0 B9R0.7 C(N)(CCC(=O)[O-])C(=O)O MCULE-5359010340 [0,0,0,0,0,0|3,0,1]=4 1 B9R0.7 C=C(CCC(=O)O)C(=O)O MCULE-3502029665 [0,0,0,0,0,0|3,0,1]=4 2 B9R0.7 CC(=CCC(N)C(=O)O)C MCULE-9020150203 [0,0,0,0,0,0|4,0,0]=4 3 B9R0.7 CC(=CC[C@@H](N)C(=O)O)C MCULE-7822845293 [0,0,0,0,0,0|4,0,0]=4 4 B9R0.7 CC(=CC[C@H](N)C(=O)O)C MCULE-6208618845 [0,0,0,0,0,0|4,0,0]=4 5 B9R0.7 CC(=O)C(C)CCC(=O)O MCULE-9124111940 [0,0,0,0,0,0|4,0,0]=4 6 B9R0.7 CC(=O)OCC(N)C(=O)O MCULE-4063734192 [0,0,0,0,0,0|3,0,1]=4 7 B9R0.7 CC(=O)OCC(N)C(=O)O MCULE-6252379108 [0,0,0,0,0,0|3,0,1]=4 8 B9R0.7 CC(=O)OCC(N)C(=O)O MCULE-6448707862 [0,0,0,0,0,0|3,0,1]=4 9 B9R0.7 CC(=O)OCC(N)C(=O)O MCULE-8255582994 [0,0,0,0,0,0|3,0,1]=4 10 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O MCULE-2377153563 [0,0,0,0,0,0|3,0,1]=4 11 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O MCULE-2469027462 [0,0,0,0,0,0|3,0,1]=4 12 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O MCULE-4796013964 [0,0,0,0,0,0|3,0,1]=4 13 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O MCULE-9408226443 [0,0,0,0,0,0|3,0,1]=4 14 B9R0.7 CC(=O)OC[C@H](N)C(=O)O MCULE-1751945139 [0,0,0,0,0,0|3,0,1]=4 15 B9R0.7 CC(=O)OC[C@H](N)C(=O)O MCULE-3822387628 [0,0,0,0,0,0|3,0,1]=4 16 B9R0.7 CC(=O)OC[C@H](N)C(=O)O MCULE-6052634347 [0,0,0,0,0,0|3,0,1]=4 17 B9R0.7 CC(=O)OC[C@H](N)C(=O)O MCULE-6909390355 [0,0,0,0,0,0|3,0,1]=4 18 B9R0.7 CC(=O)SCC(C)C(=O)O MCULE-5116238206 [0,0,0,0,0,0|3,0,1]=4 19 B9R0.7 CC(=O)SCC(N)C(=O)O MCULE-2891442308 [0,0,0,0,0,0|3,0,1]=4 20 B9R0.7 CC(=O)SCC(N)C(=O)O MCULE-4623851451 [0,0,0,0,0,0|3,0,1]=4 21 B9R0.7 CC(=O)SC[C@@H](C)C(=O)O MCULE-8028939364 [0,0,0,0,0,0|3,0,1]=4 22 B9R0.7 CC(=O)SC[C@@H](C)C(=O)O MCULE-8973266419 [0,0,0,0,0,0|3,0,1]=4 23 B9R0.7 CC(=O)SC[C@H](N)C(=O)O MCULE-1698125004 [0,0,0,0,0,0|3,0,1]=4 24 B9R0.7 CC(=O)SC[C@H](N)C(=O)O MCULE-6046193594 [0,0,0,0,0,0|3,0,1]=4 25 B9R0.7 CC(C)CCC(F)C(=O)O MCULE-1179378327 [0,0,0,0,0,0|3,0,1]=4 26 B9R0.7 CC(CCC(=O)O)C(=O)O MCULE-1523371907 [0,0,0,0,0,0|3,0,0]=3 27 B9R0.7 CC(CCC(=O)O)C(=O)O MCULE-1939523418 [0,0,0,0,0,0|3,0,0]=3 28 B9R0.7 CC(CNC(=O)N)C(=O)O MCULE-6367938073 [0,0,0,0,0,0|1,0,2]=3 29 B9R0.7 CC(NCC(=O)O)C(=O)O MCULE-1111290878 [0,0,0,0,0,0|4,0,0]=4 30 B9R0.7 CC(NCC(=O)O)C(=O)O MCULE-6569987660 [0,0,0,0,0,0|4,0,0]=4 31 B9R0.7 CC(SCC(=O)O)C(=O)O MCULE-8523268796 [0,0,0,0,0,0|4,0,0]=4 32 B9R0.7 C[C@@H](CCC(=O)O)C(=O)O MCULE-7515023265 [0,0,0,0,0,0|3,0,0]=3 33 B9R0.7 C[C@H](CCC(=O)O)C(=O)O MCULE-8441860655 [0,0,0,0,0,0|3,0,0]=3 34 B9R0.7 C[C@H](CCC(=O)O)C(=O)O MCULE-9071150671 [0,0,0,0,0,0|3,0,0]=3 35 B9R0.7 C[C@H](NCC(=O)O)C(=O)O MCULE-1511229567 [0,0,0,0,0,0|4,0,0]=4 36 B9R0.7 C[C@H](NCC(=O)O)C(=O)O MCULE-4530562082 [0,0,0,0,0,0|4,0,0]=4 37 B9R0.7 N=C(N)NCC(N)C(=O)O MCULE-1177262947 [0,0,0,0,0,0|2,0,0]=2 38 B9R0.7 N=C(N)NCC(N)C(=O)O MCULE-2474644851 [0,0,0,0,0,0|2,0,0]=2 39 B9R0.7 N=C(N)NCC(N)C(=O)O MCULE-5671557476 [0,0,0,0,0,0|2,0,0]=2 40 B9R0.7 N=C(N)NC[C@H](N)C(=O)O MCULE-3050097417 [0,0,0,0,0,0|2,0,0]=2 41 B9R0.7 N=C(N)NC[C@H](N)C(=O)O MCULE-3499032906 [0,0,0,0,0,0|2,0,0]=2 42 B9R0.7 N=C(N)NC[C@H](N)C(=O)O MCULE-4835798272 [0,0,0,0,0,0|2,0,0]=2 43 B9R0.7 N=C(N)NC[C@H](N)C(=O)O MCULE-8355456866 [0,0,0,0,0,0|2,0,0]=2 44 B9R0.7 N=C(N)NC[C@H](N)C(=O)O MCULE-8635327390 [0,0,0,0,0,0|2,0,0]=2 45 B9R0.7 NC(=O)C(N)CCC(=O)O MCULE-7109792615 [0,0,0,0,0,0|4,0,0]=4 46 B9R0.7 NC(=O)C(N)CCC(=O)O MCULE-8741984156 [0,0,0,0,0,0|4,0,0]=4 47 B9R0.7 NC(=O)CCC(N)C(=O)O MCULE-1418655814 [0,0,0,0,0,0|2,0,2]=4 48 B9R0.7 NC(=O)CC[C@@H](N)C(=O)O MCULE-7870225738 [0,0,0,0,0,0|2,0,2]=4 49 B9R0.7 NC(=O)CC[C@@H](N)C(=O)O MCULE-9711806580 [0,0,0,0,0,0|2,0,2]=4 50 B9R0.7 NC(=O)CC[C@H](N)C(=O)O MCULE-7234937947 [0,0,0,0,0,0|2,0,2]=4 51 B9R0.7 NC(=O)CC[C@H](N)C(=O)O MCULE-8718820108 [0,0,0,0,0,0|2,0,2]=4 52 B9R0.7 NC(=O)NCC(N)C(=O)O MCULE-4609961006 [0,0,0,0,0,0|1,0,2]=3 53 B9R0.7 NC(=O)NC[C@@H](N)C(=O)O MCULE-7506737023 [0,0,0,0,0,0|1,0,2]=3 54 B9R0.7 NC(=O)NC[C@H](N)C(=O)O MCULE-3123973606 [0,0,0,0,0,0|1,0,2]=3 55 B9R0.7 NC(=O)NC[C@H]([NH3+])C(=O)[O-] MCULE-2674726108 [0,0,0,0,0,0|1,0,3]=4 56 B9R0.7 NC(=O)SCC(N)C(=O)O MCULE-7865241343 [0,0,0,0,0,0|2,0,2]=4 57 B9R0.7 NC(=O)SC[C@H](N)C(=O)O MCULE-6647567669 [0,0,0,0,0,0|2,0,2]=4 58 B9R0.7 NC(=O)SC[C@H](N)C(=O)O MCULE-7995535877 [0,0,0,0,0,0|2,0,2]=4 59 B9R0.7 NC(=O)[C@@H](N)CCC(=O)O MCULE-7404893649 [0,0,0,0,0,0|4,0,0]=4 60 B9R0.7 NC(=O)[C@@H](N)CCC(=O)O MCULE-7580681383 [0,0,0,0,0,0|4,0,0]=4 61 B9R0.7 NC(=O)[C@H](N)CCC(=O)O MCULE-3142698040 [0,0,0,0,0,0|4,0,0]=4 62 B9R0.7 NC(=O)[C@H](N)CCC(=O)O MCULE-3865619229 [0,0,0,0,0,0|4,0,0]=4 63 B9R0.7 NC(=O)[C@H](N)CCC(=O)O MCULE-8184010011 [0,0,0,0,0,0|4,0,0]=4 64 B9R0.7 NC(=O)[C@H](N)CCC(=O)O MCULE-8981731652 [0,0,0,0,0,0|4,0,0]=4 65 B9R0.7 NC(CCC(=O)O)C(=O)O MCULE-4203507491 [0,0,0,0,0,0|3,0,0]=3 66 B9R0.7 NC(CCC(=O)O)C(=O)O MCULE-4600207704 [0,0,0,0,0,0|3,0,0]=3 67 B9R0.7 NC(CCC(=O)O)C(=O)O MCULE-8107432729 [0,0,0,0,0,0|3,0,0]=3 68 B9R0.7 NC(CCC(=O)[O-])C(=O)O MCULE-5012956158 [0,0,0,0,0,0|3,0,1]=4 69 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O