175 CN(C)C1CNC(C1)C(=O)O MCULE-7443555484 [0,2,0,0,0,0|1,0,0]=3 3477 B11R1.175 CN(C)[C@@H]1CN[C@@H](C1)C(=O)O MCULE-3527253805 [0,2,0,0,0,0|1,0,0]=3 3478 B11R1.175 CN(C)[C@@H]1CN[C@@H](C1)C(=O)O MCULE-7382850960 [0,2,0,0,0,0|1,0,0]=3 3479 B11R1.175 CN(C)[C@@H]1CN[C@@H](C1)C(=O)O MCULE-9623457676 [0,2,0,0,0,0|1,0,0]=3 3480 B11R1.175 CN(C)[C@@H]1CN[C@@H](C1)C(=O)O MCULE-9748302910 [0,2,0,0,0,0|1,0,0]=3 3481 B11R1.175 CN(C)[C@H]1CN[C@@H](C1)C(=O)O MCULE-2812151803 [0,2,0,0,0,0|1,0,0]=3 3482 B11R1.175 CN(C)[C@H]1CN[C@@H](C1)C(=O)O MCULE-4476087088 [0,2,0,0,0,0|1,0,0]=3 3483 B11R1.175 CN(C)[C@H]1CN[C@@H](C1)C(=O)O MCULE-7094989074 [0,2,0,0,0,0|1,0,0]=3 3484 B11R1.175 CN(C)[C@H]1CN[C@@H](C1)C(=O)O MCULE-9970516433 [0,2,0,0,0,0|1,0,0]=3 3485 B11R1.175 NC(=O)C1CCC(C1)C(=O)O MCULE-6317737981 [0,2,0,0,0,0|1,0,1]=4 3486 B11R1.175 O=C(O)C1CCC(C1)C(=O)O MCULE-5582697343 [0,2,0,0,0,0|1,0,0]=3 3487 B11R1.175 O=C(O)C1CCC(O1)C(=O)O MCULE-3136124682 [0,2,0,0,0,0|2,0,0]=4 3488 B11R1.175 O=C(O)C1CNC(C1)C(=O)O MCULE-8937278367 [0,2,0,0,0,0|0,0,0]=2 3489 B11R1.175 O=C(O)C1CSC(N1)C(=O)O MCULE-7618690294 [0,2,0,0,0,0|2,0,0]=4 3490 B11R1.175 O=C(O)[C@@H]1CC[C@@H](N1)C(=O)O MCULE-3826760511 [0,2,0,0,0,0|2,0,0]=4 3491 B11R1.175 O=C(O)[C@@H]1CC[C@@H](O1)C(=O)O MCULE-5651042358 [0,2,0,0,0,0|2,0,0]=4 3492 B11R1.175 O=C(O)[C@@H]1CC[C@H](C1)C(=O)O MCULE-4158551450 [0,2,0,0,0,0|1,0,0]=3 3493 B11R1.175 O=C(O)[C@@H]1CN[C@@H](C1)C(=O)O MCULE-1390451256 [0,2,0,0,0,0|0,0,0]=2 3494 B11R1.175 O=C(O)[C@@H]1CN[C@@H](C1)C(=O)O MCULE-7979026465 [0,2,0,0,0,0|0,0,0]=2 3495 B11R1.175 O=C(O)[C@@H]1CN[C@@H](C1)C(=O)O MCULE-9063795349 [0,2,0,0,0,0|0,0,0]=2 3496 B11R1.175 O=C(O)[C@@H]1CN[C@H](C1)C(=O)O MCULE-5420917584 [0,2,0,0,0,0|0,0,0]=2 3497 B11R1.175 O=C(O)[C@@H]1C[C@H](CN1)C(=O)O MCULE-2467535885 [0,2,0,0,0,0|0,0,0]=2 3498 B11R1.175 O=C(O)[C@H]1CC[C@@H](C1)C(=O)O MCULE-1705160233 [0,2,0,0,0,0|1,0,0]=3 3499 B11R1.175 O=C(O)[C@H]1CC[C@H](C1)C(=O)O MCULE-9410279128 [0,2,0,0,0,0|1,0,0]=3 3500 B11R1.1229 CCC1CCC(C1)(O)C(=O)O MCULE-3641341110 [0,2,0,0,0,0|2,0,0]=4 3501 B11R1.1229 COC1CNC(C1)(C)C(=O)O MCULE-1262116514 [0,2,0,0,0,0|0,0,0]=2 3502 B11R1.1229 COC1CNC(C1)(C)C(=O)O MCULE-5809003926 [0,2,0,0,0,0|0,0,0]=2 3503 B11R1.644 CC1(C[C@H](NC1=O)C(=O)O)C MCULE-2222423646 [0,2,0,0,0,0|1,0,1]=4 3504 B11R1.488 C1(CC(CN1C)(C)C)C(=O)O MCULE-6724058618 [0,2,0,0,0,0|1,0,0]=3 3505 B11R1.488 CN1CC(CC1C(=O)O)(C)C MCULE-4454904930 [0,2,0,0,0,0|1,0,0]=3 3506 B11R1.488 CN1CC(CC1C(=O)O)(F)F MCULE-2220775434 [0,2,0,0,0,0|1,0,0]=3 3507 B11R1.488 CN1CC(C[C@H]1C(=O)O)(C)C MCULE-1093985166 [0,2,0,0,0,0|1,0,0]=3 3508 B11R1.488 CN1CC(C[C@H]1C(=O)O)(C)C MCULE-9299428008 [0,2,0,0,0,0|1,0,0]=3 3509 B11R1.489 C[N+]1(C[C@@H](C[C@@H]1C(=O)[O-])O)C MCULE-1134958320 [0,2,0,0,0,0|0,0,2]=4 3510 B11R1.489 C[N+]1(C[C@@H](C[C@H]1C(=O)[O-])O)C MCULE-8422437829 [0,2,0,0,0,0|0,0,2]=4 3511 B11R1.489 C[N+]1(C[C@@H](C[C@H]1C(=O)[O-])O)C MCULE-8688546795 [0,2,0,0,0,0|0,0,2]=4 3512 B11R1.489 C[N+]1(C[C@H](C[C@@H]1C(=O)[O-])O)C MCULE-4872810769 [0,2,0,0,0,0|0,0,2]=4 3513 B11R1.490 CN1CC(CC1(C)C(=O)O)O MCULE-1198947553 [0,2,0,0,0,0|0,0,0]=2 3514 B11R1.490 CN1CC(CC1(C)C(=O)O)O MCULE-6991153536 [0,2,0,0,0,0|0,0,0]=2 3515 B11R1.738 CC1(CCC(C1)(F)F)C(=O)O MCULE-8349419788 [0,2,0,0,0,0|2,0,0]=4 3516 B11R1.738 CC1(CCC(C1)(N)C(=O)O)C MCULE-1239891143 [0,2,0,0,0,0|2,0,0]=4 3517 B11R1.738 CC1(CCC(C1)(N)C(=O)O)C MCULE-8274719221 [0,2,0,0,0,0|2,0,0]=4 3518 B11R1.738 C[C@]1(CC(CN1)(F)F)C(=O)O MCULE-7452254738 [0,2,0,0,0,0|1,0,0]=3 3519 B9R1.5 CC1NCCCNC1=O MCULE-3428365237 [0,0,1,1,0,0|2,0,0]=4 3520 B9R1.5 CC1NCCCNC1=O MCULE-7033727889 [0,0,1,1,0,0|2,0,0]=4 3521 B9R1.5 C[C@@H]1NCCCNC1=O MCULE-1934186049 [0,0,1,1,0,0|2,0,0]=4 3522 B9R1.5 C[C@@H]1NCCCNC1=O MCULE-5236470932 [0,0,1,1,0,0|2,0,0]=4 3523 B9R1.5 C[C@H]1NCCCNC1=O MCULE-1257602323 [0,0,1,1,0,0|2,0,0]=4 3524 B9R1.5 C[C@H]1NCCCNC1=O MCULE-9576161221 [0,0,1,1,0,0|2,0,0]=4 3525 B9R1.6 C1(CCCNC1)C(=O)O MCULE-5804171064 [0,0,1,1,0,0|2,0,0]=4 3526 B9R1.6 C1(CNCCN1)C(=O)O MCULE-2145678876 [0,0,1,1,0,0|1,0,0]=3 3527 B9R1.6 C1(CNCCN1)C(=O)O MCULE-9477513225 [0,0,1,1,0,0|1,0,0]=3 3528 B9R1.6 C1(COCCN1)C(=O)O MCULE-7653061162 [0,0,1,1,0,0|0,0,0]=2 3529 B9R1.6 C1(COCCN1)C(=O)O MCULE-8375563970 [0,0,1,1,0,0|0,0,0]=2 3530 B9R1.6 C=C(O)C1CNCCN1 MCULE-4032832858 [0,0,1,1,0,0|2,0,0]=4 3531 B9R1.6 C=C(O)C1CNCCN1 MCULE-7014741917 [0,0,1,1,0,0|2,0,0]=4 3532 B9R1.6 CC(=O)C1CCCCN1 MCULE-2854776557 [0,0,1,1,0,0|2,0,0]=4 3533 B9R1.6 CC(=O)C1CCCCN1 MCULE-7483298696 [0,0,1,1,0,0|2,0,0]=4 3534 B9R1.6 CC(=O)C1CCCOC1 MCULE-8355092375 [0,0,1,1,0,0|2,0,0]=4 3535 B9R1.6 CC(=O)C1COCCO1 MCULE-5168266299 [0,0,1,1,0,0|2,0,0]=4 3536 B9R1.6 CC(=O)[C@@H]1CCCCN1 MCULE-6225629414 [0,0,1,1,0,0|2,0,0]=4 3537 B9R1.6 CC(=O)[C@@H]1CCCCN1 MCULE-9308955565 [0,0,1,1,0,0|2,0,0]=4 3538 B9R1.6 CC(=O)[C@H]1CCCCN1 MCULE-6405789728 [0,0,1,1,0,0|2,0,0]=4 3539 B9R1.6 CC(=O)[C@H]1CCCCN1 MCULE-6966774576 [0,0,1,1,0,0|2,0,0]=4 3540 B9R1.6 NC(=O)C1CCCCN1 MCULE-2544126054 [0,0,1,1,0,0|2,0,0]=4 3541 B9R1.6 NC(=O)C1CCCCN1 MCULE-6661716686 [0,0,1,1,0,0|2,0,0]=4 3542 B9R1.6 NC(=O)C1CCCOC1 MCULE-3754898627 [0,0,1,1,0,0|2,0,0]=4 3543 B9R1.6 NC(=O)C1CNCCN1 MCULE-6032361805 [0,0,1,1,0,0|2,0,0]=4 3544 B9R1.6 NC(=O)C1CNCCN1 MCULE-7459621704 [0,0,1,1,0,0|2,0,0]=4 3545 B9R1.6 NC(=O)C1COCCN1 MCULE-3997305592 [0,0,1,1,0,0|1,0,0]=3 3546 B9R1.6 NC(=O)C1COCCN1 MCULE-8679226087 [0,0,1,1,0,0|1,0,0]=3 3547 B9R1.6 NC(=O)C1CSCCN1 MCULE-5519659168 [0,0,1,1,0,0|1,1,0]=4 3548 B9R1.6 NC(=O)[C@@H]1CNCCN1 MCULE-3203472135 [0,0,1,1,0,0|2,0,0]=4 3549 B9R1.6 NC(=O)[C@@H]1CNCCN1 MCULE-3866777440 [0,0,1,1,0,0|2,0,0]=4 3550 B9R1.6 NC(=O)[C@@H]1CNCCN1 MCULE-6105431602 [0,0,1,1,0,0|2,0,0]=4 3551 B9R1.6 NC(=O)[C@@H]1CNCCN1 MCULE-7727900968 [0,0,1,1,0,0|2,0,0]=4 3552 B9R1.6 NC(=O)[C@H]1CCCCN1 MCULE-5554529404 [0,0,1,1,0,0|2,0,0]=4 3553 B9R1.6 NC(=O)[C@H]1CNCCN1 MCULE-1527418805 [0,0,1,1,0,0|2,0,0]=4 3554 B9R1.6 NC(=O)[C@H]1CNCCN1 MCULE-6529490056 [0,0,1,1,0,0|2,0,0]=4 3555 B9R1.6 NC(=O)[C@H]1CNCCN1 MCULE-9894216692 [0,0,1,1,0,0|2,0,0]=4 3556 B9R1.6 NC(=O)[C@H]1COCCN1 MCULE-1904729907 [0,0,1,1,0,0|1,0,0]=3 3557 B9R1.6 NC(=O)[C@H]1COCCN1 MCULE-7069433109 [0,0,1,1,0,0|1,0,0]=3 3558 B9R1.6 NC(=O)[C@H]1COCCN1 MCULE-7970834070 [0,0,1,1,0,0|1,0,0]=3 3559 B9R1.6 NC(=O)[C@H]1COCCN1 MCULE-9117686776 [0,0,1,1,0,0|1,0,0]=3 3560 B9R1.6 O=C(O)C1=CCCOC1 MCULE-4597846034 [0,0,1,1,0,0|1,0,1]=4 3561 B9R1.6 O=C(O)C1CCCCC1 MCULE-2193918964 [0,0,1,1,0,0|2,0,0]=4 3562 B9R1.6 O=C(O)C1CCCCN1 MCULE-3485439173 [0,0,1,1,0,0|1,0,0]=3 3563 B9R1.6 O=C(O)C1CCCCN1 MCULE-4576094783 [0,0,1,1,0,0|1,0,0]=3 3564 B9R1.6 O=C(O)C1CCCCN1 MCULE-4851525706 [0,0,1,1,0,0|1,0,0]=3 3565 B9R1.6 O=C(O)C1CCCCN1 MCULE-6801625058 [0,0,1,1,0,0|1,0,0]=3 3566 B9R1.6 O=C(O)C1CCCCO1 MCULE-8947688342 [0,0,1,1,0,0|2,0,0]=4 3567 B9R1.6 O=C(O)C1CCCCS1 MCULE-6466357833 [0,0,1,1,0,0|2,0,0]=4 3568 B9R1.6 O=C(O)C1CCCNC1 MCULE-3189529983 [0,0,1,1,0,0|2,0,0]=4 3569 B9R1.6 O=C(O)C1CCCNC1 MCULE-5698100100 [0,0,1,1,0,0|2,0,0]=4 3570 B9R1.6 O=C(O)C1CCCNC1 MCULE-9486003126 [0,0,1,1,0,0|2,0,0]=4 3571 B9R1.6 O=C(O)C1CCCNN1 MCULE-1480488255 [0,0,1,1,0,0|2,0,0]=4 3572 B9R1.6 O=C(O)C1CCCNN1 MCULE-3054116225 [0,0,1,1,0,0|2,0,0]=4 3573 B9R1.6 O=C(O)C1CCCOC1 MCULE-3431951803 [0,0,1,1,0,0|1,0,0]=3 3574 B9R1.6 O=C(O)C1CCCSC1 MCULE-1777528306 [0,0,1,1,0,0|1,1,0]=4 3575 B9R1.6 O=C(O)C1CCOCN1 MCULE-2724570105 [0,0,1,1,0,0|2,0,0]=4 3576 B9R1.6 O=C(O)C1CCOCN1 MCULE-7891527992 [0,0,1,1,0,0|2,0,0]=4 3577 B9R1.6 O=C(O)C1CCSCN1 MCULE-7351632016 [0,0,1,1,0,0|2,0,0]=4 3578 B9R1.6 O=C(O)C1CCSCN1 MCULE-7786919982 [0,0,1,1,0,0|2,0,0]=4 3579 B9R1.6 O=C(O)C1CNCCN1 MCULE-2689074129 [0,0,1,1,0,0|1,0,0]=3 