0 B11R1.645 CC1=NN(C(=O)C1)CC(=O)O MCULE-5486758496 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.645 CC1=NN(C(=O)C1)CC(=O)O MCULE-9895818156 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.645 NC(=O)CN1CC(CC1=O)O MCULE-8223030209 [0,0,0,0,0,0|0,0,0]=0 3 B11R1.645 NC(=O)CN1C[C@@H](CC1=O)O MCULE-5110920506 [0,0,0,0,0,0|0,0,0]=0 4 B11R1.645 NC(=O)CN1C[C@@H](CC1=O)O MCULE-8263933474 [0,0,0,0,0,0|0,0,0]=0 5 B11R1.645 NC(=O)CN1C[C@H](CC1=O)O MCULE-2453324740 [0,0,0,0,0,0|0,0,0]=0 6 B11R1.645 NC(=O)CN1C[C@H](CC1=O)O MCULE-8181962579 [0,0,0,0,0,0|0,0,0]=0 7 B11R1.645 O=C(O)CN1CC(=O)NC1=O MCULE-6009577973 [0,0,0,0,0,0|2,0,2]=4 8 B11R1.645 O=C(O)CN1CC(CC1=O)O MCULE-3214685086 [0,0,0,0,0,0|1,0,0]=1 9 B11R1.645 O=C(O)CN1CC(CC1=O)O MCULE-9078700993 [0,0,0,0,0,0|1,0,0]=1 10 B11R1.645 O=C(O)CN1C[C@H](CC1=O)O MCULE-3576151184 [0,0,0,0,0,0|1,0,0]=1 11 B11R1.645 O=C(O)CN1C[C@H](CC1=O)O MCULE-5254432893 [0,0,0,0,0,0|1,0,0]=1 12 B10R1.54 CC1CCN(C1)CC(=O)O MCULE-1407049911 [1,0,0,0,0,0|2,0,1]=4 13 B10R1.54 CC1CCN(C1)CC(=O)O MCULE-9097138381 [1,0,0,0,0,0|2,0,1]=4 14 B10R1.54 NC1CCN(C1)CC(=O)O MCULE-5943171118 [1,0,0,0,0,0|2,0,1]=4 15 B10R1.54 NC1CCN(C1)CC(=O)O MCULE-9229773679 [1,0,0,0,0,0|2,0,1]=4 16 B10R1.54 N[C@@H]1CCN(C1)CC(=O)O MCULE-2161728364 [1,0,0,0,0,0|2,0,1]=4 17 B10R1.54 N[C@@H]1CCN(C1)CC(=O)O MCULE-8593996404 [1,0,0,0,0,0|2,0,1]=4 18 B10R1.54 N[C@@H]1CCN(C1)CC(=O)O MCULE-8985734275 [1,0,0,0,0,0|2,0,1]=4 19 B10R1.54 N[C@H]1CCN(C1)CC(=O)O MCULE-1503909439 [1,0,0,0,0,0|2,0,1]=4 20 B10R1.54 N[C@H]1CCN(C1)CC(=O)O MCULE-6977922157 [1,0,0,0,0,0|2,0,1]=4 21 B10R1.54 O=C(O)CC1CC(CN1)O MCULE-7161298106 [1,0,0,0,0,0|3,0,0]=4 22 B10R1.54 O=C(O)CC1CC(CN1)O MCULE-8476180516 [1,0,0,0,0,0|3,0,0]=4 23 B10R1.54 O=C(O)CC1CCC(C1)O MCULE-1306554926 [1,0,0,0,0,0|2,0,1]=4 24 B10R1.54 O=C(O)CN1CCC(C1)Br MCULE-3288536521 [1,0,0,0,0,0|2,0,1]=4 25 B10R1.54 O=C(O)CN1CCC(C1)Cl MCULE-1930405641 [1,0,0,0,0,0|2,0,1]=4 26 B10R1.54 O=C(O)CN1CCC(C1)I MCULE-4537982496 [1,0,0,0,0,0|2,0,1]=4 27 B10R1.54 O=C(O)CN1CCC(C1)O MCULE-7707471649 [1,0,0,0,0,0|1,0,1]=3 28 B10R1.54 O=C(O)CN1CCC(C1)O MCULE-8936002282 [1,0,0,0,0,0|1,0,1]=3 29 B10R1.54 O=C(O)CN1CC[C@@H](C1)O MCULE-1249814394 [1,0,0,0,0,0|1,0,1]=3 30 B10R1.54 O=C(O)CN1CC[C@@H](C1)O MCULE-2140738871 [1,0,0,0,0,0|1,0,1]=3 31 B10R1.54 O=C(O)CN1CC[C@H](C1)O MCULE-4416769889 [1,0,0,0,0,0|1,0,1]=3 32 B10R1.54 O=C(O)CN1CC[C@H](C1)O MCULE-4926367147 [1,0,0,0,0,0|1,0,1]=3 33 B10R1.54 O=C(O)C[C@@H]1CC(CN1)O MCULE-5520496479 [1,0,0,0,0,0|3,0,0]=4 34 B10R1.54 O=C(O)C[C@@H]1CC(CN1)O MCULE-9606256613 [1,0,0,0,0,0|3,0,0]=4 35 