MCULE-6077524166 [0,0,0,0,0,0|3,0,0]=3 70 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O MCULE-7201150413 [0,0,0,0,0,0|3,0,0]=3 71 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O MCULE-7328895736 [0,0,0,0,0,0|3,0,0]=3 72 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O MCULE-7782530856 [0,0,0,0,0,0|3,0,0]=3 73 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O MCULE-9447720868 [0,0,0,0,0,0|3,0,0]=3 74 B9R0.7 N[C@@H](CCC(=O)O)C(=O)[O-] MCULE-3042990215 [0,0,0,0,0,0|3,0,1]=4 75 B9R0.7 N[C@@H](CCC(=O)[O-])C(=O)O MCULE-2315425063 [0,0,0,0,0,0|3,0,1]=4 76 B9R0.7 N[C@@H](CCC(=O)[O-])C(=O)O MCULE-4367391999 [0,0,0,0,0,0|3,0,1]=4 77 B9R0.7 N[C@H](CCC(=O)O)C(=O)O MCULE-5884691541 [0,0,0,0,0,0|3,0,0]=3 78 B9R0.7 N[C@H](CCC(=O)O)C(=O)O MCULE-6647836957 [0,0,0,0,0,0|3,0,0]=3 79 B9R0.7 O=C(O)CCC(=O)C(=O)O MCULE-5148157449 [0,0,0,0,0,0|3,0,1]=4 80 B9R0.7 O=C(O)CCC(Cl)C(=O)O MCULE-8696439839 [0,0,0,0,0,0|2,1,0]=3 81 B9R0.7 O=C(O)CCC(O)C(=O)O MCULE-5732806069 [0,0,0,0,0,0|3,0,0]=3 82 B9R0.7 O=C(O)CC[C@@H](O)C(=O)O MCULE-2990674754 [0,0,0,0,0,0|3,0,0]=3 83 B9R0.7 O=C(O)CC[C@@H](O)C(=O)O MCULE-9463608806 [0,0,0,0,0,0|3,0,0]=3 84 B9R0.7 O=C(O)CC[C@H](Br)C(=O)O MCULE-3541564241 [0,0,0,0,0,0|2,1,0]=3 85 B9R0.7 O=C(O)CC[C@H](Br)C(=O)O MCULE-5484001209 [0,0,0,0,0,0|2,1,0]=3 86 B9R0.7 O=C(O)CC[C@H](Cl)C(=O)O MCULE-4338578978 [0,0,0,0,0,0|2,1,0]=3 87 B9R0.7 O=C(O)CC[C@H](O)C(=O)O MCULE-4494756126 [0,0,0,0,0,0|3,0,0]=3 88 B9R0.7 P(=O)(O)CC[C@H](N)C(=O)O MCULE-2875179933 [0,0,0,0,0,0|4,0,0]=4 89 B9R0.7 [C@H](N)(CCC(=O)O)C(=O)N MCULE-1881473683 [0,0,0,0,0,0|4,0,0]=4 90 B9R0.7 [C@H](N)(CCC(=O)O)C(=O)O MCULE-8526087521 [0,0,0,0,0,0|3,0,0]=3 91 B9R0.7 [C@H](O)(CCC(=O)O)C(=O)O MCULE-8564542509 [0,0,0,0,0,0|3,0,0]=3 92 B8R0.8 C=CCCC(C)C(=O)O MCULE-3089071984 [1,0,0,0,0,0|3,0,0]=4 93 B8R0.8 C=CCCC(N)C(=O)O MCULE-1524160350 [1,0,0,0,0,0|3,0,0]=4 94 B8R0.8 C=CCCC(N)C(=O)O MCULE-5522822192 [1,0,0,0,0,0|3,0,0]=4 95 B8R0.8 C=CCCC(N)C(=O)O MCULE-7998584890 [1,0,0,0,0,0|3,0,0]=4 96 B8R0.8 C=CCC[C@@H](N)C(=O)O MCULE-4571532321 [1,0,0,0,0,0|3,0,0]=4 97 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-2235047291 [1,0,0,0,0,0|3,0,0]=4 98 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-4644458098 [1,0,0,0,0,0|3,0,0]=4 99 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-7821274952 [1,0,0,0,0,0|3,0,0]=4 100 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-9807212949 [1,0,0,0,0,0|3,0,0]=4 101 B8R0.8 CCCCC(F)C(=O)O MCULE-2276381656 [1,0,0,0,0,0|2,0,1]=4 102 B8R0.8 CCNCC(C)C(=O)O MCULE-3863191122 [1,0,0,0,0,0|2,0,1]=4 103 B8R0.8 CCNCC(C)C(=O)O MCULE-4164323563 [1,0,0,0,0,0|2,0,1]=4 104 B8R0.8 NC(CCCO)C(=O)O MCULE-5421732564 [1,0,0,0,0,0|2,0,1]=4 105 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-3220645027 [1,0,0,0,0,0|2,0,1]=4 106 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-4608316868 [1,0,0,0,0,0|2,0,1]=4 107 B8R0.8 O=C(O)C(O)CCCO MCULE-9386031706 [1,0,0,0,0,0|2,0,1]=4 108 B8R0.8 [C@@H](N)(CCC=C)C(=O)O MCULE-9648209291 [1,0,0,0,0,0|3,0,0]=4 109 B8R0.28 C=C(Br)CCCC(=O)O MCULE-5394609034 [1,0,0,0,0,0|3,0,0]=4 110 B8R0.28 C=C(C)CCCC(=O)O MCULE-1282031449 [1,0,0,0,0,0|3,0,0]=4 111 B8R0.28 C=C(Cl)CCCC(=O)O MCULE-9525654231 [1,0,0,0,0,0|3,0,0]=4 112 B8R0.28 CC(=CCCC(=O)O)C MCULE-5848388333 [1,0,0,0,0,0|3,0,0]=4 113 B8R0.28 CC(=O)CCCC(=O)O MCULE-2498129200 [1,0,0,0,0,0|2,0,1]=4 114 B8R0.28 CC(=O)NCCC(=O)N MCULE-6090839432 [1,0,0,0,0,0|2,0,1]=4 115 B8R0.28 CC(=O)NCCC(=O)O MCULE-8867286578 [1,0,0,0,0,0|1,0,1]=3 116 B8R0.28 CC(=O)OCCC(=O)O MCULE-6617841906 [1,0,0,0,0,0|2,0,1]=4 117 B8R0.28 CC(=O)SCCC(=O)O MCULE-2263963171 [1,0,0,0,0,0|2,0,1]=4 118 B8R0.28 CC(C)NCCC(=O)O MCULE-2087792459 [1,0,0,0,0,0|2,0,1]=4 119 B8R0.28 CC(C)NCCC(=O)O MCULE-6893587807 [1,0,0,0,0,0|2,0,1]=4 120 B8R0.28 CC(O)CCCC(=O)O MCULE-6696855762 [1,0,0,0,0,0|2,0,1]=4 121 B8R0.28 N=C(N)NCCC(=O)O MCULE-6783592689 [1,0,0,0,0,0|1,0,0]=2 122 B8R0.28 N=C(N)SCCC(=O)O MCULE-6820090813 [1,0,0,0,0,0|2,0,0]=3 123 B8R0.28 N=C(N)SCCC(=O)O MCULE-9820250060 [1,0,0,0,0,0|2,0,0]=3 124 B8R0.28 N=C(S)NCCC(=O)O MCULE-7149670288 [1,0,0,0,0,0|0,1,0]=2 125 B8R0.28 NC(=O)CCCC(=O)O MCULE-9714346244 [1,0,0,0,0,0|1,0,2]=4 126 B8R0.28 NC(=O)NCCC(=O)O MCULE-3799706782 [1,0,0,0,0,0|0,0,2]=3 127 B8R0.28 NC(=S)SCCC(=O)O MCULE-1371836153 [1,0,0,0,0,0|1,1,1]=4 128 B8R0.28 O=C(O)/C=C/CC(=O)O MCULE-3754065542 [1,0,0,0,0,0|2,0,1]=4 129 B8R0.28 O=C(O)C=CCC(=O)O MCULE-2034660220 [1,0,0,0,0,0|2,0,1]=4 130 B8R0.28 O=C(O)CCCC(=O)O MCULE-4286022994 [1,0,0,0,0,0|2,0,0]=3 131 B8R0.28 O=C(O)CNCC(=O)O MCULE-4131542591 [1,0,0,0,0,0|3,0,0]=4 132 B8R0.28 O=C(O)COCC(=O)O MCULE-5687758679 [1,0,0,0,0,0|3,0,0]=4 133 B8R0.28 O=C(O)CSCC(=O)O MCULE-8112166808 [1,0,0,0,0,0|3,0,0]=4 134 B10R0.13 C[C@@H](CC(=O)O)[C@@H](N)C(=O)O MCULE-3332620674 [0,1,0,0,0,0|3,0,0]=4 135 B10R0.13 C[C@@H](CC(=O)O)[C@H](N)C(=O)O MCULE-1191810017 [0,1,0,0,0,0|3,0,0]=4 136 B10R0.13 C[C@H](CC(=O)O)[C@@H](N)C(=O)O MCULE-6898866017 [0,1,0,0,0,0|3,0,0]=4 137 B10R0.13 C[C@H](CC(=O)O)[C@H](N)C(=O)O MCULE-5584040869 [0,1,0,0,0,0|3,0,0]=4 138 B10R0.13 N[C@@H](C(=O)O)[C@H](O)CC(=O)O MCULE-6540374220 [0,1,0,0,0,0|3,0,0]=4 139 B10R0.13 N[C@H](C(=O)O)[C@@H](F)CC(=O)O MCULE-4546449636 [0,1,0,0,0,0|3,0,0]=4 140 B10R0.43 CC(=O)NCC(C)(C)C(=O)O MCULE-5666730658 [0,1,0,0,0,0|2,0,1]=4 141 B10R0.43 CC(C)(CCC(=O)O)C(=O)O MCULE-3722680536 [0,1,0,0,0,0|3,0,0]=4 142 B10R0.43 CC(N)(CCC(=O)O)C(=O)O MCULE-3734637690 [0,1,0,0,0,0|3,0,0]=4 143 B10R0.43 C[C@@](N)(CCC(=O)O)C(=O)O MCULE-5201150112 [0,1,0,0,0,0|3,0,0]=4 144 B10R0.43 O=C(O)CCC(F)(F)C(=O)O MCULE-3909124499 [0,1,0,0,0,0|2,0,0]=3 145 B10R0.57 C(N)(CCC(=O)O)C(=O)OC MCULE-6082605624 [0,1,0,0,0,0|3,0,0]=4 146 B10R0.57 COC(=O)C(N)CCC(=O)O MCULE-3294558028 [0,1,0,0,0,0|3,0,0]=4 147 B10R0.57 COC(=O)C(N)CCC(=O)O MCULE-4645787805 [0,1,0,0,0,0|3,0,0]=4 148 B10R0.57 COC(=O)C(N)CCC(=O)O MCULE-8573479107 [0,1,0,0,0,0|3,0,0]=4 149 B10R0.57 COC(=O)[C@@H](N)CCC(=O)O MCULE-3694424519 [0,1,0,0,0,0|3,0,0]=4 150 B10R0.57 COC(=O)[C@@H](N)CCC(=O)O MCULE-3908913342 [0,1,0,0,0,0|3,0,0]=4 151 B10R0.57 COC(=O)[C@H](N)CCC(=O)O MCULE-4899971591 [0,1,0,0,0,0|3,0,0]=4 152 B10R0.57 COC(=O)[C@H](N)CCC(=O)O MCULE-5340713177 [0,1,0,0,0,0|3,0,0]=4 153 B10R0.57 COC(=O)[C@H](N)CCC(=O)O MCULE-6573369964 [0,1,0,0,0,0|3,0,0]=4 154 B10R0.57 COC(=O)[C@H](N)CCC(=O)O MCULE-9402335659 [0,1,0,0,0,0|3,0,0]=4 155 B10R0.82 COC(=O)CCC(N)C(=O)O MCULE-1417445261 [0,1,0,0,0,0|3,0,0]=4 156 B10R0.82 COC(=O)CCC(N)C(=O)O MCULE-1495018790 [0,1,0,0,0,0|3,0,0]=4 157 B10R0.82 COC(=O)CC[C@@H](N)C(=O)O MCULE-3233905582 [0,1,0,0,0,0|3,0,0]=4 158 B10R0.82 COC(=O)CC[C@@H](N)C(=O)O MCULE-4870656159 [0,1,0,0,0,0|3,0,0]=4 159 B10R0.82 COC(=O)CC[C@H](N)C(=O)O MCULE-1607830290 [0,1,0,0,0,0|3,0,0]=4 160 B10R0.82 COC(=O)CC[C@H](N)C(=O)O MCULE-7380350089 [0,1,0,0,0,0|3,0,0]=4 161 B10R0.82 COC(=O)CC[C@H](N)C(=O)O MCULE-7654158848 [0,1,0,0,0,0|3,0,0]=4 162 B10R0.82 COC(=O)CC[C@H](N)C(=O)O MCULE-8680968839 [0,1,0,0,0,0|3,0,0]=4 163 B10R0.82 NC(CCC(=O)NO)C(=O)O MCULE-9353366308 [0,1,0,0,0,0|3,0,0]=4 164 B10R0.84 CNC(CCC(=O)O)C(=O)O MCULE-7159441787 [0,1,0,0,0,0|3,0,0]=4 165 B10R0.84 CNC(CCC(=O)O)C(=O)O MCULE-9982940361 [0,1,0,0,0,0|3,0,0]=4 166 B10R0.84 CN[C@@H](CCC(=O)O)C(=O)O MCULE-1322979818 [0,1,0,0,0,0|3,0,0]=4 167 B10R0.84 CN[C@@H](CCC(=O)O)C(=O)O MCULE-9405643691 [0,1,0,0,0,0|3,0,0]=4 168 B10R0.84 CN[C@H](CCC(=O)O)C(=O)O MCULE-1735782000 [0,1,0,0,0,0|3,0,0]=4 169 B10R0.93 CC(CC(C)C(=O)O)C(=O)O MCULE-1153209267 [0,1,0,0,0,0|3,0,0]=4 170 B10R0.93 CC(CC(N)C(=O)O)C(=O)O MCULE-4117547649 [0,1,0,0,0,0|3,0,0]=4 171 B10R0.93 C[C@H](C[C@H](N)C(=O)O)C(=O)O MCULE-2754578678 [0,1,0,0,0,0|3,0,0]=4 172 B10R0.93 C[C@H](C[C@H](N)C(=O)O)C(=O)O MCULE-7169309772 [0,1,0,0,0,0|3,0,0]=4 173 B10R0.93 NC(=O)[C@H](F)C[C@H](N)C(=O)O MCULE-6469307664 [0,1,0,0,0,0|3,0,0]=4 174 B10R0.93 NC(=O)[C@H](F)C[C@H](N)C(=O)O MCULE-6602424535 [0,1,0,0,0,0|3,0,0]=4 175 B10R0.93 NC(CC(F)C(=O)O)C(=O)O MCULE-9589470454 [0,1,0,0,0,0|2,0,0]=3 176 B10R0.93 NC(CC(N)C(=O)O)C(=O)O MCULE-1335465688 [0,1,0,0,0,0|3,0,0]=4 177 B10R0.93 NC(CC(N)C(=O)O)C(=O)O MCULE-4470732128 [0,1,0,0,0,0|3,0,0]=4 178 B10R0.93 NC(CC(O)C(=O)O)C(=O)O MCULE-2122152001 [0,1,0,0,0,0|3,0,0]=4 179 B10R0.93 N[C@@H](CC(F)C(=O)O)C(=O)O MCULE-2625841366 [0,1,0,0,0,0|2,0,0]=3 180 B10R0.93 N[C@@H](C[C@@H](N)C(=O)O)C(=O)O MCULE-5445779612 [0,1,0,0,0,0|3,0,0]=4 181 B10R0.93 N[C@@H](C[C@@H](N)C(=O)O)C(=O)O MCULE-9351036941 [0,1,0,0,0,0|3,0,0]=4 182 B10R0.93 N[C@@H](C[C@@H](O)C(=O)O)C(=O)O MCULE-2660596864 [0,1,0,0,0,0|3,0,0]=4 183 B10R0.93 N[C@@H](C[C@@H](O)C(=O)O)C(=O)O MCULE-6180379673 [0,1,0,0,0,0|3,0,0]=4 184 B10R0.93 N[C@@H](C[C@H](F)C(=O)O)C(=O)O MCULE-5145554613 [0,1,0,0,0,0|2,0,0]=3 185 B10R0.93 N[C@@H](C[C@H](F)C(=O)O)C(=O)O MCULE-9443069690 [0,1,0,0,0,0|2,0,0]=3 186 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O MCULE-2341577942 [0,1,0,0,0,0|3,0,0]=4 187 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O MCULE-4495746010 [0,1,0,0,0,0|3,0,0]=4 188 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O MCULE-6284302068 [0,1,0,0,0,0|3,0,0]=4 189 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O MCULE-6384488635 [0,1,0,0,0,0|3,0,0]=4 190 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O MCULE-6724681365 [0,1,0,0,0,0|3,0,0]=4 191 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O MCULE-8957870380 [0,1,0,0,0,0|3,0,0]=4 192 B10R0.93 N[C@@H](C[C@H](O)C(=O)O)C(=O)O MCULE-2217204949 [0,1,0,0,0,0|3,0,0]=4 193 B10R0.93 N[C@@H](C[C@H](O)C(=O)O)C(=O)O MCULE-8271752005 [0,1,0,0,0,0|3,0,0]=4 194 B10R0.93 N[C@H](C[C@@H](N)C(=O)O)C(=O)O MCULE-3848928339 [0,1,0,0,0,0|3,0,0]=4 195 B10R0.93 N[C@H](C[C@@H](N)C(=O)O)C(=O)O MCULE-4424451348 [0,1,0,0,0,0|3,0,0]=4 196 B10R0.93 N[C@H](C[C@@H](N)C(=O)O)C(=O)O MCULE-5729704628 [0,1,0,0,0,0|3,0,0]=4 197 B10R0.93 N[C@H](C[C@@H](N)C(=O)O)C(=O)O MCULE-8441844155 [0,1,0,0,0,0|3,0,0]=4 198 B10R0.93 N[C@H](C[C@H](O)C(=O)O)C(=O)O MCULE-8040485498 [0,1,0,0,0,0|3,0,0]=4 199 B10R0.93 O=C(O)C(Br)CC(Br)C(=O)O MCULE-2429859248 [0,1,0,0,0,0|2,1,0]=4 200 B10R1.13 CC1=CCC(CN1)C(=O)O MCULE-6736360947 [0,0,0,1,0,0|3,0,0]=4 201 B10R1.13 NC1=NCC(CN1)C(=O)O MCULE-5846461385 [0,0,0,1,0,0|2,0,0]=3 202 B10R1.13 NC1=NCC(CN1)C(=O)O MCULE-7792293428 [0,0,0,1,0,0|2,0,0]=3 203 B10R1.13 O=C1CCC(CN1)C(=O)O MCULE-9788917215 [0,0,0,1,0,0|2,0,1]=4 204 B10R1.13 O=C1CC[C@@H](CN1)C(=O)O MCULE-3191286949 [0,0,0,1,0,0|2,0,1]=4 205 B10R1.13 O=C1CC[C@@H](CN1)C(=O)O MCULE-9692186311 [0,0,0,1,0,0|2,0,1]=4 206 B10R1.13 O=C1CC[C@H](CN1)C(=O)O MCULE-6590332785 [0,0,0,1,0,0|2,0,1]=4 207 B10R1.13 O=C1CNC(CN1)C(=O)O MCULE-1011618274 [0,0,0,1,0,0|2,0,1]=4 208 B10R1.13 O=C1CNC(CN1)C(=O)O MCULE-9345081526 [0,0,0,1,0,0|2,0,1]=4 209 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-1270509503 [0,0,0,1,0,0|2,0,1]=4 210 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-5912128916 [0,0,0,1,0,0|2,0,1]=4 211 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-6974754540 [0,0,0,1,0,0|2,0,1]=4 212 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-9137341829 [0,0,0,1,0,0|2,0,1]=4 213 B10R1.13 O=C1CN[C@H](CN1)C(=O)O MCULE-8928326150 [0,0,0,1,0,0|2,0,1]=4 214 B10R1.58 O=C(O)[C@@H]1C[C@H](C(=O)N1)F MCULE-3594620408 [0,0,0,1,0,0|3,0,0]=4 215 B10R1.58 O=C(O)[C@@H]1C[C@H](C(=O)N1)F MCULE-7616817872 [0,0,0,1,0,0|3,0,0]=4 216 B10R1.58 O=C1NC(CC1F)C(=O)O MCULE-5782471146 [0,0,0,1,0,0|3,0,0]=4 217 B10R1.58 O=C1N[C@@H](C[C@@H]1F)C(=O)O MCULE-5667846232 [0,0,0,1,0,0|3,0,0]=4 218 B10R1.58 O=C1N[C@@H](C[C@@H]1F)C(=O)O MCULE-8319847079 [0,0,0,1,0,0|3,0,0]=4 219 B10R1.349 CC(=O)N1CC(C1)C(=O)O MCULE-3908865552 [0,0,0,1,0,0|2,0,1]=4 220 B10R1.349 NC(=O)N1CC(C1)C(=O)O MCULE-3854559032 [0,0,0,1,0,0|1,0,2]=4 221 B10R1.349 O=C(O)C1CC(C1)C(=O)O MCULE-7515334695 [0,0,0,1,0,0|3,0,0]=4 222 B10R1.349 O=C(O)C1CC(N1)C(=O)O MCULE-2441047831 [0,0,0,1,0,0|3,0,0]=4 223 B10R1.349 O=C(O)[C@H]1C[C@@H](C1)C(=O)O MCULE-7021077384 [0,0,0,1,0,0|3,0,0]=4 224 B10R1.349 O=C(O)[C@H]1C[C@H](C1)C(=O)O MCULE-2423808428 [0,0,0,1,0,0|3,0,0]=4 225 B10R1.360 CC1(CC1C(=O)O)C(=O)O MCULE-1315514899 [0,0,0,1,0,0|3,0,0]=4 226 B10R1.470 CC1(CCC(=O)O1)C(=O)O MCULE-2009596037 [0,0,0,1,0,0|3,0,0]=4 227 B10R1.470 CC1(CNC(=O)C1)C(=O)O MCULE-2188595466 [0,0,0,1,0,0|2,0,1]=4 228 B8R0.23 C=C(Br)CC(N)C(=O)O MCULE-2311003313 [0,0,0,0,1,0|3,0,0]=4 229 B8R0.23 C=C(Br)C[C@@H](N)C(=O)O MCULE-2061865879 [0,0,0,0,1,0|3,0,0]=4 230 B8R0.23 C=C(Br)C[C@@H](N)C(=O)O MCULE-6617690939 [0,0,0,0,1,0|3,0,0]=4 231 B8R0.23 C=C(Br)C[C@H](N)C(=O)O MCULE-2602336550 [0,0,0,0,1,0|3,0,0]=4 232 B8R0.23 C=C(Br)C[C@H](N)C(=O)O MCULE-9274484893 [0,0,0,0,1,0|3,0,0]=4 233 B8R0.23 C=C(C)CC(C)C(=O)O MCULE-7268483710 [0,0,0,0,1,0|3,0,0]=4 234 B8R0.23 C=C(C)CC(N)C(=O)O MCULE-5915882776 [0,0,0,0,1,0|3,0,0]=4 235 B8R0.23 C=C(C)C[C@@H](N)C(=O)O MCULE-2841714882 [0,0,0,0,1,0|3,0,0]=4 236 B8R0.23 C=C(C)C[C@H](C)C(=O)O MCULE-9053114079 [0,0,0,0,1,0|3,0,0]=4 237 B8R0.23 C=C(C)C[C@H](N)C(=O)O MCULE-1029058491 [0,0,0,0,1,0|3,0,0]=4 238 B8R0.23 C=C(C)C[C@H](N)C(=O)O MCULE-6974720260 [0,0,0,0,1,0|3,0,0]=4 239 B8R0.23 C=C(CC(=O)O)C(=O)O MCULE-5221256796 [0,0,0,0,1,0|2,0,1]=4 240 B8R0.23 C=C(Cl)CC(N)C(=O)O MCULE-3498417929 [0,0,0,0,1,0|3,0,0]=4 241 B8R0.23 C=C(Cl)CC(N)C(=O)O MCULE-7451890779 [0,0,0,0,1,0|3,0,0]=4 242 B8R0.23 CC(=O)C(C)CC(=O)O MCULE-9095166615 [0,0,0,0,1,0|3,0,0]=4 243 B8R0.23 CC(=O)C(N)CC(=O)O MCULE-7043175556 [0,0,0,0,1,0|3,0,0]=4 244 B8R0.23 CC(=O)CC(C)C(=O)O MCULE-4640477792 [0,0,0,0,1,0|2,0,1]=4 245 B8R0.23 CC(=O)CC(N)C(=O)O MCULE-6275652695 [0,0,0,0,1,0|2,0,1]=4 246 B8R0.23 CC(=O)CC(N)C(=O)O MCULE-6690241894 [0,0,0,0,1,0|2,0,1]=4 247 B8R0.23 CC(=O)CC(O)C(=O)O MCULE-4728629069 [0,0,0,0,1,0|2,0,1]=4 248 B8R0.23 CC(=O)NC(C)C(=O)O MCULE-1209958700 [0,0,0,0,1,0|2,0,1]=4 249 B8R0.23 CC(=O)NC(C)C(=O)O MCULE-6844686208 [0,0,0,0,1,0|2,0,1]=4 250 B8R0.23 CC(=O)N[C@@H](C)C(=O)O MCULE-7453059048 [0,0,0,0,1,0|2,0,1]=4 251 B8R0.23 CC(=O)N[C@@H](C)C(=O)O MCULE-9637570463 [0,0,0,0,1,0|2,0,1]=4 252 B8R0.23 CC(=O)N[C@H](C)C(=O)O MCULE-1908712348 [0,0,0,0,1,0|2,0,1]=4 253 B8R0.23 CC(=O)N[C@H](C)C(=O)O MCULE-3023888296 [0,0,0,0,1,0|2,0,1]=4 254 B8R0.23 CC(C)CC(F)C(=O)O MCULE-6908911956 [0,0,0,0,1,0|2,0,1]=4 255 B8R0.23 CC(CC(=O)N)C(=O)O MCULE-8238400356 [0,0,0,0,1,0|1,0,2]=4 256 B8R0.23 CC(CC(=O)O)C(=O)O MCULE-4824634360 [0,0,0,0,1,0|2,0,0]=3 257 B8R0.23 CC(CC(=O)O)C(=O)O MCULE-8116748590 [0,0,0,0,1,0|2,0,0]=3 258 B8R0.23 CC(NC(=N)N)C(=O)O MCULE-1509115617 [0,0,0,0,1,0|2,0,0]=3 259 B8R0.23 CC(NC(=O)N)C(=O)O MCULE-9370944250 [0,0,0,0,1,0|1,0,2]=4 260 B8R0.23 C[C@@H](CC(=O)O)C(=O)O MCULE-1711994689 [0,0,0,0,1,0|2,0,0]=3 261 B8R0.23 C[C@@H](CC(=O)O)C(=O)O MCULE-6107805812 [0,0,0,0,1,0|2,0,0]=3 262 B8R0.23 C[C@H](CC(=O)O)C(=O)O MCULE-2738295504 [0,0,0,0,1,0|2,0,0]=3 263 B8R0.23 C[C@H](CC(=O)O)C(=O)O MCULE-4544789339 [0,0,0,0,1,0|2,0,0]=3 264 B8R0.23 C[C@H](NC(=O)N)C(=O)O MCULE-7947685696 [0,0,0,0,1,0|1,0,2]=4 265 B8R0.23 NC(=O)C(N)CC(=O)O MCULE-2277575843 [0,0,0,0,1,0|3,0,0]=4 266 B8R0.23 NC(=O)CC(Br)C(=O)O MCULE-2823539046 [0,0,0,0,1,0|0,1,2]=4 267 B8R0.23 NC(=O)CC(N)C(=O)O MCULE-1395307434 [0,0,0,0,1,0|1,0,2]=4 268 B8R0.23 NC(=O)C[C@@H](N)C(=O)O MCULE-5685974579 [0,0,0,0,1,0|1,0,2]=4 269 B8R0.23 NC(=O)C[C@@H](N)C(=O)O MCULE-6923060287 [0,0,0,0,1,0|1,0,2]=4 270 B8R0.23 NC(=O)C[C@H](N)C(=O)O MCULE-1868046141 [0,0,0,0,1,0|1,0,2]=4 271 B8R0.23 NC(=O)C[C@H](N)C(=O)O MCULE-8248953574 [0,0,0,0,1,0|1,0,2]=4 272 B8R0.23 NC(=O)[C@@H](N)CC(=O)O MCULE-1924512659 [0,0,0,0,1,0|3,0,0]=4 273 B8R0.23 NC(=O)[C@@H](N)CC(=O)O MCULE-5836180326 [0,0,0,0,1,0|3,0,0]=4 274 B8R0.23 NC(=O)[C@@H](N)CC(=O)O MCULE-8799617587 [0,0,0,0,1,0|3,0,0]=4 275 B8R0.23 NC(=O)[C@@H](N)CC(=O)O MCULE-9477928215 [0,0,0,0,1,0|3,0,0]=4 276 B8R0.23 NC(=O)[C@H](N)CC(=O)O MCULE-5316198498 [0,0,0,0,1,0|3,0,0]=4 277 B8R0.23 NC(=O)[C@H](N)CC(=O)O MCULE-9833023193 [0,0,0,0,1,0|3,0,0]=4 278 B8R0.23 NC(CC(=O)O)C(=O)O MCULE-1247865301 [0,0,0,0,1,0|2,0,0]=3 279 B8R0.23 NC(CC(=O)O)C(=O)O MCULE-9328817309 [0,0,0,0,1,0|2,0,0]=3 280 B8R0.23 NC(CC(=O)O)C(=O)[O-] MCULE-5149469296 [0,0,0,0,1,0|2,0,1]=4 281 B8R0.23 NC(CC(=O)O)C(=O)[O-] MCULE-6655576025 [0,0,0,0,1,0|2,0,1]=4 282 B8R0.23 NC(CC(=O)[O-])C(=O)O MCULE-9221777365 [0,0,0,0,1,0|2,0,1]=4 283 B8R0.23 N[C@@H](CC(=O)O)C(=O)O MCULE-3710241722 [0,0,0,0,1,0|2,0,0]=3 284 B8R0.23 N[C@@H](CC(=O)O)C(=O)O MCULE-6700641640 [0,0,0,0,1,0|2,0,0]=3 285 B8R0.23 N[C@@H](CC(=O)O)C(=O)[O-] MCULE-6196524297 [0,0,0,0,1,0|2,0,1]=4 286 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O MCULE-5793000569 [0,0,0,0,1,0|2,0,1]=4 287 B8R0.23 N[C@@H](CS(=O)O)C(=O)O MCULE-6647925908 [0,0,0,0,1,0|3,0,0]=4 288 B8R0.23 N[C@@H](CS(=O)O)C(=O)O MCULE-7596867929 [0,0,0,0,1,0|3,0,0]=4 289 B8R0.23 N[C@H](CC(=O)O)C(=O)O MCULE-8102700760 [0,0,0,0,1,0|2,0,0]=3 290 B8R0.23 O=C(O)/C=C(\F)/C(=O)O MCULE-5646698704 [0,0,0,0,1,0|1,0,2]=4 291 B8R0.23 O=C(O)C=C(F)C(=O)O MCULE-9862154394 [0,0,0,0,1,0|1,0,2]=4 292 B8R0.23 O=C(O)CC(=O)C(=O)O MCULE-6059222019 [0,0,0,0,1,0|2,0,1]=4 293 B8R0.23 O=C(O)CC(Br)C(=O)O MCULE-8178780603 [0,0,0,0,1,0|1,1,0]=3 294 B8R0.23 O=C(O)CC(Cl)C(=O)O MCULE-6357456691 [0,0,0,0,1,0|1,1,0]=3 295 B8R0.23 O=C(O)CC(F)C(=O)O MCULE-8433198001 [0,0,0,0,1,0|1,0,0]=2 296 B8R0.23 O=C(O)CC(O)C(=O)O MCULE-5852208511 [0,0,0,0,1,0|2,0,0]=3 297 B8R0.23 O=C(O)CC(O)C(=O)O MCULE-9713558868 [0,0,0,0,1,0|2,0,0]=3 298 B8R0.23 O=C(O)CC(O)C(=O)O MCULE-9924961830 [0,0,0,0,1,0|2,0,0]=3 299 B8R0.23 O=C(O)CC(S)C(=O)O MCULE-7005300961 [0,0,0,0,1,0|2,0,0]=3 300 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O MCULE-4598056907 [0,0,0,0,1,0|1,1,0]=3 301 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O MCULE-7861798045 [0,0,0,0,1,0|1,1,0]=3 302 B8R0.23 O=C(O)C[C@@H](O)C(=O)O MCULE-2239273084 [0,0,0,0,1,0|2,0,0]=3 303 B8R0.23 O=C(O)C[C@@H](O)C(=O)O MCULE-4984266891 [0,0,0,0,1,0|2,0,0]=3 304 B8R0.23 O=C(O)C[C@H](Br)C(=O)O MCULE-6763472515 [0,0,0,0,1,0|1,1,0]=3 305 B8R0.23 O=C(O)C[C@H](Br)C(=O)O MCULE-7524683930 [0,0,0,0,1,0|1,1,0]=3 306 B8R0.23 O=C(O)C[C@H](F)C(=O)O MCULE-9607625100 [0,0,0,0,1,0|1,0,0]=2 307 B8R0.23 O=C(O)C[C@H](O)C(=O)O MCULE-8339271078 [0,0,0,0,1,0|2,0,0]=3 308 B8R0.23 O=C(O)C[C@H](O)C(=O)O MCULE-8865188741 [0,0,0,0,1,0|2,0,0]=3 309 B8R0.23 O=C(O)C[C@H](O)C(=O)[O-] MCULE-1033530810 [0,0,0,0,1,0|2,0,1]=4 310 B8R0.23 O=C(O)C[C@H](S)C(=O)O MCULE-6393371024 [0,0,0,0,1,0|2,0,0]=3 311 B8R0.23 [C@@H](N)(CC(=O)O)C(=O)O MCULE-7899824165 [0,0,0,0,1,0|2,0,0]=3 312 B10R0.96 CC(CCC(=O)O)CC(=O)O MCULE-7386549049 [0,0,0,0,0,1|3,0,0]=4 313 B10R0.96 C[C@H](CCC(=O)O)CC(=O)O MCULE-1721699813 [0,0,0,0,0,1|3,0,0]=4 314 B10R0.96 C[C@H](CCC(=O)O)CC(=O)O MCULE-7525360323 [0,0,0,0,0,1|3,0,0]=4 315 B10R0.96 NC(CCC(=O)O)CC(=O)O MCULE-8155260586 [0,0,0,0,0,1|3,0,0]=4 316 B10R0.96 NC(CCC(=O)O)CC(=O)O MCULE-8574900055 [0,0,0,0,0,1|3,0,0]=4 317 B10R0.96 N[C@@H](CCC(=O)O)CC(=O)O MCULE-5068946859 [0,0,0,0,0,1|3,0,0]=4 318 B10R0.96 N[C@@H](CCC(=O)O)CC(=O)O MCULE-8151605170 [0,0,0,0,0,1|3,0,0]=4 319 B10R0.96 N[C@@H](CCC(=O)O)CC(=O)O MCULE-8505675120 [0,0,0,0,0,1|3,0,0]=4 320 B10R0.96 N[C@@H](CCC(=O)O)CC(=O)O MCULE-9871725008 [0,0,0,0,0,1|3,0,0]=4 321 B10R0.96 N[C@H](CCC(=O)O)CC(=O)O MCULE-3923729315 [0,0,0,0,0,1|3,0,0]=4 322 B10R0.96 N[C@H](CCC(=O)O)CC(=O)O MCULE-6851763365 [0,0,0,0,0,1|3,0,0]=4 323 B10R0.98 CC(=O)NCC[C@H](N)C(=O)O MCULE-5384056558 [0,0,0,0,0,1|2,0,1]=4 324 B10R0.98 CC(=O)NCC[C@H](N)C(=O)O MCULE-9151560319 [0,0,0,0,0,1|2,0,1]=4 325 B10R0.98 N=C(N)NCCC(N)C(=O)O MCULE-2234773343 [0,0,0,0,0,1|2,0,0]=3 326 B10R0.98 N=C(N)NCCC(N)C(=O)O MCULE-9635728361 [0,0,0,0,0,1|2,0,0]=3 327 B10R0.98 N=C(N)NCC[C@H](N)C(=O)O MCULE-5360635274 [0,0,0,0,0,1|2,0,0]=3 328 B10R0.98 N=C(N)NCC[C@H](N)C(=O)O MCULE-7633853490 [0,0,0,0,0,1|2,0,0]=3 329 B10R0.98 NC(CCCC(=O)O)C(=O)O MCULE-3021567253 [0,0,0,0,0,1|3,0,0]=4 330 B10R0.98 NC(CCCC(=O)O)C(=O)O MCULE-7434229402 [0,0,0,0,0,1|3,0,0]=4 331 B10R0.98 NC(CCCC(=O)O)C(=O)O MCULE-8474963048 [0,0,0,0,0,1|3,0,0]=4 332 B10R0.98 NC(CSCC(=O)O)C(=O)O MCULE-1997609241 [0,0,0,0,0,1|3,0,0]=4 333 B10R0.98 N[C@@H](CCCC(=O)O)C(=O)O MCULE-1991686030 [0,0,0,0,0,1|3,0,0]=4 334 B10R0.98 N[C@@H](CCCC(=O)O)C(=O)O MCULE-6053925503 [0,0,0,0,0,1|3,0,0]=4 335 B10R0.98 N[C@@H](CSCC(=O)O)C(=O)O MCULE-3291004829 [0,0,0,0,0,1|3,0,0]=4 