3580 B9R1.6 O=C(O)C1CNCCN1 MCULE-4697614875 [0,0,1,1,0,0|1,0,0]=3 3581 B9R1.6 O=C(O)C1CNCCN1 MCULE-7015381558 [0,0,1,1,0,0|1,0,0]=3 3582 B9R1.6 O=C(O)C1CNCCO1 MCULE-1106448255 [0,0,1,1,0,0|2,0,0]=4 3583 B9R1.6 O=C(O)C1CNCCO1 MCULE-5402647836 [0,0,1,1,0,0|2,0,0]=4 3584 B9R1.6 O=C(O)C1CNCCO1 MCULE-5647993069 [0,0,1,1,0,0|2,0,0]=4 3585 B9R1.6 O=C(O)C1CNCCO1 MCULE-6949638629 [0,0,1,1,0,0|2,0,0]=4 3586 B9R1.6 O=C(O)C1CNCCS1 MCULE-3981762124 [0,0,1,1,0,0|2,0,0]=4 3587 B9R1.6 O=C(O)C1CNCCS1 MCULE-4631923202 [0,0,1,1,0,0|2,0,0]=4 3588 B9R1.6 O=C(O)C1COCCN1 MCULE-2235592409 [0,0,1,1,0,0|0,0,0]=2 3589 B9R1.6 O=C(O)C1COCCN1 MCULE-6865044459 [0,0,1,1,0,0|0,0,0]=2 3590 B9R1.6 O=C(O)C1COCCO1 MCULE-3887767361 [0,0,1,1,0,0|1,0,0]=3 3591 B9R1.6 O=C(O)C1COCCO1 MCULE-6027603960 [0,0,1,1,0,0|1,0,0]=3 3592 B9R1.6 O=C(O)C1COCOC1 MCULE-4867087023 [0,0,1,1,0,0|2,0,0]=4 3593 B9R1.6 O=C(O)C1CSCCN1 MCULE-4003309722 [0,0,1,1,0,0|0,1,0]=3 3594 B9R1.6 O=C(O)C1CSCCN1 MCULE-5519716572 [0,0,1,1,0,0|0,1,0]=3 3595 B9R1.6 O=C(O)C1CSCCS1 MCULE-6267524662 [0,0,1,1,0,0|1,1,0]=4 3596 B9R1.6 O=C(O)C1NCCCS1 MCULE-7316372918 [0,0,1,1,0,0|2,0,0]=4 3597 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-3257537289 [0,0,1,1,0,0|1,0,0]=3 3598 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-7236775885 [0,0,1,1,0,0|1,0,0]=3 3599 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-8859089797 [0,0,1,1,0,0|1,0,0]=3 3600 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-9674307172 [0,0,1,1,0,0|1,0,0]=3 3601 B9R1.6 O=C(O)[C@@H]1CCCCO1 MCULE-4995364653 [0,0,1,1,0,0|2,0,0]=4 3602 B9R1.6 O=C(O)[C@@H]1CCCCO1 MCULE-8767901302 [0,0,1,1,0,0|2,0,0]=4 3603 B9R1.6 O=C(O)[C@@H]1CCCNC1 MCULE-3206278693 [0,0,1,1,0,0|2,0,0]=4 3604 B9R1.6 O=C(O)[C@@H]1CCCNC1 MCULE-5509362549 [0,0,1,1,0,0|2,0,0]=4 3605 B9R1.6 O=C(O)[C@@H]1CCCNC1 MCULE-8357747886 [0,0,1,1,0,0|2,0,0]=4 3606 B9R1.6 O=C(O)[C@@H]1CCCNC1 MCULE-9156802088 [0,0,1,1,0,0|2,0,0]=4 3607 B9R1.6 O=C(O)[C@@H]1CCCNN1 MCULE-1404699605 [0,0,1,1,0,0|2,0,0]=4 3608 B9R1.6 O=C(O)[C@@H]1CCCNN1 MCULE-4463982289 [0,0,1,1,0,0|2,0,0]=4 3609 B9R1.6 O=C(O)[C@@H]1CCCNN1 MCULE-6113826647 [0,0,1,1,0,0|2,0,0]=4 3610 B9R1.6 O=C(O)[C@@H]1CCCOC1 MCULE-8270310960 [0,0,1,1,0,0|1,0,0]=3 3611 B9R1.6 O=C(O)[C@@H]1CCCOC1 MCULE-9211958407 [0,0,1,1,0,0|1,0,0]=3 3612 B9R1.6 O=C(O)[C@@H]1CNCCN1 MCULE-2545046706 [0,0,1,1,0,0|1,0,0]=3 3613 B9R1.6 O=C(O)[C@@H]1CNCCN1 MCULE-5694807182 [0,0,1,1,0,0|1,0,0]=3 3614 B9R1.6 O=C(O)[C@@H]1CNCCN1 MCULE-7177432982 [0,0,1,1,0,0|1,0,0]=3 3615 B9R1.6 O=C(O)[C@@H]1CNCCN1 MCULE-7413709257 [0,0,1,1,0,0|1,0,0]=3 3616 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-3078161658 [0,0,1,1,0,0|2,0,0]=4 3617 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-4550123668 [0,0,1,1,0,0|2,0,0]=4 3618 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-7218215777 [0,0,1,1,0,0|2,0,0]=4 3619 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-7983160968 [0,0,1,1,0,0|2,0,0]=4 3620 B9R1.6 O=C(O)[C@@H]1CNCCS1 MCULE-6650545170 [0,0,1,1,0,0|2,0,0]=4 3621 B9R1.6 O=C(O)[C@@H]1COCCN1 MCULE-1789021231 [0,0,1,1,0,0|0,0,0]=2 3622 B9R1.6 O=C(O)[C@@H]1COCCN1 MCULE-4026574279 [0,0,1,1,0,0|0,0,0]=2 3623 B9R1.6 O=C(O)[C@@H]1COCCN1 MCULE-7736477261 [0,0,1,1,0,0|0,0,0]=2 3624 B9R1.6 O=C(O)[C@@H]1COCCN1 MCULE-8166049277 [0,0,1,1,0,0|0,0,0]=2 3625 B9R1.6 O=C(O)[C@@H]1COCCO1 MCULE-3560012987 [0,0,1,1,0,0|1,0,0]=3 3626 B9R1.6 O=C(O)[C@@H]1COCCO1 MCULE-8883141087 [0,0,1,1,0,0|1,0,0]=3 3627 B9R1.6 O=C(O)[C@@H]1CSCCN1 MCULE-3905601111 [0,0,1,1,0,0|0,1,0]=3 3628 B9R1.6 O=C(O)[C@@H]1CSCCN1 MCULE-9668825603 [0,0,1,1,0,0|0,1,0]=3 3629 B9R1.6 O=C(O)[C@@H]1CSCCN1 MCULE-9675980130 [0,0,1,1,0,0|0,1,0]=3 3630 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-8281618311 [0,0,1,1,0,0|1,0,0]=3 3631 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-8486513131 [0,0,1,1,0,0|1,0,0]=3 3632 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-9333123477 [0,0,1,1,0,0|1,0,0]=3 3633 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-9786740249 [0,0,1,1,0,0|1,0,0]=3 3634 B9R1.6 O=C(O)[C@H]1CCCCO1 MCULE-2856988466 [0,0,1,1,0,0|2,0,0]=4 3635 B9R1.6 O=C(O)[C@H]1CCCCO1 MCULE-8960602925 [0,0,1,1,0,0|2,0,0]=4 3636 B9R1.6 O=C(O)[C@H]1CCCNC1 MCULE-5644771403 [0,0,1,1,0,0|2,0,0]=4 3637 B9R1.6 O=C(O)[C@H]1CCCNC1 MCULE-6473613352 [0,0,1,1,0,0|2,0,0]=4 3638 B9R1.6 O=C(O)[C@H]1CCCNC1 MCULE-7395918259 [0,0,1,1,0,0|2,0,0]=4 3639 B9R1.6 O=C(O)[C@H]1CCCNC1 MCULE-8202628107 [0,0,1,1,0,0|2,0,0]=4 3640 B9R1.6 O=C(O)[C@H]1CCCNN1 MCULE-5460978548 [0,0,1,1,0,0|2,0,0]=4 3641 B9R1.6 O=C(O)[C@H]1CCCNN1 MCULE-6296084302 [0,0,1,1,0,0|2,0,0]=4 3642 B9R1.6 O=C(O)[C@H]1CCCOC1 MCULE-3913162278 [0,0,1,1,0,0|1,0,0]=3 3643 B9R1.6 O=C(O)[C@H]1CCCOC1 MCULE-4021468329 [0,0,1,1,0,0|1,0,0]=3 3644 B9R1.6 O=C(O)[C@H]1CCCSC1 MCULE-1373166628 [0,0,1,1,0,0|1,1,0]=4 3645 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-2073761586 [0,0,1,1,0,0|1,0,0]=3 3646 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-3099021896 [0,0,1,1,0,0|1,0,0]=3 3647 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-5862899979 [0,0,1,1,0,0|1,0,0]=3 3648 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-8591926633 [0,0,1,1,0,0|1,0,0]=3 3649 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-9781518658 [0,0,1,1,0,0|1,0,0]=3 3650 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-1051281674 [0,0,1,1,0,0|2,0,0]=4 3651 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-2477891803 [0,0,1,1,0,0|2,0,0]=4 3652 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-5182952887 [0,0,1,1,0,0|2,0,0]=4 3653 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-6051376580 [0,0,1,1,0,0|2,0,0]=4 3654 B9R1.6 O=C(O)[C@H]1CNCCS1 MCULE-7818958113 [0,0,1,1,0,0|2,0,0]=4 3655 B9R1.6 O=C(O)[C@H]1COCCN1 MCULE-2388461804 [0,0,1,1,0,0|0,0,0]=2 3656 B9R1.6 O=C(O)[C@H]1COCCN1 MCULE-3810653827 [0,0,1,1,0,0|0,0,0]=2 3657 B9R1.6 O=C(O)[C@H]1COCCN1 MCULE-6589310258 [0,0,1,1,0,0|0,0,0]=2 3658 B9R1.6 O=C(O)[C@H]1COCCN1 MCULE-9158991594 [0,0,1,1,0,0|0,0,0]=2 3659 B9R1.6 O=C(O)[C@H]1COCCO1 MCULE-6591475838 [0,0,1,1,0,0|1,0,0]=3 3660 B9R1.6 O=C(O)[C@H]1COCCO1 MCULE-9849453248 [0,0,1,1,0,0|1,0,0]=3 3661 B9R1.6 O=C(O)[C@H]1CSCCN1 MCULE-2174373928 [0,0,1,1,0,0|0,1,0]=3 3662 B9R1.6 O=C(O)[C@H]1CSCCN1 MCULE-5936347595 [0,0,1,1,0,0|0,1,0]=3 3663 B9R1.6 O=C(O)[C@H]1CSCCN1 MCULE-8464504119 [0,0,1,1,0,0|0,1,0]=3 3664 B9R1.6 O=C([O-])C1CCCCN1 MCULE-2358540296 [0,0,1,1,0,0|1,0,1]=4 3665 B9R1.6 [C@H]1(CSCCN1)C(=O)O MCULE-2592294388 [0,0,1,1,0,0|0,1,0]=3 3666 B9R1.59 CCCC1CC1C(=O)O MCULE-5011491615 [0,0,1,1,0,0|2,0,0]=4 3667 B9R1.59 CCC[C@@H]1C[C@@H]1C(=O)O MCULE-8208745989 [0,0,1,1,0,0|2,0,0]=4 3668 B9R1.59 CCC[C@@H]1C[C@H]1C(=O)O MCULE-1448060038 [0,0,1,1,0,0|2,0,0]=4 3669 B9R1.59 CCC[C@H]1C[C@H]1C(=O)O MCULE-6634735984 [0,0,1,1,0,0|2,0,0]=4 3670 B9R1.69 C[C@@H]1NC[C@H](NC1=O)C MCULE-1197510372 [0,0,1,1,0,0|2,0,0]=4 3671 B9R1.69 C[C@@H]1NC[C@H](NC1=O)C MCULE-1474096689 [0,0,1,1,0,0|2,0,0]=4 3672 B9R1.69 C[C@@H]1NC[C@H](NC1=O)C MCULE-4763044155 [0,0,1,1,0,0|2,0,0]=4 3673 B9R1.69 C[C@@H]1NC[C@H](NC1=O)C MCULE-8537746266 [0,0,1,1,0,0|2,0,0]=4 3674 B9R1.110 CC(C(=O)O)C1CCC1 MCULE-1352377374 [0,0,1,1,0,0|2,0,0]=4 3675 B9R1.110 CC(C(=O)O)C1CCC1 MCULE-3278183132 [0,0,1,1,0,0|2,0,0]=4 3676 B9R1.110 CC(C(=O)O)C1CCO1 MCULE-4481804660 [0,0,1,1,0,0|1,0,0]=3 3677 B9R1.110 CC(C(=O)O)N1CCC1 MCULE-9923940575 [0,0,1,1,0,0|1,0,0]=3 3678 B9R1.112 CC(CC1CC1)C(=O)O MCULE-6769587353 [0,0,1,1,0,0|2,0,0]=4 3679 B9R1.112 CC(SC1CC1)C(=O)O MCULE-6918133296 [0,0,1,1,0,0|2,0,0]=4 3680 B9R1.112 C[C@H](NC1CC1)C(=O)O MCULE-2919785082 [0,0,1,1,0,0|1,0,0]=3 3681 B9R1.112 C[C@H](NC1CC1)C(=O)O MCULE-4729598853 [0,0,1,1,0,0|1,0,0]=3 