B10R1.54 O=C(O)C[C@@H]1CC[C@@H](C1)O MCULE-2394601749 [1,0,0,0,0,0|2,0,1]=4 36 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-1516021519 [1,0,0,0,0,0|3,0,0]=4 37 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-4246846585 [1,0,0,0,0,0|3,0,0]=4 38 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-5090681884 [1,0,0,0,0,0|3,0,0]=4 39 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-6554402545 [1,0,0,0,0,0|3,0,0]=4 40 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-8720083389 [1,0,0,0,0,0|3,0,0]=4 41 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-9359661762 [1,0,0,0,0,0|3,0,0]=4 42 B10R1.64 CC(=O)CN1CCCC1C MCULE-5489343795 [1,0,0,0,0,0|2,0,1]=4 43 B10R1.64 CC(=O)NN1CCCC1=O MCULE-1490773377 [1,0,0,0,0,0|2,0,0]=3 44 B10R1.64 CC(N)CN1CCCC1=O MCULE-5095143827 [1,0,0,0,0,0|1,0,1]=3 45 B10R1.64 CC(N)CN1CCOC1=O MCULE-2996526090 [1,0,0,0,0,0|2,0,1]=4 46 B10R1.64 CC(N)CN1CCOC1=O MCULE-5689560470 [1,0,0,0,0,0|2,0,1]=4 47 B10R1.64 CC(O)CN1CCCC1=O MCULE-1938738117 [1,0,0,0,0,0|1,0,2]=4 48 B10R1.64 CC1CCCN1CC(=O)O MCULE-5477147476 [1,0,0,0,0,0|2,0,1]=4 49 B10R1.64 CC1CCCN1CC(=O)O MCULE-7787437864 [1,0,0,0,0,0|2,0,1]=4 50 B10R1.64 CN(C)CN1CCCC1=O MCULE-1990095344 [1,0,0,0,0,0|3,0,0]=4 51 B10R1.64 C[C@H](N)CN1CCCC1=O MCULE-1860315177 [1,0,0,0,0,0|1,0,1]=3 52 B10R1.64 C[C@H](N)CN1CCCC1=O MCULE-2817634784 [1,0,0,0,0,0|1,0,1]=3 53 B10R1.64 C[C@H](N)CN1CCCC1=O MCULE-4282969334 [1,0,0,0,0,0|1,0,1]=3 54 B10R1.64 C[C@H](N)CN1CCCC1=O MCULE-4689124690 [1,0,0,0,0,0|1,0,1]=3 55 B10R1.64 C[NH+](C)CN1CCCC1=O MCULE-3833505116 [1,0,0,0,0,0|3,0,0]=4 56 B10R1.64 N=C1NCCN1CC(=O)O MCULE-1045168738 [1,0,0,0,0,0|3,0,0]=4 57 B10R1.64 N=C1SCCN1CC(=O)O MCULE-5189423573 [1,0,0,0,0,0|3,0,0]=4 58 B10R1.64 N=C1SCCN1CC(=O)O MCULE-5306867506 [1,0,0,0,0,0|3,0,0]=4 59 B10R1.64 NC(=O)CN1CCCC1=O MCULE-7645397226 [1,0,0,0,0,0|0,0,0]=1 60 B10R1.64 NC(=O)NC1CCCC1=O MCULE-8760589602 [1,0,0,0,0,0|2,0,0]=3 61 B10R1.64 NC(=S)CN1CCCC1=O MCULE-9902366579 [1,0,0,0,0,0|0,1,0]=2 62 B10R1.64 NC(=S)CN1CCOC1=O MCULE-7779174443 [1,0,0,0,0,0|1,1,0]=3 63 B10R1.64 O=C(Cl)CC1CCCC1=O MCULE-7029776897 [1,0,0,0,0,0|2,0,0]=3 64 B10R1.64 O=C(O)C=C1CCCC1=O MCULE-4459153895 [1,0,0,0,0,0|2,0,1]=4 65 B10R1.64 O=C(O)CC1CCCC1=O MCULE-9371811615 [1,0,0,0,0,0|2,0,0]=3 66 B10R1.64 O=C(O)CC1CCNC1=O MCULE-4096969007 [1,0,0,0,0,0|3,0,0]=4 67 B10R1.64 O=C(O)CN1CCCC1=O MCULE-3122232316 [1,0,0,0,0,0|1,0,0]=2 68 B10R1.64 O=C(O)CN1CCNC1=O MCULE-3675229228 [1,0,0,0,0,0|2,0,0]=3 69 B10R1.64 O=C(O)CN1CCOC1=O MCULE-4152481351 [1,0,0,0,0,0|2,0,0]=3 70 B10R1.64 O=C(O)CN1CCSC1=O MCULE-7099861777 [1,0,0,0,0,0|2,0,0]=3 71 B10R1.64 O=C(O)CN1CSCC1=O MCULE-8731328410 [1,0,0,0,0,0|2,0,0]=3 72 B10R1.130 CCCN1CC(CC1=O)N MCULE-1814384667 [1,0,0,0,0,0|2,0,1]=4 73 B10R1.130 CCCN1CC(CC1=O)N MCULE-3769290383 [1,0,0,0,0,0|2,0,1]=4 74 B10R1.130 CCCN1C[C@H](CC1=O)O MCULE-6013783989 [1,0,0,0,0,0|1,0,1]=3 75 B12R1.532 COC(=O)CN1CC(CC1=O)O MCULE-3435766506 [0,1,0,0,0,0|1,0,0]=2 76 B12R1.844 CC1(CC(=O)N(O1)CC(=O)O)C MCULE-1027741477 [0,1,0,0,0,0|3,0,0]=4 77 B12R1.1276 CC(=O)ON1CC(C(C1=O)N)C MCULE-6850073775 [0,1,0,0,0,0|3,0,0]=4 78 B12R1.1276 CC(=O)ON1C[C@@H]([C@@H](C1=O)N)C MCULE-7057151398 [0,1,0,0,0,0|3,0,0]=4 79 B12R1.1276 CC(=O)ON1C[C@H]([C@H](C1=O)N)C MCULE-5897109455 [0,1,0,0,0,0|3,0,0]=4 80 B10R0.32 CCOC(=O)N(C)CC(=O)O MCULE-9866294020 [0,0,1,0,0,0|3,0,0]=4 81 B10R0.32 CNCC(=O)N(C)CC(=O)O MCULE-2215254488 [0,0,1,0,0,0|3,0,0]=4 82 B10R0.32 COCC(=O)N(C)CC(=O)O MCULE-5380620856 [0,0,1,0,0,0|3,0,0]=4 83 B10R0.96 CC(=O)CC(=O)NCC(=O)O MCULE-8793325864 [0,0,1,0,0,0|1,0,2]=4 84 B10R0.96 CC(C)CC(=O)NCC(=O)O MCULE-8338157738 [0,0,1,0,0,0|2,0,0]=3 85 B10R0.96 CC(C)NC(=O)NCC(=O)O MCULE-6956868357 [0,0,1,0,0,0|3,0,0]=4 86 B12R2.1145 O=C(O)C1CC2CC(=O)C1C2 MCULE-9601771232 [0,0,0,1,0,0|3,0,0]=4 87 B12R2.1145 O=C(O)C1C[C@H]2CC(=O)[C@@H]1C2 MCULE-8622443304 [0,0,0,1,0,0|3,0,0]=4 88 B10R1.59 CC(=O)N1CC(OC1=O)C MCULE-3536795102 [0,0,0,0,1,0|3,0,0]=4 89 B10R1.59 O=C(O)N1CC(CC1=O)O MCULE-8810484712 [0,0,0,0,1,0|1,0,0]=2 90 B12R1.101 NC(=O)CN1CC(=O)NC(=O)C1 MCULE-1096711529 [0,0,0,0,0,1|1,0,2]=4 91 B9R0.2 CCCCCNCC(=O)N MCULE-1817354788 [1,0,1,0,0,0|1,0,1]=4 92 B9R0.2 CCCCCNCC(=O)N MCULE-5558188497 [1,0,1,0,0,0|1,0,1]=4 93 B9R0.2 O=CCCCCCC(=O)O MCULE-1442157793 [1,0,1,0,0,0|2,0,0]=4 94 B9R0.15 CC(=O)N(CCO)CCO MCULE-1068519018 [1,0,1,0,0,0|0,0,2]=4 95 B9R0.23 CCC(=O)N(C)CC(=O)O MCULE-1259899510 [1,0,1,0,0,0|1,0,0]=3 96 B9R0.23 CN(CC(=O)O)C(=O)CCl MCULE-5510442150 [1,0,1,0,0,0|2,0,0]=4 97 B9R0.23 CN(CC(=O)O)C(=O)CN MCULE-9356220331 [1,0,1,0,0,0|2,0,0]=4 98 B9R0.23 COC(=O)N(C)CC(=O)O MCULE-6066208018 [1,0,1,0,0,0|2,0,0]=4 99 B9R0.48 CCCC(=O)CCC(=O)C MCULE-2562578971 [1,0,1,0,0,0|2,0,0]=4 100 B9R0.48 CCCC(=O)CCC(=O)O MCULE-4809633073 [1,0,1,0,0,0|2,0,0]=4 101 B9R0.48 CCCC(=O)NCC(=O)N MCULE-4903049688 [1,0,1,0,0,0|0,0,0]=2 102 B9R0.48 CCCC(=O)NCC(=O)O MCULE-1331310812 [1,0,1,0,0,0|1,0,0]=3 103 B9R0.48 CCOC(=O)CCC(=O)N MCULE-4243878001 [1,0,1,0,0,0|2,0,0]=4 104 B9R0.48 CCOC(=O)NCC(=O)O MCULE-6050328577 [1,0,1,0,0,0|2,0,0]=4 105 B9R0.48 COCC(=O)NCC(=O)O MCULE-2679622476 [1,0,1,0,0,0|2,0,0]=4 106 B9R0.48 NCCC(=O)NCC(=O)O MCULE-4396558835 [1,0,1,0,0,0|2,0,0]=4 107 B9R0.48 NCCC(=O)NCC(=O)O MCULE-9256160395 [1,0,1,0,0,0|2,0,0]=4 108 B9R1.7 NCCN1CCC(C1)O MCULE-6486204934 [2,0,0,0,0,0|0,0,2]=4 109 B9R1.7 NCCN1CC[C@@H](C1)O MCULE-5099361761 [2,0,0,0,0,0|0,0,2]=4 110 B9R1.7 NCCN1CC[C@@H](C1)O MCULE-6257789938 [2,0,0,0,0,0|0,0,2]=4 111 B9R1.7 NCCN1CC[C@@H](C1)O MCULE-6897946390 [2,0,0,0,0,0|0,0,2]=4 112 B9R1.7 NCCN1CC[C@H](C1)O MCULE-6447258046 [2,0,0,0,0,0|0,0,2]=4 113 B9R1.7 NCCN1CC[C@H](C1)O MCULE-9790959431 [2,0,0,0,0,0|0,0,2]=4 114 B9R1.13 CC(=O)CN1CCCC1 MCULE-7257105125 [2,0,0,0,0,0|1,0,1]=4 115 B9R1.13 N=C(N)CN1CCCC1 MCULE-4701046871 [2,0,0,0,0,0|1,0,1]=4 116 B9R1.13 N=C(N)CN1CCCC1 MCULE-6983675892 [2,0,0,0,0,0|1,0,1]=4 117 B9R1.13 NC(=O)CC1CCCC1 MCULE-2082339108 [2,0,0,0,0,0|1,0,1]=4 118 B9R1.13 NC(=O)CC1CCCN1 MCULE-2142594957 [2,0,0,0,0,0|2,0,0]=4 119 B9R1.13 NC(=O)CC1CCCN1 MCULE-8011902334 [2,0,0,0,0,0|2,0,0]=4 120 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-2790931086 [2,0,0,0,0,0|2,0,0]=4 121 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-3723741843 [2,0,0,0,0,0|2,0,0]=4 122 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-3877903747 [2,0,0,0,0,0|2,0,0]=4 123 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-5587287647 [2,0,0,0,0,0|2,0,0]=4 124 B9R1.13 O=C(Cl)CN1CCCC1 MCULE-5855966340 [2,0,0,0,0,0|1,0,1]=4 125 B9R1.13 O=C(Cl)CN1CCCC1 MCULE-7423158222 [2,0,0,0,0,0|1,0,1]=4 126 B9R1.13 O=C(O)CC1=CCCC1 MCULE-5115478269 [2,0,0,0,0,0|2,0,0]=4 127 B9R1.13 O=C(O)CN1CCCC1 MCULE-3979513963 [2,0,0,0,0,0|1,0,1]=4 128 B9R1.13 O=C(O)CN1CCCC1 MCULE-4046939568 [2,0,0,0,0,0|1,0,1]=4 129 B9R1.33 C#CCN1CCCC1=O MCULE-2593192702 [2,0,0,0,0,0|1,0,1]=4 130 B9R1.33 C=CCC1CCCC1=O MCULE-9567921811 [2,0,0,0,0,0|2,0,0]=4 131 B9R1.33 C=CCN1CCCC1=O MCULE-5813823289 [2,0,0,0,0,0|1,0,0]=3 132 B9R1.33 C=CCN1CCNC1=O MCULE-9048630937 [2,0,0,0,0,0|2,0,0]=4 133 B9R1.33 CCCN1CCCC1=O MCULE-4645322719 [2,0,0,0,0,0|1,0,1]=4 134 B9R1.33 N#CCN1CCCC1=O MCULE-7806752058 [2,0,0,0,0,0|0,0,2]=4 135 B9R1.33 NCCN1CCCC1=O MCULE-4385413489 [2,0,0,0,0,0|0,0,1]=3 136 B9R1.33 NCCN1CCCC1=O MCULE-6558299461 [2,0,0,0,0,0|0,0,1]=3 137 B9R1.33 NCCN1CCCC1=O MCULE-8578984383 [2,0,0,0,0,0|0,0,1]=3 138 B9R1.33 NCCN1CCNC1=O MCULE-8206548892 [2,0,0,0,0,0|1,0,1]=4 139 B9R1.33 NCCN1CCOC1=O MCULE-2249111154 [2,0,0,0,0,0|1,0,1]=4 140 B9R1.33 NCCN1CCOC1=O MCULE-5564763400 [2,0,0,0,0,0|1,0,1]=4 141 B9R1.33 O=C1CCCN1C=CI MCULE-8124153384 [2,0,0,0,0,0|1,0,1]=4 142 B9R1.33 O=C1CCCN1CCBr MCULE-8609405083 [2,0,0,0,0,0|1,0,1]=4 143 B9R1.33 O=C1CCCN1CCCl MCULE-2170579993 [2,0,0,0,0,0|1,0,1]=4 144 B9R1.33 O=C1CCCN1CCI MCULE-5597930583 [2,0,0,0,0,0|1,0,1]=4 145 B9R1.33 O=C1CCCN1CCO MCULE-7117687978 [2,0,0,0,0,0|0,0,2]=4 146 B9R1.22 CCN1CC(CC1=O)N MCULE-3399064439 [2,0,0,0,0,0|1,0,1]=4 147 B9R1.22 CCN1CC(CC1=O)N MCULE-9447237222 [2,0,0,0,0,0|1,0,1]=4 148 B9R1.22 CCN1CC(CC1=O)O MCULE-3389024209 [2,0,0,0,0,0|0,0,1]=3 149 B9R1.22 CCN1C[C@H](CC1=O)O MCULE-9379641102 [2,0,0,0,0,0|0,0,1]=3 150 B11R0.43 COC(=O)CN(C)C(=O)CCCl MCULE-8122738680 [0,1,1,0,0,0|2,0,0]=4 151 B11R0.149 CC(C)CC(=O)N(C)CC(=O)O MCULE-2571328749 [0,1,1,0,0,0|2,0,0]=4 152 B11R0.33 CC(C)CC(=O)NC(C)C(=O)O MCULE-3764403032 [0,1,1,0,0,0|2,0,0]=4 153 B11R0.34 CC(C)(C)CC(=O)NCC(=O)O MCULE-7894138691 [0,1,1,0,0,0|2,0,0]=4 154 B11R0.34 CC(C)(C)OC(=O)NCC(=O)N MCULE-3574100957 [0,1,1,0,0,0|2,0,0]=4 155 B11R0.173 CC(C)[C@H](N)C(=O)NCC(=O)N MCULE-4754933584 [0,1,1,0,0,0|1,0,0]=3 156 B11R0.173 CC(C)[C@H](N)C(=O)NCC(=O)N MCULE-5752362218 [0,1,1,0,0,0|1,0,0]=3 157 B11R0.173 CC(C)[C@H](N)C(=O)NCC(=O)N MCULE-6703170058 [0,1,1,0,0,0|1,0,0]=3 158 B11R0.173 CC(C)[C@H](N)C(=O)NCC(=O)N MCULE-7994286284 [0,1,1,0,0,0|1,0,0]=3 159 B11R0.173 CC(C)[C@H](N)C(=O)NCC(=O)O MCULE-3864208578 [0,1,1,0,0,0|2,0,0]=4 160 B11R1.43 COC1CCN(C1)CC(=O)O MCULE-8169487800 [1,1,0,0,0,0|1,0,1]=4 161 B11R1.43 O=C(O)CN1CCC(C1)CO MCULE-3062534752 [1,1,0,0,0,0|1,0,1]=4 162 B11R1.710 NC(=O)CN1CCC(C1)(F)F MCULE-4569382730 [1,1,0,0,0,0|1,0,1]=4 163 B11R1.89 CC(C(=O)O)N1CCCC1=O MCULE-9190574225 [1,1,0,0,0,0|1,0,0]=3 164 B11R1.89 C[C@@H](C(=O)O)N1CCCC1=O MCULE-1695435983 [1,1,0,0,0,0|1,0,0]=3 165 B11R1.105 O=C1CCCN1CP(=O)(O)O MCULE-6722280609 [1,1,0,0,0,0|2,0,0]=4 166 B11R1.228 CC(CN)CN1CCCC1=O MCULE-3548868433 [1,1,0,0,0,0|1,0,1]=4 167 B11R1.228 COC(=O)CC1CCCC1=O MCULE-1943898216 [1,1,0,0,0,0|2,0,0]=4 168 B11R1.228 COC(=O)CN1CCCC1=O MCULE-7846371214 [1,1,0,0,0,0|1,0,0]=3 169 B11R1.228 COC(=O)CN1CCOC1=O MCULE-3500722271 [1,1,0,0,0,0|2,0,0]=4 170 B11R1.228 N/C(=N\O)/CN1CCCC1=O MCULE-1700287113 [1,1,0,0,0,0|0,0,1]=3 171 B11R1.228 NCC(O)CN1CCCC1=O MCULE-9467853643 [1,1,0,0,0,0|0,0,2]=4 172 B11R1.228 NNC(=O)CN1CCCC1=O MCULE-4805275941 [1,1,0,0,0,0|0,0,0]=2 173 B11R1.234 O=C(O)CN1CCCS1(=O)=O MCULE-1444102239 [1,1,0,0,0,0|2,0,0]=4 174 B11R1.495 CC(=O)CN1C(=O)CCC1=O MCULE-2644034739 [1,1,0,0,0,0|1,0,1]=4 175 B11R1.495 NC(=S)CN1C(=O)CCC1=O MCULE-8715026530 [1,1,0,0,0,0|0,1,1]=4 176 B11R1.495 O=C(O)CN1C(=O)CCC1=O MCULE-3966172669 [1,1,0,0,0,0|1,0,1]=4 177 B11R1.185 C=CCN1CC(CC1=O)CO MCULE-3057336255 [1,1,0,0,0,0|1,0,0]=3 178 B13R1.690 CCOC(=O)CN1CC(CC1=O)O MCULE-1297066254 [0,2,0,0,0,0|1,0,0]=3 179 B13R1.690 CCOC(=O)CN1C[C@@H](CC1=O)N MCULE-8646852231 [0,2,0,0,0,0|2,0,0]=4 180 