3682 B9R1.1 NCC1CCC(=O)CC1 MCULE-6777974410 [0,0,1,1,0,0|2,0,0]=4 3683 B9R1.1 NCC1CCC(=O)CC1 MCULE-8440793392 [0,0,1,1,0,0|2,0,0]=4 3684 B9R1.1 NCC1CCC(=O)NC1 MCULE-5893065665 [0,0,1,1,0,0|2,0,0]=4 3685 B9R1.1 NCC1CCC(=O)NC1 MCULE-9881642861 [0,0,1,1,0,0|2,0,0]=4 3686 B9R1.1 NCC1CCC(CO1)O MCULE-3286854000 [0,0,1,1,0,0|1,0,1]=4 3687 B9R1.1 NCC1CNC(=O)CO1 MCULE-1373630821 [0,0,1,1,0,0|2,0,0]=4 3688 B9R1.1 NCC1CNC(=O)CO1 MCULE-2564136433 [0,0,1,1,0,0|2,0,0]=4 3689 B9R1.1 NC[C@H]1CCC(=O)NC1 MCULE-9489755430 [0,0,1,1,0,0|2,0,0]=4 3690 B9R1.84 O=C(O)CCC1CCC1 MCULE-5780532364 [0,0,1,1,0,0|2,0,0]=4 3691 B9R1.84 O=C(O)COC1CNC1 MCULE-6412418210 [0,0,1,1,0,0|2,0,0]=4 3692 B9R1.86 CCC1CC1CC(=O)O MCULE-9659162510 [0,0,1,1,0,0|2,0,0]=4 3693 B9R1.127 CCC1(CC1C(=O)O)C MCULE-5907126944 [0,0,1,1,0,0|2,0,0]=4 3694 B9R1.147 CC1(CC1)CCC(=O)O MCULE-7141144115 [0,0,1,1,0,0|2,0,0]=4 3695 B9R1.147 O=C(O)CCC1(CC1)O MCULE-2890628610 [0,0,1,1,0,0|1,0,0]=3 3696 B9R1.15 CCC1CCCOC1=O MCULE-7711682964 [0,0,1,1,0,0|2,0,0]=4 3697 B9R1.15 CCC1CCOCC1=O MCULE-6091403730 [0,0,1,1,0,0|2,0,0]=4 3698 B9R1.15 CNC1CCCCC1=O MCULE-4213094446 [0,0,1,1,0,0|2,0,0]=4 3699 B9R1.15 CNC1CCCCC1=O MCULE-6828302325 [0,0,1,1,0,0|2,0,0]=4 3700 B9R1.15 CNC1CCCNC1=O MCULE-5728861814 [0,0,1,1,0,0|2,0,0]=4 3701 B9R1.15 CNC1CCCNC1=O MCULE-6142186918 [0,0,1,1,0,0|2,0,0]=4 3702 B9R1.33 O=C1NCCC1CCO MCULE-4049375641 [0,0,1,1,0,0|2,0,0]=4 3703 B9R1.33 O=C1OCCC1CCBr MCULE-8450575724 [0,0,1,1,0,0|2,0,0]=4 3704 B9R1.33 O=C1OCCN1CCO MCULE-9126918441 [0,0,1,1,0,0|2,0,0]=4 3705 B9R1.116 CNC(C(=O)N)C1CC1 MCULE-8533863121 [0,0,1,1,0,0|2,0,0]=4 3706 B9R1.116 CNC(C(=O)O)C1CC1 MCULE-7436139771 [0,0,1,1,0,0|1,0,0]=3 3707 B9R1.116 COC(C(=O)O)C1CC1 MCULE-8084470877 [0,0,1,1,0,0|2,0,0]=4 3708 B9R1.119 CCC1(CCC1)C(=O)O MCULE-8472500117 [0,0,1,1,0,0|2,0,0]=4 3709 B9R1.119 CCC1(CCO1)C(=O)O MCULE-9145728118 [0,0,1,1,0,0|1,0,0]=3 3710 B9R1.119 CC[C@]1(CCO1)C(=O)O MCULE-5752888055 [0,0,1,1,0,0|1,0,0]=3 3711 B9R1.119 CNC1(CCC1)C(=O)N MCULE-9618501617 [0,0,1,1,0,0|2,0,0]=4 3712 B9R1.119 CNC1(CCC1)C(=O)O MCULE-3757495053 [0,0,1,1,0,0|1,0,0]=3 3713 B9R1.119 CNC1(CCC1)C(=O)O MCULE-4024637716 [0,0,1,1,0,0|1,0,0]=3 3714 B9R1.119 CNC1(CNC1)C(=O)O MCULE-2429867360 [0,0,1,1,0,0|2,0,0]=4 3715 B9R1.119 CNC1(CNC1)C(=O)O MCULE-6668272665 [0,0,1,1,0,0|2,0,0]=4 3716 B9R1.119 CNC1(COC1)C(=O)O MCULE-5428851378 [0,0,1,1,0,0|2,0,0]=4 3717 B9R1.119 COC1(CCC1)C(=O)O MCULE-5969292821 [0,0,1,1,0,0|2,0,0]=4 3718 B9R1.119 CSC1(CCC1)C(=O)O MCULE-8804902018 [0,0,1,1,0,0|2,0,0]=4 3719 B9R1.130 CC[C@]1(C[C@@H]1F)C(=O)O MCULE-7765739144 [0,0,1,1,0,0|2,0,0]=4 3720 B9R1.130 CC[C@]1(C[C@H]1F)C(=O)O MCULE-6558255104 [0,0,1,1,0,0|2,0,0]=4 3721 B9R1.130 CC[C@]1(C[C@H]1F)C(=O)O MCULE-9949603359 [0,0,1,1,0,0|2,0,0]=4 3722 B9R1.179 CCCC1(CC1)C(=O)O MCULE-3737695448 [0,0,1,1,0,0|2,0,0]=4 3723 B9R1.179 NCCC1(CC1)C(=O)O MCULE-1732909908 [0,0,1,1,0,0|2,0,0]=4 3724 B9R1.179 NCCC1(CC1)C(=O)O MCULE-7079307522 [0,0,1,1,0,0|2,0,0]=4 3725 B9R1.179 O=C(O)C1(CC1)CCCl MCULE-8895296339 [0,0,1,1,0,0|2,0,0]=4 3726 B9R1.179 O=C(O)C1(CC1)CCF MCULE-7598361699 [0,0,1,1,0,0|2,0,0]=4 3727 B9R1.179 O=C(O)C1(CC1)CCO MCULE-4706234979 [0,0,1,1,0,0|1,0,0]=3 3728 B9R1.36 CC1(CC(C(=O)O1)N)C MCULE-7823096614 [0,0,1,1,0,0|1,0,0]=3 3729 B9R1.36 CC1(CC(C(=O)O1)N)C MCULE-8973330971 [0,0,1,1,0,0|1,0,0]=3 3730 B9R1.161 CC(C)C1CC1C(=O)O MCULE-4298027549 [0,0,1,1,0,0|2,0,0]=4 3731 B9R1.53 CC1CC(C1)CC(=O)O MCULE-1823232756 [0,0,1,1,0,0|2,0,0]=4 3732 B9R1.53 NC1CC(C1)CC(=O)O MCULE-1535901081 [0,0,1,1,0,0|2,0,0]=4 3733 B9R1.53 NC1CC(C1)CC(=O)O MCULE-4536482207 [0,0,1,1,0,0|2,0,0]=4 3734 B9R1.53 N[C@H]1C[C@@H](C1)CC(=O)O MCULE-2333675175 [0,0,1,1,0,0|2,0,0]=4 3735 B9R1.53 N[C@H]1C[C@@H](C1)CC(=O)O MCULE-3710409300 [0,0,1,1,0,0|2,0,0]=4 3736 B9R1.53 N[C@H]1C[C@H](C1)CC(=O)O MCULE-1039324799 [0,0,1,1,0,0|2,0,0]=4 3737 B9R1.53 N[C@H]1C[C@H](C1)CC(=O)O MCULE-3309485111 [0,0,1,1,0,0|2,0,0]=4 3738 B9R1.53 O=C(O)CC1CC(C1)F MCULE-2736771844 [0,0,1,1,0,0|2,0,0]=4 3739 B9R1.66 CC1(CNCC(=O)N1)C MCULE-1640277430 [0,0,1,1,0,0|2,0,0]=4 3740 B9R1.66 CC1(CNCC(=O)N1)C MCULE-6894196220 [0,0,1,1,0,0|2,0,0]=4 3741 B9R1.85 O=C(O)CCCC1CC1 MCULE-4019156455 [0,0,1,1,0,0|2,0,0]=4 3742 B9R1.85 O=C(O)CNCC1CC1 MCULE-2914571109 [0,0,1,1,0,0|1,0,0]=3 3743 B9R1.85 O=C(O)CNCC1CC1 MCULE-8479764724 [0,0,1,1,0,0|1,0,0]=3 3744 B9R1.85 O=C(O)COCC1CC1 MCULE-1838251623 [0,0,1,1,0,0|2,0,0]=4 3745 B9R1.85 O=C(O)CSCC1CC1 MCULE-7765855577 [0,0,1,1,0,0|2,0,0]=4 3746 B9R2.39 C12CNC(C1)C(=O)O2 MCULE-4651135224 [1,0,0,1,0,0|0,0,0]=2 3747 B9R2.39 O=C1CC2CCC1C2 MCULE-2467634489 [1,0,0,1,0,0|2,0,0]=4 3748 B9R2.39 O=C1CC2CNC1C2 MCULE-1302527504 [1,0,0,1,0,0|1,0,0]=3 3749 B9R2.39 O=C1CC2CNC1C2 MCULE-3367580397 [1,0,0,1,0,0|1,0,0]=3 3750 B9R2.39 O=C1C[C@@H]2CC[C@H]1C2 MCULE-9992741520 [1,0,0,1,0,0|2,0,0]=4 3751 B9R2.39 O=C1C[C@H]2CC[C@@H]1C2 MCULE-2228698965 [1,0,0,1,0,0|2,0,0]=4 3752 B9R2.39 O=C1NC2CCC1C2 MCULE-2050587567 [1,0,0,1,0,0|2,0,0]=4 3753 B9R2.39 O=C1N[C@@H]2CC[C@H]1C2 MCULE-2601085316 [1,0,0,1,0,0|2,0,0]=4 3754 B9R2.39 O=C1N[C@@H]2CN[C@H]1C2 MCULE-6049411288 [1,0,0,1,0,0|1,0,0]=3 3755 B9R2.39 O=C1N[C@@H]2CN[C@H]1C2 MCULE-7775612507 [1,0,0,1,0,0|1,0,0]=3 3756 B9R2.39 O=C1N[C@H]2CC[C@@H]1C2 MCULE-6863863448 [1,0,0,1,0,0|2,0,0]=4 3757 B9R2.39 O=C1OC2CNC1C2 MCULE-1081203973 [1,0,0,1,0,0|0,0,0]=2 3758 B9R2.39 O=C1OC2CNC1C2 MCULE-4715019258 [1,0,0,1,0,0|0,0,0]=2 3759 B9R2.39 O=C1O[C@@H]2CN[C@H]1C2 MCULE-1020161730 [1,0,0,1,0,0|0,0,0]=2 3760 B9R2.39 O=C1O[C@@H]2CN[C@H]1C2 MCULE-3837738406 [1,0,0,1,0,0|0,0,0]=2 3761 B9R2.39 O=C1O[C@@H]2CN[C@H]1C2 MCULE-6980885310 [1,0,0,1,0,0|0,0,0]=2 3762 B9R2.39 OC1CC2C=CC1C2 MCULE-4941839757 [1,0,0,1,0,0|2,0,0]=4 3763 B9R2.39 OC1CC2CCC1N2 MCULE-1605436075 [1,0,0,1,0,0|1,0,1]=4 3764 B9R2.39 OC1CC2CCC1N2 MCULE-1761281414 [1,0,0,1,0,0|1,0,1]=4 3765 B9R2.39 OC1CC2CNC1C2 MCULE-2749316886 [1,0,0,1,0,0|1,0,1]=4 3766 B9R2.39 OC1CC2CNC1C2 MCULE-4966948452 [1,0,0,1,0,0|1,0,1]=4 3767 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1N2 MCULE-3144398733 [1,0,0,1,0,0|1,0,1]=4 3768 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1N2 MCULE-7894832313 [1,0,0,1,0,0|1,0,1]=4 3769 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1N2 MCULE-1633391346 [1,0,0,1,0,0|1,0,1]=4 3770 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1N2 MCULE-9461548760 [1,0,0,1,0,0|1,0,1]=4 3771 B9R2.39 O[C@H]1C[C@@H]2CN[C@H]1C2 MCULE-1159886921 [1,0,0,1,0,0|1,0,1]=4 3772 B9R2.39 O[C@H]1C[C@@H]2CN[C@H]1C2 MCULE-6982071164 [1,0,0,1,0,0|1,0,1]=4 3773 B9R2.39 O[C@H]1C[C@H]2CN[C@@H]1C2 MCULE-4495352435 [1,0,0,1,0,0|1,0,1]=4 3774 B9R2.39 O[C@H]1C[C@H]2CN[C@@H]1C2 MCULE-6073992216 [1,0,0,1,0,0|1,0,1]=4 3775 B9R2.39 [C@@H]12CC[C@@H](N1)[C@@H](C2)O MCULE-3428651950 [1,0,0,1,0,0|1,0,1]=4 3776 B9R2.39 [C@@H]12CC[C@@H](N1)[C@@H](C2)O MCULE-5974580174 [1,0,0,1,0,0|1,0,1]=4 3777 B9R2.39 [C@@H]12CC[C@@H](N1)[C@@H](C2)O MCULE-6305413134 [1,0,0,1,0,0|1,0,1]=4 3778 B9R2.39 [C@@H]12CC[C@@H](N1)[C@@H](C2)O MCULE-7062654568 [1,0,0,1,0,0|1,0,1]=4 3779 B9R2.39 [C@@H]12CC[C@@H](N1)[C@H](C2)O MCULE-4291985781 [1,0,0,1,0,0|1,0,1]=4 3780 B9R2.39 [C@@H]12CC[C@@H](N1)[C@H](C2)O MCULE-8663774893 [1,0,0,1,0,0|1,0,1]=4 3781 B9R2.39 [C@@H]12CN[C@@H](C1)C(=O)O2 MCULE-4857421267 [1,0,0,1,0,0|0,0,0]=2 3782 B9R2.39 [C@@H]12CN[C@@H](C1)C(=O)O2 MCULE-5314520254 [1,0,0,1,0,0|0,0,0]=2 3783 B9R2.39 [C@@H]12CN[C@@H](C1)C(=O)O2 MCULE-8592680797 [1,0,0,1,0,0|0,0,0]=2 3784 B9R2.39 [C@H]12C=C[C@H](C1)C(C2)O MCULE-3338276421 [1,0,0,1,0,0|2,0,0]=4 3785 B9R2.39 [C@H]12CC[C@H](C1)C(=O)N2 MCULE-3838940137 [1,0,0,1,0,0|2,0,0]=4 3786 B9R2.39 [C@H]12CC[C@H](C1)CC2=O MCULE-1488894938 [1,0,0,1,0,0|2,0,0]=4 