B13R1.138 C=C(C)CN1CC(CC1=O)C(=O)O MCULE-3930389347 [0,2,0,0,0,0|2,0,0]=4 181 B13R1.138 O=C(O)CN1CC(CC1=O)C(=O)O MCULE-9910291732 [0,2,0,0,0,0|1,0,0]=3 182 B11R1.86 NC(=O)CC1CCCCC1=O MCULE-3971347881 [0,0,1,1,0,0|2,0,0]=4 183 B11R1.86 NC(=O)CN1CCCCC1=O MCULE-5240363696 [0,0,1,1,0,0|1,0,0]=3 184 B11R1.86 NC(=O)CN1CCNCC1=O MCULE-5666648477 [0,0,1,1,0,0|1,0,0]=3 185 B11R1.86 NC(=O)CN1CCNCC1=O MCULE-7550699579 [0,0,1,1,0,0|1,0,0]=3 186 B11R1.86 NC(=O)CN1CCNCC1=O MCULE-8146509218 [0,0,1,1,0,0|1,0,0]=3 187 B11R1.86 O=C(Cl)CN1CCCCC1=O MCULE-8291995808 [0,0,1,1,0,0|2,0,0]=4 188 B11R1.86 O=C(O)CN1CCCCC1=O MCULE-6673893259 [0,0,1,1,0,0|2,0,0]=4 189 B11R1.86 O=C(O)CN1CCNCC1=O MCULE-4839192117 [0,0,1,1,0,0|2,0,0]=4 190 B11R1.86 O=C(O)CN1CCNCC1=O MCULE-8916863898 [0,0,1,1,0,0|2,0,0]=4 191 B11R1.86 O=C(O)CN1CCOCC1=O MCULE-2251474090 [0,0,1,1,0,0|1,0,0]=3 192 B11R1.178 CC(=O)N1CCCC1C(=O)N MCULE-3826239589 [0,0,1,1,0,0|1,0,0]=3 193 B11R1.178 CC(=O)N1CCCC1C(=O)O MCULE-1813411528 [0,0,1,1,0,0|2,0,0]=4 194 B11R1.178 CC(=O)N1CCCC1C(=O)O MCULE-9022800854 [0,0,1,1,0,0|2,0,0]=4 195 B11R1.178 CC(=O)N1CCCC1C(=S)N MCULE-4542195039 [0,0,1,1,0,0|1,1,0]=4 196 B11R1.178 CC(=O)N1CCC[C@@H]1C(=O)O MCULE-1405603447 [0,0,1,1,0,0|2,0,0]=4 197 B11R1.178 CC(=O)N1CCC[C@@H]1C(=O)O MCULE-9216589773 [0,0,1,1,0,0|2,0,0]=4 198 B11R1.178 CC(=O)N1CCC[C@H]1C(=N)N MCULE-1919864106 [0,0,1,1,0,0|2,0,0]=4 199 B11R1.178 CC(=O)N1CCC[C@H]1C(=O)N MCULE-2667654412 [0,0,1,1,0,0|1,0,0]=3 200 B11R1.178 CC(=O)N1CCC[C@H]1C(=O)N MCULE-3510789923 [0,0,1,1,0,0|1,0,0]=3 201 B11R1.178 CC(=O)N1CCC[C@H]1C(=O)O MCULE-1169221802 [0,0,1,1,0,0|2,0,0]=4 202 B11R1.178 CC(=O)N1CCC[C@H]1C(=O)O MCULE-9915147289 [0,0,1,1,0,0|2,0,0]=4 203 B11R1.178 CC(=O)N1CCS[C@H]1C(=O)O MCULE-1643107830 [0,0,1,1,0,0|1,1,0]=4 204 B11R1.596 CCCN1C(=O)CC1C(=O)O MCULE-3045055027 [0,0,1,1,0,0|2,0,0]=4 205 B11R1.8 CCC1NC(=O)CN(C1=O)C MCULE-8400693412 [0,0,1,1,0,0|1,0,0]=3 206 B11R1.8 CN1CC(=O)N[C@H](C1=O)CO MCULE-6511003318 [0,0,1,1,0,0|0,0,0]=2 207 B11R1.159 CN1C(=O)CCCC1C(=O)O MCULE-2434427513 [0,0,1,1,0,0|2,0,0]=4 208 B11R1.719 CN(CC(=O)O)C(=O)C1CC1 MCULE-2988382122 [0,0,1,1,0,0|2,0,0]=4 209 B11R1.103 CC1CC1C(=O)NCC(=O)O MCULE-8688930104 [0,0,1,1,0,0|2,0,0]=4 210 B11R1.167 CC(C)C1NC(=O)CNC1=O MCULE-4291970196 [0,0,1,1,0,0|1,0,0]=3 211 B11R1.167 CC(C)C1NC(=O)CNC1=O MCULE-4390994872 [0,0,1,1,0,0|1,0,0]=3 212 B11R1.167 CC(C)[C@@H]1NC(=O)CNC1=O MCULE-8179867886 [0,0,1,1,0,0|1,0,0]=3 213 B11R1.167 CC(C)[C@H]1NC(=O)CNC1=O MCULE-6593694528 [0,0,1,1,0,0|1,0,0]=3 214 B11R1.167 CC(O)C1NC(=O)CNC1=O MCULE-8265308288 [0,0,1,1,0,0|0,0,0]=2 