3787 B9R2.47 O=CC1CC2CC2C1 MCULE-3086245534 [1,0,0,1,0,0|2,0,0]=4 3788 B9R2.61 OCC12CC(C1)CN2 MCULE-5338704221 [1,0,0,1,0,0|1,0,1]=4 3789 B9R2.61 OCC12CC(C1)CN2 MCULE-9335953299 [1,0,0,1,0,0|1,0,1]=4 3790 B9R2.68 C1CC2CC(O1)CN2 MCULE-3865024029 [1,0,0,1,0,0|1,0,1]=4 3791 B9R2.68 C1CC2CC(O1)CN2 MCULE-8660013017 [1,0,0,1,0,0|1,0,1]=4 3792 B9R2.70 C12CNC(C1C2)CO MCULE-4394798761 [1,0,0,1,0,0|1,0,1]=4 3793 B9R2.70 C12CNC(C1C2)CO MCULE-8368311568 [1,0,0,1,0,0|1,0,1]=4 3794 B9R2.70 [C@@H]1(NC[C@H]2[C@@H]1C2)CO MCULE-3868037858 [1,0,0,1,0,0|1,0,1]=4 3795 B9R2.70 [C@@H]1(NC[C@H]2[C@@H]1C2)CO MCULE-9214226537 [1,0,0,1,0,0|1,0,1]=4 3796 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-1920097396 [1,0,0,1,0,0|1,0,1]=4 3797 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-2926228582 [1,0,0,1,0,0|1,0,1]=4 3798 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-4595239988 [1,0,0,1,0,0|1,0,1]=4 3799 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-7784163101 [1,0,0,1,0,0|1,0,1]=4 3800 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-8164622872 [1,0,0,1,0,0|1,0,1]=4 3801 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-9132252654 [1,0,0,1,0,0|1,0,1]=4 3802 B9R2.70 [C@H]12C[C@H]1CN[C@@H]2CO MCULE-2610856714 [1,0,0,1,0,0|1,0,1]=4 3803 B9R2.70 [C@H]12C[C@H]1CN[C@@H]2CO MCULE-5772132528 [1,0,0,1,0,0|1,0,1]=4 3804 B9R2.70 [C@H]12C[C@H]1CN[C@@H]2CO MCULE-8152584888 [1,0,0,1,0,0|1,0,1]=4 3805 B9R2.70 [C@H]12C[C@H]1CN[C@@H]2CO MCULE-8708552456 [1,0,0,1,0,0|1,0,1]=4 3806 B9R2.110 CC12CNC(C1)CO2 MCULE-8579051024 [1,0,0,1,0,0|1,0,1]=4 3807 B9R2.7 O=C1CC2C1NCC2 MCULE-5565431334 [1,0,0,1,0,0|1,0,0]=3 3808 B9R2.7 O=C1CC2C1NCC2 MCULE-8877801710 [1,0,0,1,0,0|1,0,0]=3 3809 B9R2.7 O=C1CC2C1OCC2 MCULE-9845403948 [1,0,0,1,0,0|2,0,0]=4 3810 B9R2.7 O=C1C[C@H]2[C@@H]1OCC2 MCULE-7616272357 [1,0,0,1,0,0|2,0,0]=4 3811 B9R2.7 O=C1NC2C1CCC2 MCULE-4665683392 [1,0,0,1,0,0|2,0,0]=4 3812 B9R2.7 O=C1N[C@@H]2[C@H]1CCC2 MCULE-6354748107 [1,0,0,1,0,0|2,0,0]=4 3813 B9R2.7 OC1CC2C1NCC2 MCULE-1724056091 [1,0,0,1,0,0|1,0,1]=4 3814 B9R2.7 OC1CC2C1NCC2 MCULE-4088023944 [1,0,0,1,0,0|1,0,1]=4 3815 B9R2.7 [C@@H]12CCO[C@@H]1C(=O)C2 MCULE-8869936364 [1,0,0,1,0,0|2,0,0]=4 3816 B9R2.7 [C@H]12CCC[C@H]1NC2=O MCULE-8553168635 [1,0,0,1,0,0|2,0,0]=4 3817 B9R2.148 O=C(O)C1C2C1CC2 MCULE-2273094599 [1,0,0,1,0,0|1,0,0]=3 3818 B9R2.148 O=C(O)C1C2C1NC2 MCULE-5026622210 [1,0,0,1,0,0|2,0,0]=4 3819 B9R2.19 O=C1CCC2CC1C2 MCULE-7777720832 [0,0,0,1,1,0|2,0,0]=4 3820 B9R2.19 O=C1NCC2CC1C2 MCULE-1404448235 [0,0,0,1,1,0|2,0,0]=4 3821 B9R2.19 O=C1NCC2CC1N2 MCULE-4322893965 [0,0,0,1,1,0|2,0,0]=4 3822 B9R2.145 CC(=O)C12CC(C1)C2 MCULE-4306075078 [0,0,0,1,1,0|2,0,0]=4 3823 B9R2.145 NC(=O)C12CC(C1)C2 MCULE-6296637670 [0,0,0,1,1,0|2,0,0]=4 3824 B9R2.145 O=C(O)C12CC(C1)C2 MCULE-3144378973 [0,0,0,1,1,0|1,0,0]=3 3825 B11R2.68 O=C1OC2CC1CCC2Br MCULE-7626914072 [0,0,0,1,0,1|2,0,0]=4 3826 B11R2.68 O=C1O[C@@H]2CC1CC[C@H]2I MCULE-6993806994 [0,0,0,1,0,1|2,0,0]=4 3827 B11R2.68 O[C@@H]1CC[C@@H]2N[C@H]1C[C@H]2O MCULE-9168113282 [0,0,0,1,0,1|1,0,1]=4 3828 B11R2.564 NC1C2C1CC(C2)C(=O)O MCULE-3977960580 [0,0,0,1,0,1|2,0,0]=4 3829 B11R2.564 NC1C2C1CC(C2)C(=O)O MCULE-6176990589 [0,0,0,1,0,1|2,0,0]=4 3830 B11R2.564 NC1C2C1CC(C2)C(=O)O MCULE-9184232184 [0,0,0,1,0,1|2,0,0]=4 3831 B11R2.821 [C@@H]12CC[C@@H]([C@@H](C1)N2)C(=O)O MCULE-4969323707 [0,0,0,1,0,1|2,0,0]=4 3832 B11R2.839 O=C(O)C1CCC2CC2C1 MCULE-9539219207 [0,0,0,1,0,1|2,0,0]=4 3833 B11R2.1839 O=C(O)C12CCC(C1)CC2 MCULE-6630732907 [0,0,0,1,0,1|2,0,0]=4 3834 B11R2.1839 O=C(O)C12CCC(C1)CN2 MCULE-5678506531 [0,0,0,1,0,1|1,0,0]=3 3835 B11R2.1839 O=C(O)C12CCC(C1)CN2 MCULE-7284735604 [0,0,0,1,0,1|1,0,0]=3 3836 B11R2.1839 O=C(O)C12CCC(N1)CC2 MCULE-3118230770 [0,0,0,1,0,1|2,0,0]=4 3837 B11R2.1839 O=C(O)C12CCC(N1)CC2 MCULE-9332995177 [0,0,0,1,0,1|2,0,0]=4 3838 B11R2.1839 O=C(O)C12CCC(O1)CC2 MCULE-3125021989 [0,0,0,1,0,1|1,0,0]=3 3839 B11R2.1839 [C@@H]12CCC(C1)(CN2)C(=O)O MCULE-4354063940 [0,0,0,1,0,1|2,0,0]=4 3840 B11R2.1839 [C@@H]12CCC(C1)(CN2)C(=O)O MCULE-8094375931 [0,0,0,1,0,1|2,0,0]=4 3841 B11R2.1839 [C@H]12CCC(C1)(CN2)C(=O)O MCULE-1269384340 [0,0,0,1,0,1|2,0,0]=4 3842 B11R2.1839 [C@H]12CCC(C1)(CN2)C(=O)O MCULE-9709707983 [0,0,0,1,0,1|2,0,0]=4 3843 B11R2.845 O=C(O)C1CC2CCC1C2 MCULE-2105378214 [0,0,0,1,0,1|2,0,0]=4 3844 B11R2.845 O=C(O)C1CC2CCC1C2 MCULE-5033425758 [0,0,0,1,0,1|2,0,0]=4 3845 B11R2.845 O=C(O)C1CC2CNC1C2 MCULE-4741023802 [0,0,0,1,0,1|1,0,0]=3 3846 B11R2.845 O=C(O)C1CC2CNC1C2 MCULE-8094602403 [0,0,0,1,0,1|1,0,0]=3 3847 B11R2.845 O=C(O)C1NC2CCC1C2 MCULE-2419483992 [0,0,0,1,0,1|2,0,0]=4 3848 B11R2.845 O=C(O)C1NC2CCC1C2 MCULE-4216750988 [0,0,0,1,0,1|2,0,0]=4 3849 B11R2.845 O=C(O)C1NC2CCC1C2 MCULE-7576433397 [0,0,0,1,0,1|2,0,0]=4 3850 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@@H]1C2 MCULE-1749677274 [0,0,0,1,0,1|2,0,0]=4 3851 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@@H]1C2 MCULE-6361507980 [0,0,0,1,0,1|2,0,0]=4 3852 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@H]1C2 MCULE-8988709359 [0,0,0,1,0,1|2,0,0]=4 3853 B11R2.845 O=C(O)[C@H]1C[C@H]2CC[C@@H]1C2 MCULE-4397167204 [0,0,0,1,0,1|2,0,0]=4 3854 B11R2.845 O=C(O)[C@H]1N[C@@H]2CC[C@H]1C2 MCULE-5294641154 [0,0,0,1,0,1|2,0,0]=4 3855 B11R2.845 [C@@H]12CC[C@@H](C1)C(C2)C(=O)O MCULE-7685177551 [0,0,0,1,0,1|2,0,0]=4 3856 B11R2.845 [C@@H]12CC[C@@H](C1)C(C2)C(=O)O MCULE-9283430685 [0,0,0,1,0,1|2,0,0]=4 3857 B11R2.845 [C@@H]12CC[C@H](C1)[C@H](N2)C(=O)O MCULE-2373068137 [0,0,0,1,0,1|2,0,0]=4 3858 B11R2.845 [C@H]12CC[C@H](C1)N[C@@H]2C(=O)O MCULE-2807014544 [0,0,0,1,0,1|2,0,0]=4 3859 B11R2.845 [C@H]12CC[C@H](C1)N[C@@H]2C(=O)O MCULE-8789224031 [0,0,0,1,0,1|2,0,0]=4 3860 B11R2.845 [C@H]12CC[C@H](C1)[C@@H](C2)C(=O)O MCULE-5848404845 [0,0,0,1,0,1|2,0,0]=4 3861 B11R2.845 [C@H]12CC[C@H](C1)[C@@H](N2)C(=O)O MCULE-6558374948 [0,0,0,1,0,1|2,0,0]=4 3862 B11R2.845 [C@H]12CC[C@H](C1)[C@@H](N2)C(=O)O MCULE-6979068312 [0,0,0,1,0,1|2,0,0]=4 3863 B11R2.845 [C@H]12CC[C@H](C1)[C@@H](N2)C(=O)O MCULE-7785103775 [0,0,0,1,0,1|2,0,0]=4 3864 B11R2.845 [C@H]12CC[C@H](C1)[C@@H](N2)C(=O)O MCULE-9975397997 [0,0,0,1,0,1|2,0,0]=4 3865 B11R2.932 O=C(O)CC1CCC2C1C2 MCULE-5939746375 [0,0,0,1,0,1|2,0,0]=4 3866 B11R2.411 N[C@@H]1C[C@H]2C[C@]2(C1)C(=O)O MCULE-2111082325 [0,0,0,1,0,1|2,0,0]=4 3867 B11R2.411 N[C@@H]1C[C@H]2C[C@]2(C1)C(=O)O MCULE-4355305095 [0,0,0,1,0,1|2,0,0]=4 3868 B11R2.1826 O=C(O)C12CC(C1)CCN2 MCULE-2027717821 [0,0,0,1,0,1|1,0,0]=3 3869 B11R2.1826 O=C(O)C12CC(C1)CCN2 MCULE-3937212667 [0,0,0,1,0,1|1,0,0]=3 3870 B11R2.1826 O=C(O)C12CCCC(C1)C2 MCULE-1931429837 [0,0,0,1,0,1|2,0,0]=4 3871 B11R2.1826 O=C(O)C12CNCC(C1)C2 MCULE-1943461113 [0,0,0,1,0,1|1,0,0]=3 3872 B11R2.1826 O=C(O)C12CNCC(C1)C2 MCULE-5658280461 [0,0,0,1,0,1|1,0,0]=3 3873 B11R2.1837 O=C(O)C1CCCC2C1C2 MCULE-3545310305 [0,0,0,1,0,1|2,0,0]=4 3874 B11R2.1837 O=C(O)C1NCCC2C1C2 MCULE-7549040679 [0,0,0,1,0,1|1,0,0]=3 3875 B11R2.1837 O=C(O)C1NCCC2C1C2 MCULE-8003320761 [0,0,0,1,0,1|1,0,0]=3 3876 B11R2.1837 O=C(O)[C@@H]1NCC[C@H]2[C@@H]1C2 MCULE-5605484677 [0,0,0,1,0,1|1,0,0]=3 3877 B11R2.1837 O=C(O)[C@@H]1NCC[C@H]2[C@@H]1C2 MCULE-8372319730 [0,0,0,1,0,1|1,0,0]=3 3878 B11R2.1837 O=C(O)[C@H]1NCC[C@@H]2[C@H]1C2 MCULE-3959784629 [0,0,0,1,0,1|1,0,0]=3 3879 B11R2.1837 O=C(O)[C@H]1NCC[C@@H]2[C@H]1C2 MCULE-9660720209 [0,0,0,1,0,1|1,0,0]=3 3880 B11R2.1837 O=C(O)[C@H]1NCC[C@H]2[C@@H]1C2 MCULE-2415102953 [0,0,0,1,0,1|1,0,0]=3 3881 B11R2.1837 O=C(O)[C@H]1NCC[C@H]2[C@@H]1C2 MCULE-3447611520 [0,0,0,1,0,1|1,0,0]=3 3882 B11R2.1837 [C@@H]12CCNC([C@@H]1C2)C(=O)O MCULE-1481596159 [0,0,0,1,0,1|1,0,0]=3 3883 B11R2.1837 [C@@H]12CCNC([C@@H]1C2)C(=O)O MCULE-3526088768 [0,0,0,1,0,1|1,0,0]=3 3884 B11R2.1837 [C@H]12CCNC([C@@H]1C2)C(=O)O MCULE-1555944016 [0,0,0,1,0,1|1,0,0]=3 3885 B11R2.1837 [C@H]12CCNC([C@@H]1C2)C(=O)O MCULE-5915776174 [0,0,0,1,0,1|1,0,0]=3 3886 B11R2.1837 [C@H]12CCN[C@H]([C@H]1C2)C(=O)O MCULE-8519514554 [0,0,0,1,0,1|1,0,0]=3 3887 B11R2.1837 [C@H]12CCN[C@H]([C@H]1C2)C(=O)O MCULE-8683744573 [0,0,0,1,0,1|1,0,0]=3 3888 B11R2.162 O=C1CC2CC1CC2CO MCULE-5306151281 [0,1,0,1,0,0|2,0,0]=4 3889 B11R2.738 O=C1NC2CC1C(C2O)O MCULE-9230685797 [0,1,0,1,0,0|2,0,0]=4 3890 B11R2.738 O=C1N[C@@H]2C[C@H]1[C@H]([C@H]2O)O MCULE-7928317676 [0,1,0,1,0,0|2,0,0]=4 3891 B11R2.901 COC(=O)C12CC(C1)CN2 MCULE-3579167897 [0,1,0,1,0,0|1,0,0]=3 3892 B11R2.901 COC(=O)C12CC(C1)CN2 MCULE-8134587320 [0,1,0,1,0,0|1,0,0]=3 3893 B11R2.911 C12CNC(C1C2)C(=O)OC MCULE-1898138848 [0,1,0,1,0,0|1,0,0]=3 3894 B11R2.911 C12CNC(C1C2)C(=O)OC MCULE-2593369815 [0,1,0,1,0,0|1,0,0]=3 3895 B11R2.911 COC(=O)[C@H]1NC[C@@H]2[C@H]1C2 MCULE-1808508130 [0,1,0,1,0,0|1,0,0]=3 3896 B11R2.911 COC(=O)[C@H]1NC[C@@H]2[C@H]1C2 MCULE-8597092683 [0,1,0,1,0,0|1,0,0]=3 3897 B11R2.911 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)OC MCULE-4678740496 [0,1,0,1,0,0|1,0,0]=3 3898 B11R2.911 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)OC MCULE-8212632843 [0,1,0,1,0,0|1,0,0]=3 3899 B11R2.911 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)OC MCULE-8682288025 [0,1,0,1,0,0|1,0,0]=3 3900 B11R2.911 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)OC MCULE-9440290794 [0,1,0,1,0,0|1,0,0]=3 3901 B11R2.911 [C@@H]12CN[C@H]([C@@H]1C2)C(=O)OC MCULE-1811469529 [0,1,0,1,0,0|1,0,0]=3 3902 B11R2.911 [C@@H]12CN[C@H]([C@@H]1C2)C(=O)OC MCULE-3154566544 [0,1,0,1,0,0|1,0,0]=3 3903 B11R2.911 [C@@H]12CN[C@H]([C@@H]1C2)C(=O)OC MCULE-6573688012 [0,1,0,1,0,0|1,0,0]=3 3904 B11R2.911 [C@@H]12CN[C@H]([C@@H]1C2)C(=O)OC MCULE-7961003347 [0,1,0,1,0,0|1,0,0]=3 3905 B11R2.914 COC(=O)C1CC2CC2C1 MCULE-6179800543 [0,1,0,1,0,0|2,0,0]=4 3906 B11R2.914 COC(=O)C1CC2OC2C1 MCULE-5558345645 [0,1,0,1,0,0|1,0,0]=3 3907 B11R2.914 COC(=O)C1C[C@@H]2O[C@H]2C1 MCULE-5139827570 [0,1,0,1,0,0|1,0,0]=3 3908 B11R2.914 [C@H]12C[C@@H](C[C@H]1O2)C(=O)OC MCULE-4497705681 [0,1,0,1,0,0|1,0,0]=3 3909 B11R2.201 O=C1OC(=O)C2CCC1C2 MCULE-3134850414 [0,1,0,1,0,0|1,0,1]=4 3910 B11R2.201 [C@H]12CC[C@H](C1)C(=O)OC2=O MCULE-4601747422 [0,1,0,1,0,0|1,0,1]=4 3911 B11R2.576 [C@@H]12CN[C@@](C1)([C@@H]2C)C(=O)O MCULE-1127629056 [0,1,0,1,0,0|1,0,0]=3 3912 B11R2.576 [C@@H]12CN[C@@](C1)([C@@H]2C)C(=O)O MCULE-4290916659 [0,1,0,1,0,0|1,0,0]=3 3913 B11R2.822 O=C(O)C1NCC2C1CC2 MCULE-1771587431 [0,1,0,1,0,0|1,0,0]=3 3914 B11R2.822 O=C(O)[C@@H]1NC[C@@H]2[C@H]1CC2 MCULE-2762293004 [0,1,0,1,0,0|1,0,0]=3 3915 B11R2.822 O=C(O)[C@@H]1NC[C@@H]2[C@H]1CC2 MCULE-7115056217 [0,1,0,1,0,0|1,0,0]=3 3916 B11R2.822 [C@H]12CC[C@H]1CN[C@@H]2C(=O)O MCULE-5715089354 [0,1,0,1,0,0|1,0,0]=3 3917 B11R2.822 [C@H]12CC[C@H]1CN[C@@H]2C(=O)O MCULE-5720996089 [0,1,0,1,0,0|1,0,0]=3 3918 B11R2.822 [C@H]12CC[C@H]1CN[C@H]2C(=O)O MCULE-6325799801 [0,1,0,1,0,0|1,0,0]=3 3919 B11R2.822 [C@H]12CC[C@H]1CN[C@H]2C(=O)O MCULE-9154008612 [0,1,0,1,0,0|1,0,0]=3 3920 B11R2.842 O=C(O)C1CC2CCC2C1 MCULE-9918842821 [0,1,0,1,0,0|2,0,0]=4 3921 B11R2.1868 O=C(O)C1CC2(CC2)CN1 MCULE-4778549821 [0,1,0,1,0,0|1,0,0]=3 3922 B11R2.1868 O=C(O)C1CC2(CC2)CN1 MCULE-7694970169 [0,1,0,1,0,0|1,0,0]=3 3923 B11R2.1868 O=C(O)C1CC2(CC2)CN1 MCULE-9027822231 [0,1,0,1,0,0|1,0,0]=3 3924 B11R2.1868 O=C(O)C1CC2(CC2)CN1 MCULE-9855562233 [0,1,0,1,0,0|1,0,0]=3 3925 B11R2.1868 O=C(O)C1CC2(CC2)CO1 MCULE-6940085644 [0,1,0,1,0,0|2,0,0]=4 3926 B11R2.1868 O=C(O)C1CCC2(C1)CC2 MCULE-1181145196 [0,1,0,1,0,0|2,0,0]=4 3927 B11R2.1868 O=C(O)C1CCC2(C1)N=N2 MCULE-1978155544 [0,1,0,1,0,0|2,0,0]=4 3928 B11R2.1868 O=C(O)[C@@H]1CC2(CC2)CN1 MCULE-2871735191 [0,1,0,1,0,0|1,0,0]=3 3929 B11R2.1868 O=C(O)[C@@H]1CC2(CC2)CN1 MCULE-6367003123 [0,1,0,1,0,0|1,0,0]=3 3930 B11R2.1868 O=C(O)[C@@H]1CC2(CC2)CN1 MCULE-7465606427 [0,1,0,1,0,0|1,0,0]=3 3931 B11R2.1868 O=C(O)[C@@H]1CC2(CC2)CN1 MCULE-9934623327 [0,1,0,1,0,0|1,0,0]=3 3932 B11R2.1868 O=C(O)[C@@H]1CC2(CN1)N=N2 MCULE-2356246601 [0,1,0,1,0,0|1,0,0]=3 3933 B11R2.1868 O=C(O)[C@H]1CC2(CC2)CN1 MCULE-1483590010 [0,1,0,1,0,0|1,0,0]=3 3934 B11R2.1868 O=C(O)[C@H]1CC2(CC2)CN1 MCULE-5865619653 [0,1,0,1,0,0|1,0,0]=3 3935 B11R2.2454 CC12CNC(C1)(C2)C(=O)O MCULE-4173417458 [0,1,0,1,0,0|1,0,0]=3 3936 B11R2.2454 CC12CNC(C1)(C2)C(=O)O MCULE-6288913019 [0,1,0,1,0,0|1,0,0]=3 3937 B11R2.2454 CC12COC(C1)(C2)C(=O)O MCULE-1758963057 [0,1,0,1,0,0|2,0,0]=4 3938 B11R2.2454 CC12COC(C1)(C2)C(=O)O MCULE-5169487794 [0,1,0,1,0,0|2,0,0]=4 3939 B11R2.2454 NC12CCC(C1)(C2)C(=O)O MCULE-4415557284 [0,1,0,1,0,0|2,0,0]=4 3940 B11R2.2454 O=C(O)C12CC(C1)(CN2)F MCULE-7172506799 [0,1,0,1,0,0|1,0,0]=3 3941 B11R2.2454 O=C(O)C12CC(C1)(CN2)F MCULE-8868717417 [0,1,0,1,0,0|1,0,0]=3 3942 B11R2.2454 O=C(O)C12CCC(C1)(C2)F MCULE-8953867117 [0,1,0,1,0,0|2,0,0]=4 3943 B11R2.1850 CC1(CC2CC2C1)C(=O)O MCULE-5006077474 [0,1,0,1,0,0|2,0,0]=4 3944 B7R0.16 C=C(C)C(N)C(=O)O MCULE-1815568719 [0,0,1,0,1,0|1,0,1]=4 3945 B7R0.16 C=C(C)C(N)C(=O)O MCULE-2839869274 [0,0,1,0,1,0|1,0,1]=4 3946 B7R0.16 C=C(C)C(N)C(=O)O MCULE-5015326828 [0,0,1,0,1,0|1,0,1]=4 3947 B7R0.16 C=C(C)C(N)C(=O)O MCULE-5043630144 [0,0,1,0,1,0|1,0,1]=4 3948 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-2007035571 [0,0,1,0,1,0|1,0,1]=4 3949 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-6240689602 [0,0,1,0,1,0|1,0,1]=4 3950 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-8025014656 [0,0,1,0,1,0|1,0,1]=4 3951 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-9704891439 [0,0,1,0,1,0|1,0,1]=4 3952 B7R0.16 CC(Br)C(Br)C(=O)O MCULE-8605068480 [0,0,1,0,1,0|2,0,0]=4 3953 B7R0.16 CC(Br)C(O)C(=O)O MCULE-8231714451 [0,0,1,0,1,0|2,0,0]=4 3954 B7R0.16 CC(C)C(Br)C(=O)O MCULE-7284929535 [0,0,1,0,1,0|2,0,0]=4 3955 B7R0.16 CC(C)C(Br)C(=O)O MCULE-8100016953 [0,0,1,0,1,0|2,0,0]=4 3956 B7R0.16 CC(C)C(C)C(=O)O MCULE-4998524686 [0,0,1,0,1,0|2,0,0]=4 3957 B7R0.16 CC(C)C(Cl)C(=O)O MCULE-8634615546 [0,0,1,0,1,0|2,0,0]=4 3958 B7R0.16 CC(C)C(F)C(=O)O MCULE-5644342535 [0,0,1,0,1,0|2,0,0]=4 3959 B7R0.16 CC(C)C(N)C(=O)N MCULE-5793065876 [0,0,1,0,1,0|2,0,0]=4 3960 B7R0.16 CC(C)C(N)C(=O)N MCULE-6836215171 [0,0,1,0,1,0|2,0,0]=4 3961 B7R0.16 CC(C)C(N)C(=O)O MCULE-8140660263 [0,0,1,0,1,0|1,0,0]=3 3962 B7R0.16 CC(C)C(N)C(=O)O MCULE-9199801639 [0,0,1,0,1,0|1,0,0]=3 3963 B7R0.16 CC(C)C(O)C(=O)O MCULE-6517225229 [0,0,1,0,1,0|2,0,0]=4 3964 B7R0.16 CC(C)C(O)C(=O)O MCULE-7748605101 [0,0,1,0,1,0|2,0,0]=4 3965 B7R0.16 CC(C)[C@@H](Br)C(=O)O MCULE-2705531785 [0,0,1,0,1,0|2,0,0]=4 3966 B7R0.16 CC(C)[C@@H](Br)C(=O)O MCULE-7570119486 [0,0,1,0,1,0|2,0,0]=4 3967 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-2330575489 [0,0,1,0,1,0|2,0,0]=4 3968 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-2653474443 [0,0,1,0,1,0|2,0,0]=4 3969 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-3449326352 [0,0,1,0,1,0|2,0,0]=4 3970 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-7409435805 [0,0,1,0,1,0|2,0,0]=4 3971 B7R0.16 CC(C)[C@@H](N)C(=O)O MCULE-1338052740 [0,0,1,0,1,0|1,0,0]=3 3972 B7R0.16 CC(C)[C@@H](N)C(=O)O MCULE-2459930572 [0,0,1,0,1,0|1,0,0]=3 3973 B7R0.16 CC(C)[C@@H](O)C(=O)O MCULE-7719048521 [0,0,1,0,1,0|2,0,0]=4 3974 B7R0.16 CC(C)[C@@H](O)C(=O)O MCULE-9864796653 [0,0,1,0,1,0|2,0,0]=4 3975 B7R0.16 CC(C)[C@H](Br)C(=O)O MCULE-4863317096 [0,0,1,0,1,0|2,0,0]=4 3976 B7R0.16 CC(C)[C@H](Br)C(=O)O MCULE-8695526864 [0,0,1,0,1,0|2,0,0]=4 3977 B7R0.16 CC(C)[C@H](C)C(=O)O MCULE-4413397700 [0,0,1,0,1,0|2,0,0]=4 3978 B7R0.16 CC(C)[C@H](C)C(=O)O MCULE-6269612306 [0,0,1,0,1,0|2,0,0]=4 3979 B7R0.16 CC(C)[C@H](Cl)C(=O)O MCULE-8084934210 [0,0,1,0,1,0|2,0,0]=4 