215 B11R1.167 O=C1CNC(=O)C(N1)C(=O)O MCULE-9729486152 [0,0,1,1,0,0|1,0,1]=4 216 B11R1.167 [C@@H]1(NC(=O)CNC1=O)C(C)C MCULE-1212098069 [0,0,1,1,0,0|1,0,0]=3 217 B11R1.167 [C@H]1(NC(=O)CNC1=O)C(C)C MCULE-7643648003 [0,0,1,1,0,0|1,0,0]=3 218 B11R2.36 O=C1CN2CCCC2CN1 MCULE-5107830244 [1,0,0,1,0,0|1,0,1]=4 219 B11R2.356 O=C1CC(CN1C2CC2)O MCULE-2966955490 [1,0,0,1,0,0|1,0,1]=4 220 B13R2.4935 O=C1CC2CC(=O)NC[C@@H](C1)C2 MCULE-9878646221 [0,0,0,1,0,1|2,0,0]=4 221 B9R0.7 CC(=O)CNC(=O)C(C)Cl MCULE-4419592009 [0,0,1,0,1,0|2,0,0]=4 222 B9R0.7 CC(C)C(=O)NCC(=O)O MCULE-8263786936 [0,0,1,0,1,0|2,0,0]=4 223 B9R0.7 CC(Cl)C(=O)NCC(=O)O MCULE-9908034208 [0,0,1,0,1,0|2,0,0]=4 224 B9R0.7 CC(N)C(=O)NCC(=O)N MCULE-4006646204 [0,0,1,0,1,0|1,0,0]=3 225 B9R0.7 CC(N)C(=O)NCC(=O)N MCULE-6349133598 [0,0,1,0,1,0|1,0,0]=3 226 B9R0.7 CC(N)C(=O)NCC(=O)N MCULE-7301508385 [0,0,1,0,1,0|1,0,0]=3 227 B9R0.7 CC(N)C(=O)NCC(=O)O MCULE-5334499783 [0,0,1,0,1,0|2,0,0]=4 228 B9R0.7 CC(S)C(=O)NCC(=O)O MCULE-8593628629 [0,0,1,0,1,0|1,1,0]=4 229 B9R0.7 C[C@@H](N)C(=O)NCC(=O)O MCULE-1572586456 [0,0,1,0,1,0|2,0,0]=4 230 B9R0.7 C[C@@H](N)C(=O)NCC(=O)O MCULE-2334963197 [0,0,1,0,1,0|2,0,0]=4 231 B9R0.7 C[C@@H](N)C(=O)NCC(=O)O MCULE-3041567092 [0,0,1,0,1,0|2,0,0]=4 232 B9R0.7 C[C@@H](N)C(=O)NCC(=O)O MCULE-5810433569 [0,0,1,0,1,0|2,0,0]=4 233 B9R0.7 C[C@H](N)C(=O)NCC(=O)N MCULE-4603378022 [0,0,1,0,1,0|1,0,0]=3 234 B9R0.7 C[C@H](N)C(=O)NCC(=O)N MCULE-6766283783 [0,0,1,0,1,0|1,0,0]=3 235 B9R0.7 C[C@H](N)C(=O)NCC(=O)N MCULE-9070332994 [0,0,1,0,1,0|1,0,0]=3 236 B9R0.7 C[C@H](N)C(=O)NCC(=O)N MCULE-9863378410 [0,0,1,0,1,0|1,0,0]=3 237 B9R0.7 C[C@H](N)C(=O)NCC(=O)O MCULE-1231323853 [0,0,1,0,1,0|2,0,0]=4 238 B9R0.7 C[C@H](N)C(=O)NCC(=O)O MCULE-6793382418 [0,0,1,0,1,0|2,0,0]=4 239 B9R0.7 C[C@H](S)C(=O)NCC(=O)O MCULE-3909668002 [0,0,1,0,1,0|1,1,0]=4 240 B9R1.35 C1(CCN(C1)C(=O)C)O MCULE-2995435877 [1,0,0,0,1,0|1,0,1]=4 241 B9R1.35 CC(=O)N1CCC(C1)O MCULE-4508537142 [1,0,0,0,1,0|1,0,1]=4 242 B9R1.35 CC(=O)N1CC[C@@H](C1)O MCULE-4145127323 [1,0,0,0,1,0|1,0,1]=4 243 B9R1.35 CC(=O)N1CC[C@@H](C1)O MCULE-8205833952 [1,0,0,0,1,0|1,0,1]=4 244 B9R1.35 CC(=O)N1CC[C@H](C1)O MCULE-1031340554 [1,0,0,0,1,0|1,0,1]=4 245 B9R1.35 CC(=O)N1CC[C@H](C1)O MCULE-1348897751 [1,0,0,0,1,0|1,0,1]=4 246 B9R1.35 N=C(N)N1CCC(C1)O MCULE-4691653250 [1,0,0,0,1,0|1,0,1]=4 247 B9R1.35 N=C(N)N1CCC(C1)O MCULE-6578584286 [1,0,0,0,1,0|1,0,1]=4 248 B9R1.35 NC(=O)C1CC(CN1)O MCULE-8628888959 [1,0,0,0,1,0|2,0,0]=4 249 B9R1.35 NC(=O)C1CC(CN1)O MCULE-9327040437 [1,0,0,0,1,0|2,0,0]=4 250 B9R1.35 NC(=O)N1CCC(C1)N MCULE-1767398338 [1,0,0,0,1,0|1,0,1]=4 