3980 B7R0.16 CC(C)[C@H](Cl)C(=O)O MCULE-8307595659 [0,0,1,0,1,0|2,0,0]=4 3981 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-1415573194 [0,0,1,0,1,0|2,0,0]=4 3982 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-2742126302 [0,0,1,0,1,0|2,0,0]=4 3983 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-3124084676 [0,0,1,0,1,0|2,0,0]=4 3984 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-4854272542 [0,0,1,0,1,0|2,0,0]=4 3985 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-7430998836 [0,0,1,0,1,0|2,0,0]=4 3986 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-9899853579 [0,0,1,0,1,0|2,0,0]=4 3987 B7R0.16 CC(C)[C@H](N)C(=O)O MCULE-2507309072 [0,0,1,0,1,0|1,0,0]=3 3988 B7R0.16 CC(C)[C@H](N)C(=O)O MCULE-9143825935 [0,0,1,0,1,0|1,0,0]=3 3989 B7R0.16 CC(C)[C@H](O)C(=O)O MCULE-1975771806 [0,0,1,0,1,0|2,0,0]=4 3990 B7R0.16 CC(C)[C@H](O)C(=O)O MCULE-4070611738 [0,0,1,0,1,0|2,0,0]=4 3991 B7R0.16 CC(F)C(N)C(=O)O MCULE-8810968604 [0,0,1,0,1,0|1,0,0]=3 3992 B7R0.16 CC(N)C(C)C(=O)O MCULE-2921617741 [0,0,1,0,1,0|2,0,0]=4 3993 B7R0.16 CC(N)C(C)C(=O)O MCULE-8511267926 [0,0,1,0,1,0|2,0,0]=4 3994 B7R0.16 CC(N)C(O)C(=O)O MCULE-1086139043 [0,0,1,0,1,0|2,0,0]=4 3995 B7R0.16 CC(N)C(O)C(=O)O MCULE-6405300346 [0,0,1,0,1,0|2,0,0]=4 3996 B7R0.16 CC(O)C(C)C(=O)O MCULE-2499360516 [0,0,1,0,1,0|1,0,0]=3 3997 B7R0.16 CC(O)C(N)C(=O)N MCULE-1234785834 [0,0,1,0,1,0|1,0,0]=3 3998 B7R0.16 CC(O)C(N)C(=O)N MCULE-5867306342 [0,0,1,0,1,0|1,0,0]=3 3999 B7R0.16 CC(O)C(N)C(=O)O MCULE-1563595722 [0,0,1,0,1,0|0,0,0]=2 4000 B7R0.16 CC(O)C(N)C(=O)O MCULE-5581920538 [0,0,1,0,1,0|0,0,0]=2 4001 B7R0.16 C[C@@H](N)[C@@H](N)C(=O)O MCULE-5302456851 [0,0,1,0,1,0|1,0,0]=3 4002 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-1663687439 [0,0,1,0,1,0|0,0,0]=2 4003 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-3863591433 [0,0,1,0,1,0|0,0,0]=2 4004 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-8080019797 [0,0,1,0,1,0|0,0,0]=2 4005 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-9284411012 [0,0,1,0,1,0|0,0,0]=2 4006 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-1969228933 [0,0,1,0,1,0|1,0,0]=3 4007 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-3285041526 [0,0,1,0,1,0|1,0,0]=3 4008 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-5018319528 [0,0,1,0,1,0|1,0,0]=3 4009 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-6080625355 [0,0,1,0,1,0|1,0,0]=3 4010 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-9393787536 [0,0,1,0,1,0|1,0,0]=3 4011 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-9925689829 [0,0,1,0,1,0|1,0,0]=3 4012 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-2430667007 [0,0,1,0,1,0|0,0,0]=2 4013 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-2676185993 [0,0,1,0,1,0|0,0,0]=2 4014 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-5254477364 [0,0,1,0,1,0|0,0,0]=2 4015 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-5505393195 [0,0,1,0,1,0|0,0,0]=2 4016 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-7379719940 [0,0,1,0,1,0|0,0,0]=2 4017 B7R0.16 C[C@@H](O)[C@H](O)C(=O)O MCULE-9383777855 [0,0,1,0,1,0|1,0,0]=3 4018 B7R0.16 C[C@H](C(=O)O)[C@@H](C)N MCULE-2245171795 [0,0,1,0,1,0|2,0,0]=4 4019 B7R0.16 C[C@H](C(=O)O)[C@@H](C)N MCULE-2727261050 [0,0,1,0,1,0|2,0,0]=4 4020 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O MCULE-8875933839 [0,0,1,0,1,0|1,0,0]=3 4021 B7R0.16 C[C@H](N)[C@@H](N)C(=O)O MCULE-9507122128 [0,0,1,0,1,0|1,0,0]=3 4022 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O MCULE-2574349608 [0,0,1,0,1,0|2,0,0]=4 4023 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O MCULE-6297204649 [0,0,1,0,1,0|2,0,0]=4 4024 B7R0.16 C[C@H](N)[C@H](N)C(=O)O MCULE-3178389621 [0,0,1,0,1,0|1,0,0]=3 4025 B7R0.16 C[C@H](O)C(N)C(=O)O MCULE-6661175670 [0,0,1,0,1,0|0,0,0]=2 4026 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-6288272506 [0,0,1,0,1,0|0,0,0]=2 4027 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-7203096302 [0,0,1,0,1,0|0,0,0]=2 4028 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-9531951265 [0,0,1,0,1,0|0,0,0]=2 4029 B7R0.16 C[C@H](O)[C@H](N)C(=O)O MCULE-2246314901 [0,0,1,0,1,0|0,0,0]=2 4030 B7R0.16 C[C@H](O)[C@H](N)C(=O)O MCULE-9478987169 [0,0,1,0,1,0|0,0,0]=2 4031 B7R0.16 NC(C(=O)O)C(=O)O MCULE-6118746267 [0,0,1,0,1,0|1,0,1]=4 4032 B7R1.8 CC1CCC1C=O MCULE-9541644884 [1,0,0,0,1,0|2,0,0]=4 4033 B7R1.8 OCC1CCC1O MCULE-9764745395 [1,0,0,0,1,0|1,0,1]=4 4034 B7R1.8 OC[C@@H]1CC[C@H]1O MCULE-5043281368 [1,0,0,0,1,0|1,0,1]=4 4035 B7R1.8 OC[C@H]1CC[C@H]1O MCULE-1536326248 [1,0,0,0,1,0|1,0,1]=4 4036 B7R1.10 C#CC1CC(C1)O MCULE-6127254681 [1,0,0,0,1,0|1,0,1]=4 4037 B7R1.10 CC1CC(C1)C=O MCULE-1258886786 [1,0,0,0,1,0|1,0,0]=3 4038 B7R1.10 CC1CC(C1)CO MCULE-5730978355 [1,0,0,0,1,0|1,0,1]=4 4039 B7R1.10 CNC1CC(C1)O MCULE-1360972312 [1,0,0,0,1,0|2,0,0]=4 4040 B7R1.10 CNC1CC(C1)O MCULE-1798280109 [1,0,0,0,1,0|2,0,0]=4 4041 B7R1.10 CN[C@H]1C[C@@H](C1)O MCULE-2573139583 [1,0,0,0,1,0|2,0,0]=4 4042 B7R1.10 CN[C@H]1C[C@@H](C1)O MCULE-8240672064 [1,0,0,0,1,0|2,0,0]=4 4043 B7R1.10 CN[C@H]1C[C@H](C1)O MCULE-1676114682 [1,0,0,0,1,0|2,0,0]=4 4044 B7R1.10 CN[C@H]1C[C@H](C1)O MCULE-5219886186 [1,0,0,0,1,0|2,0,0]=4 4045 B7R1.10 COC1CC(C1)O MCULE-6762585493 [1,0,0,0,1,0|2,0,0]=4 4046 B7R1.10 CO[C@H]1C[C@@H](C1)O MCULE-8355585959 [1,0,0,0,1,0|2,0,0]=4 4047 B7R1.10 CO[C@H]1C[C@H](C1)O MCULE-4960775262 [1,0,0,0,1,0|2,0,0]=4 4048 B7R1.10 CSC1CC(C1)O MCULE-1605912153 [1,0,0,0,1,0|2,0,0]=4 4049 B7R1.10 N#CC1CC(C1)O MCULE-4680091192 [1,0,0,0,1,0|1,0,1]=4 4050 B7R1.10 N#C[C@H]1C[C@@H](C1)O MCULE-1011646509 [1,0,0,0,1,0|1,0,1]=4 4051 B7R1.10 N#C[C@H]1C[C@H](C1)O MCULE-9751568094 [1,0,0,0,1,0|1,0,1]=4 4052 B7R1.10 NC1CC(C1)CO MCULE-4549811698 [1,0,0,0,1,0|1,0,1]=4 4053 B7R1.10 NC1CC(C1)CO MCULE-9310533439 [1,0,0,0,1,0|1,0,1]=4 4054 B7R1.10 NCC1CC(C1)O MCULE-1448807479 [1,0,0,0,1,0|1,0,1]=4 4055 B7R1.10 NCC1CC(C1)O MCULE-5095960848 [1,0,0,0,1,0|1,0,1]=4 4056 B7R1.10 NC[C@H]1C[C@@H](C1)O MCULE-2155101378 [1,0,0,0,1,0|1,0,1]=4 4057 B7R1.10 NC[C@H]1C[C@@H](C1)O MCULE-3237212031 [1,0,0,0,1,0|1,0,1]=4 4058 B7R1.10 NC[C@H]1C[C@H](C1)O MCULE-3137766844 [1,0,0,0,1,0|1,0,1]=4 4059 B7R1.10 NC[C@H]1C[C@H](C1)O MCULE-6173771659 [1,0,0,0,1,0|1,0,1]=4 4060 B7R1.10 NNC1CC(C1)O MCULE-5994485672 [1,0,0,0,1,0|2,0,0]=4 4061 B7R1.10 NN[C@H]1C[C@@H](C1)O MCULE-7299068166 [1,0,0,0,1,0|2,0,0]=4 4062 B7R1.10 NN[C@H]1C[C@H](C1)O MCULE-6067864594 [1,0,0,0,1,0|2,0,0]=4 4063 B7R1.10 NN[C@H]1C[C@H](C1)O MCULE-8225790345 [1,0,0,0,1,0|2,0,0]=4 4064 B7R1.10 N[C@H]1C[C@@H](C1)CO MCULE-1976271596 [1,0,0,0,1,0|1,0,1]=4 4065 B7R1.10 N[C@H]1C[C@@H](C1)CO MCULE-2004610084 [1,0,0,0,1,0|1,0,1]=4 4066 B7R1.10 N[C@H]1C[C@H](C1)CO MCULE-3406959231 [1,0,0,0,1,0|1,0,1]=4 4067 B7R1.10 N[C@H]1C[C@H](C1)CO MCULE-9771399616 [1,0,0,0,1,0|1,0,1]=4 4068 B7R1.10 OC1CC(C1)CBr MCULE-8641406432 [1,0,0,0,1,0|1,0,1]=4 4069 B7R1.10 OC1CC(C1)CF MCULE-9152872996 [1,0,0,0,1,0|1,0,1]=4 4070 B7R1.10 OCC1CC(C1)Br MCULE-6426656913 [1,0,0,0,1,0|1,0,1]=4 4071 B7R1.10 OCC1CC(C1)Cl MCULE-8102550006 [1,0,0,0,1,0|1,0,1]=4 4072 B7R1.10 OCC1CC(C1)F MCULE-8343173774 [1,0,0,0,1,0|1,0,1]=4 4073 B7R1.10 OCC1CC(C1)O MCULE-3885216336 [1,0,0,0,1,0|0,0,1]=3 4074 B7R1.10 OC[C@H]1C[C@H](C1)O MCULE-2350233032 [1,0,0,0,1,0|0,0,1]=3 4075 B7R1.10 O[C@H]1C[C@H](C1)CF MCULE-2417083162 [1,0,0,0,1,0|1,0,1]=4 4076 B7R1.18 C1(CCN1)C(=O)O MCULE-9324355017 [1,0,0,0,1,0|0,0,0]=2 4077 B7R1.18 CC(=O)C1CCC1 MCULE-5770046789 [1,0,0,0,1,0|1,0,0]=3 4078 B7R1.18 CC(=O)C1CNC1 MCULE-2354733934 [1,0,0,0,1,0|2,0,0]=4 4079 B7R1.18 CC(=O)C1CNC1 MCULE-3110609785 [1,0,0,0,1,0|2,0,0]=4 4080 B7R1.18 CC(=O)C1CNC1 