251 B9R1.35 NC(=O)N1CCC(C1)N MCULE-2883297977 [1,0,0,0,1,0|1,0,1]=4 252 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)O MCULE-1506534259 [1,0,0,0,1,0|2,0,0]=4 253 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)O MCULE-4335155413 [1,0,0,0,1,0|2,0,0]=4 254 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-1442980635 [1,0,0,0,1,0|2,0,0]=4 255 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-4854132547 [1,0,0,0,1,0|2,0,0]=4 256 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-8175631848 [1,0,0,0,1,0|2,0,0]=4 257 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-9092665787 [1,0,0,0,1,0|2,0,0]=4 258 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-1212665796 [1,0,0,0,1,0|2,0,0]=4 259 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-2172080185 [1,0,0,0,1,0|2,0,0]=4 260 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-2463066874 [1,0,0,0,1,0|2,0,0]=4 261 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-7245012102 [1,0,0,0,1,0|2,0,0]=4 262 B9R1.53 NC(=O)CC1CC(C1)N MCULE-4414712655 [1,0,0,0,1,0|2,0,0]=4 263 B9R1.53 NC(=O)CC1CC(C1)N MCULE-6104457108 [1,0,0,0,1,0|2,0,0]=4 264 B9R1.41 CC(=O)C1CCCC1=O MCULE-8152440536 [1,0,0,0,1,0|2,0,0]=4 265 B9R1.41 CC(=O)N1CCCC1=O MCULE-3328735907 [1,0,0,0,1,0|1,0,0]=3 266 B9R1.41 CC(=O)N1CCNC1=O MCULE-9582889409 [1,0,0,0,1,0|2,0,0]=4 267 B9R1.41 CC(=O)N1CCOC1=O MCULE-6944210144 [1,0,0,0,1,0|2,0,0]=4 268 B9R1.41 N=C(N)N1CCCC1=O MCULE-2949809967 [1,0,0,0,1,0|1,0,0]=3 269 B9R1.41 N=C(N)N1CCCC1=O MCULE-3208253060 [1,0,0,0,1,0|1,0,0]=3 270 B9R1.41 NC(=O)C1CCCC1=O MCULE-2399127943 [1,0,0,0,1,0|1,0,0]=3 271 B9R1.41 NC(=O)C1CSCC1=O MCULE-9294547014 [1,0,0,0,1,0|2,0,0]=4 272 B9R1.41 NC(=O)N1CCCC1=O MCULE-5194166141 [1,0,0,0,1,0|0,0,0]=2 273 B9R1.41 O=C(Cl)C1CCCC1=O MCULE-1186628152 [1,0,0,0,1,0|2,0,0]=4 274 B9R1.41 O=C(Cl)N1CCCC1=O MCULE-4360774967 [1,0,0,0,1,0|1,0,0]=3 275 B9R1.41 O=C(Cl)N1CCNC1=O MCULE-6015702584 [1,0,0,0,1,0|2,0,0]=4 276 B9R1.41 O=C(Cl)N1CCOC1=O MCULE-2077780134 [1,0,0,0,1,0|2,0,0]=4 277 B9R1.41 O=C(O)C1CCCC1=O MCULE-9500236289 [1,0,0,0,1,0|2,0,0]=4 278 B9R1.41 O=C(O)N1CCNC1=O MCULE-2423498210 [1,0,0,0,1,0|2,0,0]=4 279 B9R1.41 O=C(O)N1CCOC1=O MCULE-1134006173 [1,0,0,0,1,0|2,0,0]=4 280 B11R0.85 CC(=O)NCC(=O)NCC(=O)N MCULE-8528768403 [0,0,1,0,0,1|0,0,2]=4 281 B11R0.85 CC(C)CCC(=O)NCC(=O)O MCULE-9958753385 [0,0,1,0,0,1|2,0,0]=4 282 B11R0.85 CC(C)CNC(=O)NCC(=O)O MCULE-3206648590 [0,0,1,0,0,1|2,0,0]=4 283 B11R0.85 CC(C)SCC(=O)NCC(=O)N MCULE-2600102713 [0,0,1,0,0,1|1,0,0]=3 284 B11R0.85 NC(=O)CNC(=O)CCC(=O)O MCULE-2519011568 [0,0,1,0,0,1|1,0,1]=4