MCULE-4112322251 [1,0,0,0,1,0|2,0,0]=4 4081 B7R1.18 CC(=O)C1COC1 MCULE-3416774210 [1,0,0,0,1,0|2,0,0]=4 4082 B7R1.18 CC(=O)N1CCC1 MCULE-6467100562 [1,0,0,0,1,0|2,0,0]=4 4083 B7R1.18 CC(O)C1CCC1 MCULE-7846963519 [1,0,0,0,1,0|1,0,1]=4 4084 B7R1.18 C[C@@H](O)C1CCC1 MCULE-6990873960 [1,0,0,0,1,0|1,0,1]=4 4085 B7R1.18 C[C@H](O)C1CCC1 MCULE-5072123772 [1,0,0,0,1,0|1,0,1]=4 4086 B7R1.18 C[C@H](O)C1CCC1 MCULE-6701623925 [1,0,0,0,1,0|1,0,1]=4 4087 B7R1.18 N=C(N)C1CCC1 MCULE-3470535674 [1,0,0,0,1,0|2,0,0]=4 4088 B7R1.18 N=C(N)C1CCC1 MCULE-4802517706 [1,0,0,0,1,0|2,0,0]=4 4089 B7R1.18 N=C(N)C1CCC1 MCULE-5858986439 [1,0,0,0,1,0|2,0,0]=4 4090 B7R1.18 NC(=O)C1CCC1 MCULE-5151176129 [1,0,0,0,1,0|1,0,0]=3 4091 B7R1.18 NC(=O)C1CCN1 MCULE-1856696035 [1,0,0,0,1,0|1,0,0]=3 4092 B7R1.18 NC(=O)C1CCN1 MCULE-5757704016 [1,0,0,0,1,0|1,0,0]=3 4093 B7R1.18 NC(=O)C1CNC1 MCULE-2319282799 [1,0,0,0,1,0|2,0,0]=4 4094 B7R1.18 NC(=O)C1CNC1 MCULE-4985073048 [1,0,0,0,1,0|2,0,0]=4 4095 B7R1.18 NC(=O)C1CNC1 MCULE-8796959516 [1,0,0,0,1,0|2,0,0]=4 4096 B7R1.18 NC(=O)C1COC1 MCULE-1077689713 [1,0,0,0,1,0|2,0,0]=4 4097 B7R1.18 NC(=O)N1CCC1 MCULE-1594728830 [1,0,0,0,1,0|2,0,0]=4 4098 B7R1.18 NC(=O)[C@H]1CCN1 MCULE-7187425143 [1,0,0,0,1,0|1,0,0]=3 4099 B7R1.18 NC(=S)C1CCC1 MCULE-9753547991 [1,0,0,0,1,0|1,1,0]=4 4100 B7R1.18 O=C(Cl)C1CCC1 MCULE-2155859428 [1,0,0,0,1,0|1,0,0]=3 4101 B7R1.18 O=C(Cl)N1CCC1 MCULE-8313088104 [1,0,0,0,1,0|2,0,0]=4 4102 B7R1.18 O=C(O)C1=CCC1 MCULE-4244912351 [1,0,0,0,1,0|0,0,2]=4 4103 B7R1.18 O=C(O)C1CCC1 MCULE-2498509888 [1,0,0,0,1,0|0,0,0]=2 4104 B7R1.18 O=C(O)C1CCN1 MCULE-1336085891 [1,0,0,0,1,0|0,0,0]=2 4105 B7R1.18 O=C(O)C1CCN1 MCULE-6501890131 [1,0,0,0,1,0|0,0,0]=2 4106 B7R1.18 O=C(O)C1CCN1 MCULE-7647115314 [1,0,0,0,1,0|0,0,0]=2 4107 B7R1.18 O=C(O)C1CCO1 MCULE-6065911736 [1,0,0,0,1,0|1,0,0]=3 4108 B7R1.18 O=C(O)C1CCO1 MCULE-9296370119 [1,0,0,0,1,0|1,0,0]=3 4109 B7R1.18 O=C(O)C1CNC1 MCULE-2350328355 [1,0,0,0,1,0|1,0,0]=3 4110 B7R1.18 O=C(O)C1CNC1 MCULE-7890374869 [1,0,0,0,1,0|1,0,0]=3 4111 B7R1.18 O=C(O)C1COC1 MCULE-2530431165 [1,0,0,0,1,0|1,0,0]=3 4112 B7R1.18 O=C(O)C1CSC1 MCULE-4019152056 [1,0,0,0,1,0|1,0,0]=3 4113 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-2126306157 [1,0,0,0,1,0|0,0,0]=2 4114 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-2597576629 [1,0,0,0,1,0|0,0,0]=2 4115 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-6006656004 [1,0,0,0,1,0|0,0,0]=2 4116 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-7241612713 [1,0,0,0,1,0|0,0,0]=2 4117 B7R1.18 O=C(O)[C@@H]1CCO1 MCULE-5117442811 [1,0,0,0,1,0|1,0,0]=3 4118 B7R1.18 O=C(O)[C@@H]1CCO1 MCULE-8116248615 [1,0,0,0,1,0|1,0,0]=3 4119 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-3254184046 [1,0,0,0,1,0|0,0,0]=2 4120 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-5162570273 [1,0,0,0,1,0|0,0,0]=2 4121 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-5488052558 [1,0,0,0,1,0|0,0,0]=2 4122 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-8240936495 [1,0,0,0,1,0|0,0,0]=2 4123 B7R1.18 O=C(O)[C@H]1CCO1 MCULE-5499247834 [1,0,0,0,1,0|1,0,0]=3 4124 B7R1.18 O=C(O)[C@H]1CCO1 MCULE-7468207073 [1,0,0,0,1,0|1,0,0]=3 4125 B7R1.18 O=N(=O)C1CCC1 MCULE-1263563910 [1,0,0,0,1,0|1,0,1]=4 4126 B7R1.18 O=S([O-])C1CCC1 MCULE-2181260614 [1,0,0,0,1,0|1,0,1]=4 4127 B7R1.18 O=S([O-])C1CCC1 MCULE-5691798035 [1,0,0,0,1,0|1,0,1]=4 4128 B7R1.18 OB(O)C1CCC1 MCULE-3574521261 [1,0,0,0,1,0|1,0,1]=4 4129 B7R1.12 C=C1CC1C(=O)O MCULE-4330944573 [0,0,0,0,2,0|1,0,1]=4 4130 B7R1.12 CC(=O)C1CC1C MCULE-5857709747 [0,0,0,0,2,0|2,0,0]=4 4131 B7R1.12 CC(=O)[C@@H]1C[C@H]1C MCULE-4367650211 [0,0,0,0,2,0|2,0,0]=4 4132 B7R1.12 CC1CC1C(=O)Cl MCULE-7645594952 [0,0,0,0,2,0|2,0,0]=4 4133 B7R1.12 CC1CC1C(=O)N MCULE-4145079494 [0,0,0,0,2,0|2,0,0]=4 4134 B7R1.12 CC1CC1C(=O)O MCULE-1757330006 [0,0,0,0,2,0|1,0,0]=3 4135 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O MCULE-1245851874 [0,0,0,0,2,0|1,0,0]=3 4136 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O MCULE-9582782871 [0,0,0,0,2,0|1,0,0]=3 4137 B7R1.12 C[C@@H]1C[C@H]1C(=O)O MCULE-2621918749 [0,0,0,0,2,0|1,0,0]=3 4138 B7R1.12 C[C@@H]1C[C@H]1C(=O)O MCULE-7347988261 [0,0,0,0,2,0|1,0,0]=3 4139 B7R1.12 C[C@H]1C[C@@H]1C(=O)O MCULE-4499487863 [0,0,0,0,2,0|1,0,0]=3 4140 B7R1.12 C[C@H]1C[C@@H]1C(=O)O MCULE-9300153165 [0,0,0,0,2,0|1,0,0]=3 4141 B7R1.12 C[C@H]1C[C@H]1C(=O)O MCULE-4410115478 [0,0,0,0,2,0|1,0,0]=3 4142 B7R1.12 C[C@H]1C[C@H]1C(=O)O MCULE-6590525761 [0,0,0,0,2,0|1,0,0]=3 4143 B7R1.12 C[C@H]1C[C@H]1C(=O)O MCULE-8070492716 [0,0,0,0,2,0|1,0,0]=3 4144 B7R1.12 NC(=O)C1CC1N MCULE-9433325277 [0,0,0,0,2,0|2,0,0]=4 4145 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F MCULE-2857193174 [0,0,0,0,2,0|2,0,0]=4 4146 B7R1.12 O=C(O)C1CC1Br MCULE-6387317137 [0,0,0,0,2,0|1,0,0]=3 4147 B7R1.12 O=C(O)C1CC1Cl MCULE-8907850405 [0,0,0,0,2,0|1,0,0]=3 4148 B7R1.12 O=C(O)C1CC1F MCULE-8258481986 [0,0,0,0,2,0|1,0,0]=3 4149 B7R1.12 O=C(O)C1CC1I MCULE-9535592263 [0,0,0,0,2,0|1,0,0]=3 4150 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F MCULE-1882710455 [0,0,0,0,2,0|1,0,0]=3 4151 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F MCULE-7715660561 [0,0,0,0,2,0|1,0,0]=3 4152 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F MCULE-7741460434 [0,0,0,0,2,0|1,0,0]=3 4153 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I MCULE-2594739726 [0,0,0,0,2,0|1,0,0]=3 4154 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I MCULE-3033770510 [0,0,0,0,2,0|1,0,0]=3 4155 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I MCULE-6224902495 [0,0,0,0,2,0|1,0,0]=3 4156 B7R1.12 O=C(O)[C@@H]1C[C@H]1Br MCULE-3031410853 [0,0,0,0,2,0|1,0,0]=3 4157 B7R1.12 O=C(O)[C@@H]1C[C@H]1F MCULE-1201733028 [0,0,0,0,2,0|1,0,0]=3 4158 B7R1.12 O=C(O)[C@@H]1C[C@H]1F MCULE-5963625184 [0,0,0,0,2,0|1,0,0]=3 4159 B7R1.12 O=C(O)[C@@H]1C[C@H]1F MCULE-9724617114 [0,0,0,0,2,0|1,0,0]=3 4160 B7R1.12 O=C(O)[C@@H]1C[C@H]1I MCULE-3702576454 [0,0,0,0,2,0|1,0,0]=3 4161 B7R1.12 O=C(O)[C@H]1C[C@@H]1F MCULE-3766204952 [0,0,0,0,2,0|1,0,0]=3 4162 B7R1.12 O=C(O)[C@H]1C[C@@H]1F MCULE-4258983574 [0,0,0,0,2,0|1,0,0]=3 4163 B7R1.12 O=C(O)[C@H]1C[C@H]1Br MCULE-3094747797 [0,0,0,0,2,0|1,0,0]=3 4164 B7R1.12 O=C(O)[C@H]1C[C@H]1F MCULE-7993479857 [0,0,0,0,2,0|1,0,0]=3 4165 B7R1.12 O=C(O)[C@H]1C[C@H]1F MCULE-9922834235 [0,0,0,0,2,0|1,0,0]=3 4166 B7R1.12 O=C(O)[C@H]1C[C@H]1I MCULE-5714437007 [0,0,0,0,2,0|1,0,0]=3 4167 B7R1.12 O=C(O)[C@H]1C[C@H]1I MCULE-8000208987 [0,0,0,0,2,0|1,0,0]=3 4168 B7R1.12 [C@H]1(C[C@H]1C(=O)O)C MCULE-9539625763 [0,0,0,0,2,0|1,0,0]=3 4169 B9R0.4 CC(CC(=O)O)NCCO MCULE-6990108869 [0,0,1,0,0,1|0,0,0]=2 4170 B9R0.4 CCCCC(C)CC(=O)O MCULE-1674327007 [0,0,1,0,0,1|2,0,0]=4 4171 B9R0.4 CCCC[C@H](C)CC(=O)O MCULE-2048808547 [0,0,1,0,0,1|2,0,0]=4 4172 B9R0.14 CCCC(CC)CC(=O)O MCULE-7716353443 [0,0,1,0,0,1|2,0,0]=4 4173 B9R0.55 CC(C)CCCCC(=O)O MCULE-9552597130 [0,0,1,0,0,1|2,0,0]=4 4174 B9R0.55 CC(C)CCOCC(=O)O MCULE-8263995178 [0,0,1,0,0,1|2,0,0]=4 4175 B9R0.55 CC(C)CCSCC(=O)O MCULE-6718693744 [0,0,1,0,0,1|2,0,0]=4 4176 B9R0.55 CC(C)CNCCC(=O)O MCULE-7021054047 [0,0,1,0,0,1|1,0,0]=3 4177 B9R0.55 CC(C)CNCCC(=O)O MCULE-7640501484 [0,0,1,0,0,1|1,0,0]=3 4178 B9R0.55 CC(C)COCCC(=O)O MCULE-6429199224 [0,0,1,0,0,1|2,0,0]=4 4179 B9R0.55 CC(C)CSCCC(=O)O MCULE-9529480904 [0,0,1,0,0,1|2,0,0]=4 4180 B9R0.55 CC(C)NCCCC(=O)O MCULE-4053268267 [0,0,1,0,0,1|2,0,0]=4 4181 B9R0.55 CC(C)NCCCC(=O)O MCULE-8505810240 [0,0,1,0,0,1|2,0,0]=4 4182 B9R0.55 CC(C)OCCCC(=O)O MCULE-8577811101 [0,0,1,0,0,1|2,0,0]=4 4183 B9R0.55 CC(C)SCCCC(=O)O MCULE-7082519548 [0,0,1,0,0,1|2,0,0]=4 4184 B9R0.55 CC(N)CCCCC(=O)O MCULE-3306602652 [0,0,1,0,0,1|2,0,0]=4 4185 B9R0.55 CC(N)CCCCC(=O)O MCULE-3909320120 [0,0,1,0,0,1|2,0,0]=4 4186 B9R0.55 CN(C)CCNCC(=O)O MCULE-6551648059 [0,0,1,0,0,1|2,0,0]=4 4187 B9R0.55 CN(C)CCNCC(=O)O MCULE-7040720736 [0,0,1,0,0,1|2,0,0]=4 4188 B9R0.55 O=C(O)CNNCC(=O)O MCULE-8753369145 [0,0,1,0,0,1|1,0,1]=4 4189 B9R1.2 CC1CC(CCO1)C=O MCULE-4627853236 [1,0,0,0,0,1|2,0,0]=4 4190 B9R1.2 CC1CCCC(C1)C=O MCULE-8003239715 [1,0,0,0,0,1|2,0,0]=4 4191 B9R1.2 CC1CNCC(C1)CO MCULE-1604083581 [1,0,0,0,0,1|1,0,1]=4 4192 B9R1.2 CCC1CC(CCN1)O MCULE-4953737441 [1,0,0,0,0,1|1,0,1]=4 4193 B9R1.2 CCC1CC(CCN1)O MCULE-9634837614 [1,0,0,0,0,1|1,0,1]=4 4194 B9R1.2 CC[C@@H]1C[C@@H](CCN1)O MCULE-1934337871 [1,0,0,0,0,1|1,0,1]=4 4195 B9R1.2 CC[C@@H]1C[C@@H](CCN1)O MCULE-5295834203 [1,0,0,0,0,1|1,0,1]=4 4196 B9R1.2 O=CC1CCNC(C1)Br MCULE-8861349259 [1,0,0,0,0,1|2,0,0]=4 4197 B9R1.2 OCC1CNCC(C1)F MCULE-4143657441 [1,0,0,0,0,1|1,0,1]=4 4198 B9R1.2 OCC1CNCC(C1)F MCULE-8277902234 [1,0,0,0,0,1|1,0,1]=4 4199 B9R1.2 OC[C@@H]1C[C@@H](CCN1)O MCULE-6189374946 [1,0,0,0,0,1|0,0,1]=3 4200 B9R1.2 OC[C@@H]1C[C@@H](CCN1)O MCULE-7813341428 [1,0,0,0,0,1|0,0,1]=3 4201 B9R1.2 OC[C@H]1C[C@H](CCN1)O MCULE-6277104745 [1,0,0,0,0,1|0,0,1]=3 4202 B9R1.2 OC[C@H]1C[C@H](CCN1)O MCULE-9933354273 [1,0,0,0,0,1|0,0,1]=3 4203 B9R1.13 C1(CCCN1)CC(=O)O MCULE-3743402418 [1,0,0,0,0,1|0,0,0]=2 4204 B9R1.13 C1(CCCN1)CC(=O)O MCULE-9966702869 [1,0,0,0,0,1|0,0,0]=2 4205 B9R1.13 C1(CCNC1)CC(=O)O MCULE-7279534621 [1,0,0,0,0,1|2,0,0]=4 4206 B9R1.13 CC(=O)CC1CCCC1 MCULE-5830536761 [1,0,0,0,0,1|2,0,0]=4 4207 B9R1.13 CC(=O)CC1CCCO1 MCULE-7012539509 [1,0,0,0,0,1|2,0,0]=4 4208 B9R1.13 CC(=O)NC1CCCC1 MCULE-5984597819 [1,0,0,0,0,1|2,0,0]=4 4209 B9R1.13 CC(=O)OC1CCCC1 MCULE-7737656947 [1,0,0,0,0,1|2,0,0]=4 4210 B9R1.13 CC(=O)OC1CCCO1 MCULE-9160883410 [1,0,0,0,0,1|2,0,0]=4 4211 B9R1.13 CC(O)CC1CCCN1 MCULE-7800705257 [1,0,0,0,0,1|1,0,1]=4 4212 B9R1.13 NC(=O)/N=C\1/CCCN1 MCULE-4992899283 [1,0,0,0,0,1|1,0,1]=4 4213 B9R1.13 NC(=O)CC1CCCC1 MCULE-2082339108 [1,0,0,0,0,1|2,0,0]=4 4214 B9R1.13 NC(=O)CC1CCCN1 MCULE-2142594957 [1,0,0,0,0,1|1,0,0]=3 4215 B9R1.13 NC(=O)CC1CCCN1 MCULE-8011902334 [1,0,0,0,0,1|1,0,0]=3 4216 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-2790931086 [1,0,0,0,0,1|1,0,0]=3 4217 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-3723741843 [1,0,0,0,0,1|1,0,0]=3 4218 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-3877903747 [1,0,0,0,0,1|1,0,0]=3 4219 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-5587287647 [1,0,0,0,0,1|1,0,0]=3 4220 B9R1.13 NC(=O)NC1CCCC1 MCULE-9715014489 [1,0,0,0,0,1|2,0,0]=4 4221 B9R1.13 NC(=O)NC1NCCN1 MCULE-5746168335 [1,0,0,0,0,1|2,0,0]=4 4222 B9R1.13 NC(=O)OC1CCCC1 MCULE-7706681395 [1,0,0,0,0,1|2,0,0]=4 4223 B9R1.13 O=C(Cl)CC1CCCC1 MCULE-1532102571 [1,0,0,0,0,1|2,0,0]=4 4224 B9R1.13 O=C(Cl)CC1CCCO1 MCULE-6649417514 [1,0,0,0,0,1|2,0,0]=4 4225 B9R1.13 O=C(Cl)OC1CCCC1 MCULE-2692212922 [1,0,0,0,0,1|2,0,0]=4 4226 B9R1.13 O=C(O)C=C1CCCC1 MCULE-1637420148 [1,0,0,0,0,1|1,0,1]=4 4227 B9R1.13 O=C(O)CC1=CCCC1 MCULE-5115478269 [1,0,0,0,0,1|1,0,1]=4 4228 B9R1.13 O=C(O)CC1C=CCC1 MCULE-6825390000 [1,0,0,0,0,1|1,0,1]=4 4229 B9R1.13 O=C(O)CC1CCCC1 MCULE-1115751804 [1,0,0,0,0,1|1,0,0]=3 4230 B9R1.13 O=C(O)CC1CCCN1 MCULE-6784535537 [1,0,0,0,0,1|0,0,0]=2 4231 B9R1.13 O=C(O)CC1CCCN1 MCULE-8302150253 [1,0,0,0,0,1|0,0,0]=2 4232 B9R1.13 O=C(O)CC1CCCO1 MCULE-8027346350 [1,0,0,0,0,1|1,0,0]=3 4233 B9R1.13 O=C(O)CC1CCNC1 MCULE-3199492917 [1,0,0,0,0,1|2,0,0]=4 4234 B9R1.13 O=C(O)CC1CCNC1 MCULE-3887627276 [1,0,0,0,0,1|2,0,0]=4 4235 B9R1.13 O=C(O)CC1CCOC1 MCULE-5167901709 [1,0,0,0,0,1|2,0,0]=4 4236 B9R1.13 O=C(O)CC1CCOC1 MCULE-9171332464 [1,0,0,0,0,1|2,0,0]=4 4237 B9R1.13 O=C(O)CC1CCSS1 MCULE-4893716992 [1,0,0,0,0,1|2,0,0]=4 4238 B9R1.13 O=C(O)CC1OCCO1 MCULE-2253063465 [1,0,0,0,0,1|2,0,0]=4 4239 B9R1.13 O=C(O)CN1CCCC1 MCULE-3979513963 [1,0,0,0,0,1|2,0,0]=4 4240 B9R1.13 O=C(O)CN1CCCC1 MCULE-4046939568 [1,0,0,0,0,1|2,0,0]=4 4241 B9R1.13 O=C(O)C[C@@H]1CCCN1 MCULE-3034711788 [1,0,0,0,0,1|0,0,0]=2 4242 B9R1.13 O=C(O)C[C@@H]1CCCN1 MCULE-8632270998 [1,0,0,0,0,1|0,0,0]=2 4243 B9R1.13 O=C(O)C[C@@H]1CCCN1 MCULE-9053746158 [1,0,0,0,0,1|0,0,0]=2 4244 B9R1.13 O=C(O)C[C@@H]1CCCO1 MCULE-6652130024 [1,0,0,0,0,1|1,0,0]=3 4245 B9R1.13 O=C(O)C[C@@H]1CCNC1 MCULE-1313399028 [1,0,0,0,0,1|2,0,0]=4 4246 B9R1.13 O=C(O)C[C@@H]1CCNC1 MCULE-3013411353 [1,0,0,0,0,1|2,0,0]=4 4247 B9R1.13 O=C(O)C[C@@H]1CCNC1 MCULE-4082052328 [1,0,0,0,0,1|2,0,0]=4 4248 B9R1.13 O=C(O)C[C@@H]1CCNC1 MCULE-4709831049 [1,0,0,0,0,1|2,0,0]=4 4249 B9R1.13 O=C(O)C[C@@H]1CCOC1 MCULE-2630690308 [1,0,0,0,0,1|2,0,0]=4 4250 B9R1.13 O=C(O)C[C@@H]1CCOC1 MCULE-6148582776 [1,0,0,0,0,1|2,0,0]=4 4251 B9R1.13 O=C(O)C[C@H]1CCCN1 MCULE-1934097379 [1,0,0,0,0,1|0,0,0]=2 4252 B9R1.13 O=C(O)C[C@H]1CCCN1 MCULE-3129569449 [1,0,0,0,0,1|0,0,0]=2 4253 B9R1.13 O=C(O)C[C@H]1CCCN1 MCULE-8499782890 [1,0,0,0,0,1|0,0,0]=2 4254 B9R1.13 O=C(O)C[C@H]1CCCN1 MCULE-9712071738 [1,0,0,0,0,1|0,0,0]=2 4255 B9R1.13 O=C(O)C[C@H]1CCNC1 MCULE-3712345326 [1,0,0,0,0,1|2,0,0]=4 4256 B9R1.13 O=C(O)C[C@H]1CCNC1 MCULE-4882389427 [1,0,0,0,0,1|2,0,0]=4 4257 B9R1.13 O=C(O)C[C@H]1CCNC1 MCULE-5390328422 [1,0,0,0,0,1|2,0,0]=4 4258 B9R1.13 O=C(O)C[C@H]1CCNC1 MCULE-8402835022 [1,0,0,0,0,1|2,0,0]=4 4259 B9R1.13 O=C(O)C[C@H]1CCOC1 MCULE-3521696581 [1,0,0,0,0,1|2,0,0]=4 4260 B9R1.13 O=C(O)C[C@H]1CCOC1 MCULE-6096956796 [1,0,0,0,0,1|2,0,0]=4 4261 B9R1.13 [C@H]1(CCCN1)CC(=O)O MCULE-6368276149 [1,0,0,0,0,1|0,0,0]=2 4262 B11R1.20 CC(=O)NC1CCC(CC1)O MCULE-4935359894 [0,0,0,0,0,2|2,0,0]=4 4263 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)O MCULE-7696004406 [0,0,0,0,0,2|2,0,0]=4 4264 B11R1.20 CC1CCC(CC1)CC(=O)O MCULE-4709512543 [0,0,0,0,0,2|2,0,0]=4 4265 B11R1.20 C[C@H]1CC[C@@H](CC1)CC(=O)O MCULE-6731009022 [0,0,0,0,0,2|2,0,0]=4 4266 B11R1.20 NC(=O)NC1CCC(CC1)O MCULE-8332331754 [0,0,0,0,0,2|2,0,0]=4 4267 B11R1.20 NC1CCC(CC1)CC(=O)O MCULE-7784789459 [0,0,0,0,0,2|2,0,0]=4 4268 B11R1.20 N[C@H]1CC[C@@H](CC1)CC(=O)O MCULE-2303304803 [0,0,0,0,0,2|2,0,0]=4 4269 B11R1.20 N[C@H]1CC[C@@H](CC1)CC(=O)O MCULE-5990177555 [0,0,0,0,0,2|2,0,0]=4 4270 B11R1.20 N[C@H]1CC[C@H](CC1)CC(=O)O MCULE-4302933877 [0,0,0,0,0,2|2,0,0]=4 4271 B11R1.20 N[C@H]1CC[C@H](CC1)CC(=O)O MCULE-7773137329 [0,0,0,0,0,2|2,0,0]=4 4272 B11R1.20 O=C(O)CC1CCC(CC1)Cl MCULE-8089546058 [0,0,0,0,0,2|2,0,0]=4 4273 B11R1.20 O=C(O)CC1CCC(CC1)O MCULE-4327900578 [0,0,0,0,0,2|1,0,0]=3 4274 B11R1.20 O=C(O)CN1CCC(CC1)O MCULE-6234398101 [0,0,0,0,0,2|2,0,0]=4 4275 B11R1.20 O=C(O)C[C@H]1CC[C@@H](CC1)O MCULE-4456637498 [0,0,0,0,0,2|1,0,0]=3 4276 B11R1.20 O=C(O)C[C@H]1CC[C@H](CC1)O MCULE-7150660975 [0,0,0,0,0,2|1,0,0]=3 4277 B11R1.20 [NH3+]C1CCC(CC1)CC(=O)O MCULE-6083129512 [0,0,0,0,0,2|2,0,0]=4 4278 B11R1.157 CC1CCCC(C1)CC(=O)O MCULE-8177394227 [0,0,0,0,0,2|2,0,0]=4 4279 B11R1.157 CC1CCNC(C1)CC(=O)O MCULE-5716034877 [0,0,0,0,0,2|1,0,0]=3 4280 B11R1.157 CC1CNCC(C1)CC(=O)O MCULE-1750389348 [0,0,0,0,0,2|1,0,0]=3 4281 B11R1.157 CC1CNCC(C1)CC(=O)O MCULE-3483420567 [0,0,0,0,0,2|1,0,0]=3 4282 B11R1.157 NC1CCOC(C1)CC(=O)O MCULE-1365112311 [0,0,0,0,0,2|2,0,0]=4 4283 B11R1.157 NC1CCOC(C1)CC(=O)O MCULE-9509541900 [0,0,0,0,0,2|2,0,0]=4 4284 B11R1.157 O=C(O)CN1CCCC(C1)O MCULE-4186047458 [0,0,0,0,0,2|2,0,0]=4 4285 B11R1.157 O=C(O)CN1CCC[C@@H](C1)O MCULE-3402932405 [0,0,0,0,0,2|2,0,0]=4 4286 B11R1.157 O=C(O)CN1CCC[C@H](C1)O MCULE-4870964189 [0,0,0,0,0,2|2,0,0]=4 4287 B11R1.497 CC(=O)N1CCNCC(C1)O MCULE-6634305760 [0,0,0,0,0,2|2,0,0]=4 4288 B11R1.497 CC(=O)N1CCNCC(C1)O MCULE-8301515073 [0,0,0,0,0,2|2,0,0]=4 4289 B11R1.497 NC1CCCCC(C1)C(=O)O MCULE-6764464855 [0,0,0,0,0,2|2,0,0]=4 4290 B11R1.497 O=C(O)C1CCCCC(C1)O MCULE-8775414897 [0,0,0,0,0,2|1,0,0]=3