336 B10R0.98 N[C@@H](CSCC(=O)O)C(=O)O MCULE-3828091379 [0,0,0,0,0,1|3,0,0]=4 337 B10R0.98 N[C@H](CCCC(=O)O)C(=O)O MCULE-3179500404 [0,0,0,0,0,1|3,0,0]=4 338 B10R0.98 N[C@H](CCCC(=O)O)C(=O)O MCULE-9722366772 [0,0,0,0,0,1|3,0,0]=4 339 B10R0.98 O=C(O)CCCC(O)C(=O)O MCULE-5970708862 [0,0,0,0,0,1|3,0,0]=4 340 B10R0.98 O=C(O)CCC[C@H](O)C(=O)O MCULE-4157551693 [0,0,0,0,0,1|3,0,0]=4 341 B7R0.4 C=CCCCC(=O)O MCULE-6043142578 [2,0,0,0,0,0|2,0,0]=4 342 B7R0.4 CC(=O)NCCC=O MCULE-1907633123 [2,0,0,0,0,0|1,0,1]=4 343 B7R0.4 CC=CCCC(=O)O MCULE-4275247668 [2,0,0,0,0,0|2,0,0]=4 344 B7R0.4 CCNCCC(=O)O MCULE-4226597657 [2,0,0,0,0,0|1,0,1]=4 345 B7R0.4 CCNCCC(=O)O MCULE-9183951914 [2,0,0,0,0,0|1,0,1]=4 346 B7R0.4 O=C(O)CCC=CBr MCULE-1826887170 [2,0,0,0,0,0|2,0,0]=4 347 B7R0.4 O=C(O)CCCCO MCULE-8816195933 [2,0,0,0,0,0|1,0,1]=4 348 B7R0.4 O=CCCCC(=O)O MCULE-8389457571 [2,0,0,0,0,0|1,0,1]=4 349 B7R0.5 C#CCC(F)C(=O)O MCULE-1070671235 [2,0,0,0,0,0|1,0,1]=4 350 B7R0.5 C=CCC(C)C(=O)O MCULE-2912410432 [2,0,0,0,0,0|2,0,0]=4 351 B7R0.5 C=CCC(N)C(=O)O MCULE-1550468430 [2,0,0,0,0,0|2,0,0]=4 352 B7R0.5 C=CCC(N)C(=O)O MCULE-1783682768 [2,0,0,0,0,0|2,0,0]=4 353 B7R0.5 C=CCC(N)C(=O)O MCULE-8721864064 [2,0,0,0,0,0|2,0,0]=4 354 B7R0.5 C=CCC(N)C(=O)O MCULE-9091562338 [2,0,0,0,0,0|2,0,0]=4 355 B7R0.5 C=CCC(O)C(=O)O MCULE-6418899544 [2,0,0,0,0,0|2,0,0]=4 356 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-3817126030 [2,0,0,0,0,0|2,0,0]=4 357 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-5479618260 [2,0,0,0,0,0|2,0,0]=4 358 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-6719393730 [2,0,0,0,0,0|2,0,0]=4 359 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-7577627870 [2,0,0,0,0,0|2,0,0]=4 360 B7R0.5 C=CC[C@@H](O)C(=O)O MCULE-4103471826 [2,0,0,0,0,0|2,0,0]=4 361 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-2073484196 [2,0,0,0,0,0|2,0,0]=4 362 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-3267648941 [2,0,0,0,0,0|2,0,0]=4 363 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-4183531139 [2,0,0,0,0,0|2,0,0]=4 364 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-8225762047 [2,0,0,0,0,0|2,0,0]=4 365 B7R0.5 C=CC[C@H](O)C(=O)O MCULE-8230827617 [2,0,0,0,0,0|2,0,0]=4 366 B7R0.5 CC(CCO)C(=O)O MCULE-9724304469 [2,0,0,0,0,0|1,0,1]=4 367 B7R0.5 CC(NC=O)C(=O)O MCULE-7277951464 [2,0,0,0,0,0|1,0,1]=4 368 B7R0.5 CCCC(F)C(=O)O MCULE-5551678948 [2,0,0,0,0,0|1,0,1]=4 369 B7R0.5 CNCC(C)C(=O)O MCULE-4255373615 [2,0,0,0,0,0|1,0,1]=4 370 B7R0.5 CNCC(C)C(=O)O MCULE-8076489545 [2,0,0,0,0,0|1,0,1]=4 371 B7R0.5 CNCC(N)C(=O)O MCULE-4360775406 [2,0,0,0,0,0|1,0,1]=4 372 B7R0.5 CNCC(N)C(=O)O MCULE-4913403405 [2,0,0,0,0,0|1,0,1]=4 373 B7R0.5 CNC[C@H](N)C(=O)O MCULE-3465445123 [2,0,0,0,0,0|1,0,1]=4 374 B7R0.5 CNC[C@H](N)C(=O)O MCULE-7309489523 [2,0,0,0,0,0|1,0,1]=4 375 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8418254346 [2,0,0,0,0,0|1,0,1]=4 376 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8752314299 [2,0,0,0,0,0|1,0,1]=4 377 B7R0.5 C[C@H](NC=O)C(=O)O MCULE-3824082361 [2,0,0,0,0,0|1,0,1]=4 378 B7R0.5 C[C@H](NC=O)C(=O)O MCULE-5248110352 [2,0,0,0,0,0|1,0,1]=4 379 B7R0.5 NC(CCO)C(=O)O MCULE-1744838687 [2,0,0,0,0,0|1,0,1]=4 380 B7R0.5 NC(CCO)C(=O)O MCULE-9642233758 [2,0,0,0,0,0|1,0,1]=4 381 B7R0.5 NC(CNO)C(=O)O MCULE-2332662988 [2,0,0,0,0,0|1,0,0]=3 382 B7R0.5 NCCC(F)C(=O)O MCULE-5068755002 [2,0,0,0,0,0|0,0,2]=4 383 B7R0.5 NCCC(F)C(=O)O MCULE-9196695600 [2,0,0,0,0,0|0,0,2]=4 384 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-2370353784 [2,0,0,0,0,0|1,0,1]=4 385 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-4861747928 [2,0,0,0,0,0|1,0,1]=4 386 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8005652100 [2,0,0,0,0,0|1,0,1]=4 387 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8613625039 [2,0,0,0,0,0|1,0,1]=4 388 B7R0.5 O=C(O)C(O)CCO MCULE-9096271794 [2,0,0,0,0,0|1,0,1]=4 389 B9R0.47 N/N=C/NC[C@H](N)C(=O)O MCULE-5611888169 [1,1,0,0,0,0|1,0,0]=3 390 B9R0.47 N/N=C/NC[C@H](N)C(=O)O MCULE-6448566029 [1,1,0,0,0,0|1,0,0]=3 391 B9R0.1 CCC(=O)NCCC(=O)O MCULE-8290753533 [1,1,0,0,0,0|1,0,1]=4 392 B9R0.1 CNC(=O)NCCC(=O)O MCULE-2339960341 [1,1,0,0,0,0|0,0,2]=4 393 B9R0.1 COC(=O)CCCC(=O)O MCULE-9458960872 [1,1,0,0,0,0|2,0,0]=4 394 B9R0.1 COC(=O)CCNC(=O)C MCULE-2210096145 [1,1,0,0,0,0|1,0,1]=4 395 B9R0.1 COC(=O)CCNC(=O)N MCULE-9678867682 [1,1,0,0,0,0|0,0,2]=4 396 B9R0.1 COC(=O)NCCC(=O)O MCULE-2819384794 [1,1,0,0,0,0|1,0,0]=3 397 B9R0.1 O=C(O)CCNC(=O)CBr MCULE-6072289927 [1,1,0,0,0,0|1,0,1]=4 398 B9R0.1 O=C(O)CCNC(=O)CCl MCULE-4076619762 [1,1,0,0,0,0|1,0,1]=4 399 B9R0.1 O=C(O)CCNC(=O)CO MCULE-2710668626 [1,1,0,0,0,0|1,0,0]=3 400 B9R0.53 CC(=O)NC(C)CC(=O)O MCULE-8603148812 [1,1,0,0,0,0|1,0,1]=4 401 B9R0.53 CC(CC(=O)O)CC(=O)O MCULE-7399673381 [1,1,0,0,0,0|2,0,0]=4 402 B9R0.53 CC(CC(=O)O)NC(=O)N MCULE-2917505998 [1,1,0,0,0,0|0,0,2]=4 403 B9R0.53 NC(CC(=O)O)CC(=O)O MCULE-4205352281 [1,1,0,0,0,0|2,0,0]=4 404 B9R0.53 NC(CC(=O)O)CC(=O)O MCULE-5754399431 [1,1,0,0,0,0|2,0,0]=4 405 B9R0.53 O=C(O)CC(O)CC(=O)O MCULE-7670149511 [1,1,0,0,0,0|2,0,0]=4 406 B9R0.56 N=C(N)NCCS(=O)(=O)O MCULE-8763764734 [1,1,0,0,0,0|2,0,0]=4 407 B9R0.11 CC(C)(CC(=O)O)C(=O)O MCULE-7005043054 [0,1,0,0,1,0|2,0,0]=4 408 B9R0.11 CC(F)(NC(=O)N)C(=O)O MCULE-5893224532 [0,1,0,0,1,0|0,0,2]=4 409 B9R0.11 CC(N)(CC(=O)O)C(=O)O MCULE-3390093551 [0,1,0,0,1,0|2,0,0]=4 410 B9R0.11 CC(N)(CC(=O)O)C(=O)O MCULE-4137717341 [0,1,0,0,1,0|2,0,0]=4 411 B9R0.11 CC(O)(CC(=O)O)C(=O)O MCULE-8670926890 [0,1,0,0,1,0|2,0,0]=4 412 B9R0.11 C[C@@](N)(CC(=O)O)C(=O)O MCULE-5803003392 [0,1,0,0,1,0|2,0,0]=4 413 B9R0.11 C[C@@](N)(CC(=O)O)C(=O)O MCULE-7987571569 [0,1,0,0,1,0|2,0,0]=4 414 B9R0.11 C[C@](N)(CC(=O)O)C(=O)O MCULE-4314292616 [0,1,0,0,1,0|2,0,0]=4 415 B9R0.11 C[C@](O)(CC(=O)O)C(=O)O MCULE-1934088864 [0,1,0,0,1,0|2,0,0]=4 416 B9R0.11 O=C(O)CC(F)(F)C(=O)O MCULE-7706048377 [0,1,0,0,1,0|1,0,0]=3 417 B9R0.11 O=C(O)CC(S)(S)C(=O)O MCULE-7344489814 [0,1,0,0,1,0|2,0,0]=4 418 B9R0.39 CCC(CC(=O)O)C(=O)O MCULE-6275256194 [0,1,0,0,1,0|2,0,0]=4 419 B9R0.39 CNC(CC(=O)O)C(=O)O MCULE-5049531079 [0,1,0,0,1,0|2,0,0]=4 420 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O MCULE-4725692041 [0,1,0,0,1,0|2,0,0]=4 421 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O MCULE-6356483886 [0,1,0,0,1,0|2,0,0]=4 422 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O MCULE-9428412153 [0,1,0,0,1,0|2,0,0]=4 423 B9R0.39 CN[C@H](CC(=O)O)C(=O)O MCULE-1405442072 [0,1,0,0,1,0|2,0,0]=4 424 B9R0.39 CN[C@H](CC(=O)O)C(=O)O MCULE-8611804669 [0,1,0,0,1,0|2,0,0]=4 425 B9R0.39 CN[C@H](CC(=O)O)C(=O)O MCULE-9080466863 [0,1,0,0,1,0|2,0,0]=4 426 B9R0.39 COC(CC(=O)O)C(=O)O MCULE-3778948045 [0,1,0,0,1,0|2,0,0]=4 427 B9R0.39 N=C(N)N[C@@H](CS)C(=O)O MCULE-8761842896 [0,1,0,0,1,0|2,0,0]=4 428 B9R0.39 NCC(CC(=O)O)C(=O)O MCULE-1683659350 [0,1,0,0,1,0|2,0,0]=4 429 B9R0.39 NCC(CC(=O)O)C(=O)O MCULE-8428141166 [0,1,0,0,1,0|2,0,0]=4 430 B9R0.39 O=C(O)CC(CS)C(=O)O MCULE-7352825049 [0,1,0,0,1,0|2,0,0]=4 431 B9R0.79 CC(C(=O)O)C(C)C(=O)O MCULE-6112773421 [0,1,0,0,1,0|2,0,0]=4 432 B9R0.79 CC(C(=O)O)C(N)C(=O)O MCULE-7699599383 [0,1,0,0,1,0|2,0,0]=4 433 B9R0.79 CC(C(=O)O)C(O)C(=O)O MCULE-1644748819 [0,1,0,0,1,0|2,0,0]=4 434 B9R0.79 CC(C(=O)O)[C@H](N)C(=O)O MCULE-1516476673 [0,1,0,0,1,0|2,0,0]=4 435 B9R0.79 C[C@H](C(=O)O)[C@@H](C)C(=O)O MCULE-1961663558 [0,1,0,0,1,0|2,0,0]=4 436 B9R0.79 C[C@H](C(=O)O)[C@@H](N)C(=O)O MCULE-1232463081 [0,1,0,0,1,0|2,0,0]=4 437 B9R0.79 C[C@H](C(=O)O)[C@H](N)C(=O)O MCULE-3277052139 [0,1,0,0,1,0|2,0,0]=4 438 B9R0.79 NC(C(=O)O)C(N)C(=O)O MCULE-8316230798 [0,1,0,0,1,0|2,0,0]=4 439 B9R0.79 NC(C(=O)O)C(O)C(=O)O MCULE-9532787420 [0,1,0,0,1,0|2,0,0]=4 440 B9R0.79 N[C@@H](C(=O)O)[C@@H](F)C(=O)O MCULE-2171226271 [0,1,0,0,1,0|1,0,0]=3 441 B9R0.79 N[C@H](C(=O)O)[C@@H](N)C(=O)O MCULE-6540811499 [0,1,0,0,1,0|2,0,0]=4 442 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O MCULE-1913101511 [0,1,0,0,1,0|2,0,0]=4 443 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O MCULE-9488918896 [0,1,0,0,1,0|2,0,0]=4 444 B9R0.79 O=C(O)C(Br)C(Br)C(=O)O MCULE-5784765255 [0,1,0,0,1,0|1,1,0]=4 445 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-1129308393 [0,1,0,0,1,0|2,0,0]=4 446 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-2045308981 [0,1,0,0,1,0|2,0,0]=4 447 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-2628563960 [0,1,0,0,1,0|2,0,0]=4 448 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-3711883524 [0,1,0,0,1,0|2,0,0]=4 449 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-3867000095 [0,1,0,0,1,0|2,0,0]=4 450 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-4358223174 [0,1,0,0,1,0|2,0,0]=4 451 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-4807487882 [0,1,0,0,1,0|2,0,0]=4 452 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-5140635020 [0,1,0,0,1,0|2,0,0]=4 453 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-6522296758 [0,1,0,0,1,0|2,0,0]=4 454 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-6821495270 [0,1,0,0,1,0|2,0,0]=4 455 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-7561074998 [0,1,0,0,1,0|2,0,0]=4 456 B9R0.79 O=C(O)C(O)C(O)C(=O)O MCULE-8089597216 [0,1,0,0,1,0|2,0,0]=4 457 B9R0.79 O=C(O)C(O)[C@@H](O)C(=O)O MCULE-5751523258 [0,1,0,0,1,0|2,0,0]=4 458 B9R0.79 O=C(O)C(O)[C@@H](O)C(=O)O MCULE-9550173577 [0,1,0,0,1,0|2,0,0]=4 459 B9R0.79 O=C(O)C(O)[C@H](O)C(=O)O MCULE-7402521361 [0,1,0,0,1,0|2,0,0]=4 460 B9R0.79 O=C(O)C(S)C(S)C(=O)O MCULE-6206640169 [0,1,0,0,1,0|2,0,0]=4 461 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-2640391251 [0,1,0,0,1,0|2,0,0]=4 462 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-3329629643 [0,1,0,0,1,0|2,0,0]=4 463 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-3643444072 [0,1,0,0,1,0|2,0,0]=4 464 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-4107297969 [0,1,0,0,1,0|2,0,0]=4 465 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-6410123526 [0,1,0,0,1,0|2,0,0]=4 466 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-6491788082 [0,1,0,0,1,0|2,0,0]=4 467 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-8917357121 [0,1,0,0,1,0|2,0,0]=4 468 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O MCULE-9727943205 [0,1,0,0,1,0|2,0,0]=4 469 B9R0.79 O=C(O)[C@H](Br)[C@H](Br)C(=O)O MCULE-4542712392 [0,1,0,0,1,0|1,1,0]=4 470 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-1568229930 [0,1,0,0,1,0|2,0,0]=4 471 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-2241188013 [0,1,0,0,1,0|2,0,0]=4 472 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-2831813022 [0,1,0,0,1,0|2,0,0]=4 473 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-3942804599 [0,1,0,0,1,0|2,0,0]=4 474 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-5431486019 [0,1,0,0,1,0|2,0,0]=4 475 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O MCULE-5579731165 [0,1,0,0,1,0|2,0,0]=4 476 B9R0.79 O=C(O)[C@H](S)[C@H](S)C(=O)O MCULE-4953802229 [0,1,0,0,1,0|2,0,0]=4 477 B9R0.79 [C@@H](O)(C(=O)O)[C@H](O)C(=O)O MCULE-5798988872 [0,1,0,0,1,0|2,0,0]=4 478 B9R0.79 [C@H](O)(C(=O)O)[C@@H](O)C(=O)O MCULE-9974976226 [0,1,0,0,1,0|2,0,0]=4 479 B11R0.109 N/C(=N\O)/NCC[C@H](N)C(=O)O MCULE-6818477347 [0,1,0,0,0,1|1,0,1]=4 480 B11R0.109 N=C(NO)NCCC(N)C(=O)O MCULE-1136835208 [0,1,0,0,0,1|1,0,0]=3 481 B11R0.109 N=C(NO)NCC[C@H](N)C(=O)O MCULE-1084312846 [0,1,0,0,0,1|1,0,0]=3 482 B11R0.109 N=C(NO)NCC[C@H](N)C(=O)O MCULE-4376787249 [0,1,0,0,0,1|1,0,0]=3 483 B11R0.109 N=C(NO)NCC[C@H](N)C(=O)O MCULE-5014640829 [0,1,0,0,0,1|1,0,0]=3 484 B11R0.109 N=C(NO)NCC[C@H](N)C(=O)O MCULE-5651762446 [0,1,0,0,0,1|1,0,0]=3 485 B11R0.109 N=C(NO)NCC[C@H](N)C(=O)O MCULE-6461612970 [0,1,0,0,0,1|1,0,0]=3 486 B11R0.109 N=C(NO)NCC[C@H](N)C(=O)O MCULE-9060251744 [0,1,0,0,0,1|1,0,0]=3 487 B11R0.150 NC(CNC(=O)C(=O)O)C(=O)O MCULE-4369517479 [0,1,0,0,0,1|2,0,0]=4 488 B11R0.150 N[C@@H](CNC(=O)C(=O)O)C(=O)O MCULE-6891448368 [0,1,0,0,0,1|2,0,0]=4 489 B11R0.150 N[C@@H](CNC(=O)C(=O)O)C(=O)O MCULE-8386372368 [0,1,0,0,0,1|2,0,0]=4 490 B11R0.169 C=C(CC(F)(F)C(=O)O)C(=O)O MCULE-6251282874 [0,2,0,0,0,0|2,0,0]=4 491 B11R0.169 NC(CC(F)(F)C(=O)O)C(=O)O MCULE-9496860126 [0,2,0,0,0,0|2,0,0]=4 492 B11R0.169 N[C@@H](CC(F)(F)C(=O)O)C(=O)O MCULE-6781805828 [0,2,0,0,0,0|2,0,0]=4 493 B9R1.35 O=C1CC(CN1)C(=O)O MCULE-2190630193 [1,0,0,1,0,0|1,0,1]=4 494 B9R1.35 O=C1C[C@@H](CN1)C(=O)O MCULE-5673992530 [1,0,0,1,0,0|1,0,1]=4 495 B9R1.35 O=C1C[C@@H](CN1)C(=O)O MCULE-8443757903 [1,0,0,1,0,0|1,0,1]=4 496 B9R1.35 O=C1C[C@H](CN1)C(=O)O MCULE-1024601569 [1,0,0,1,0,0|1,0,1]=4 497 B9R1.35 O=C1C[C@H](CN1)C(=O)O MCULE-4280238532 [1,0,0,1,0,0|1,0,1]=4 498 B9R1.35 O=C1NCC(N1)C(=O)O MCULE-5872947769 [1,0,0,1,0,0|1,0,1]=4 499 B9R1.35 O=C1NCC(O1)C(=O)O MCULE-2773613806 [1,0,0,1,0,0|1,0,1]=4 500 B9R1.35 O=C1NC[C@@H](N1)C(=O)O MCULE-3499982275 [1,0,0,1,0,0|1,0,1]=4 501 B9R1.35 O=C1NC[C@@H](N1)C(=O)O MCULE-9995046216 [1,0,0,1,0,0|1,0,1]=4 502 B9R1.35 O=C1NC[C@H](N1)C(=O)O MCULE-2524102915 [1,0,0,1,0,0|1,0,1]=4 503 B9R1.35 O=C1NC[C@H](N1)C(=O)O MCULE-5992511798 [1,0,0,1,0,0|1,0,1]=4 504 B9R1.35 O=C1NC[C@H](O1)C(=O)O MCULE-5972751457 [1,0,0,1,0,0|1,0,1]=4 505 B9R1.35 O=C1NC[C@H](O1)C(=O)O MCULE-6879191654 [1,0,0,1,0,0|1,0,1]=4 506 B9R1.69 CC1CNC(=NC1=O)O MCULE-1498737305 [1,0,0,1,0,0|2,0,0]=4 507 B9R1.69 O=C1NCC(C(=O)N1)F MCULE-3119054190 [1,0,0,1,0,0|1,0,1]=4 508 B9R1.163 O=C(O)C1(CCNC1)F MCULE-3943818123 [1,0,0,1,0,0|1,0,1]=4 509 B9R1.163 O=C(O)C1(CCNC1)F MCULE-9385624346 [1,0,0,1,0,0|1,0,1]=4 510 B9R1.163 O=C(O)[C@@]1(CCNC1)F MCULE-8296048165 [1,0,0,1,0,0|1,0,1]=4 511 B9R1.53 O=C(O)CC1CC(=O)N1 MCULE-4393961412 [1,0,0,1,0,0|1,0,1]=4 512 B9R1.161 O=C(O)C1CC1C(=O)O MCULE-5636831869 [1,0,0,1,0,0|2,0,0]=4 513 B9R1.161 O=C(O)[C@@H]1C[C@H]1C(=O)O MCULE-2176178577 [1,0,0,1,0,0|2,0,0]=4 514 B9R1.161 O=C(O)[C@@H]1C[C@H]1C(=O)O MCULE-7341169681 [1,0,0,1,0,0|2,0,0]=4 515 B9R1.161 O=C(O)[C@@H]1C[C@H]1C(=O)O MCULE-9766210553 [1,0,0,1,0,0|2,0,0]=4 516 B9R1.161 O=C(O)[C@H]1C[C@@H]1C(=O)O MCULE-8230558967 [1,0,0,1,0,0|2,0,0]=4 517 B9R1.161 O=C(O)[C@H]1C[C@@H]1C(=O)O MCULE-9433538416 [1,0,0,1,0,0|2,0,0]=4 518 B9R1.161 O=C(O)[C@H]1C[C@H]1C(=O)O MCULE-4280807741 [1,0,0,1,0,0|2,0,0]=4 519 B9R1.152 O=C(O)[C@@]1(C[C@@H](C1)O)F MCULE-1599041261 [0,0,0,1,1,0|1,0,1]=4 520 B9R1.152 O=C(O)[C@@]1(C[C@H](C1)O)F MCULE-8929901678 [0,0,0,1,1,0|1,0,1]=4 521 B11R1.167 CC1=NC(C(CN1)O)C(=O)O MCULE-2175075890 [0,0,0,1,0,1|2,0,0]=4 522 B11R1.167 CC1=N[C@@H]([C@H](CN1)O)C(=O)O MCULE-6274285156 [0,0,0,1,0,1|2,0,0]=4 523 B11R1.175 O=C(O)C1CNC(C1)C(=O)O MCULE-8937278367 [0,0,0,1,0,1|2,0,0]=4 524 B11R1.175 O=C(O)[C@@H]1CN[C@@H](C1)C(=O)O MCULE-1390451256 [0,0,0,1,0,1|2,0,0]=4 525 B11R1.175 O=C(O)[C@@H]1CN[C@@H](C1)C(=O)O MCULE-7979026465 [0,0,0,1,0,1|2,0,0]=4 526 B11R1.175 O=C(O)[C@@H]1CN[C@@H](C1)C(=O)O MCULE-9063795349 [0,0,0,1,0,1|2,0,0]=4 527 B11R1.175 O=C(O)[C@@H]1CN[C@H](C1)C(=O)O MCULE-5420917584 [0,0,0,1,0,1|2,0,0]=4 528 B11R1.175 O=C(O)[C@@H]1C[C@H](CN1)C(=O)O MCULE-2467535885 [0,0,0,1,0,1|2,0,0]=4 529 B11R1.22 COC(=O)C1C=NC(=O)NC1 MCULE-2370649722 [0,1,0,1,0,0|1,0,1]=4 530 B7R0.16 CC(C(=O)O)C(=O)O MCULE-7232226851 [0,0,0,0,2,0|2,0,0]=4 531 B7R0.16 NC(C(=O)O)C(=O)O MCULE-6118746267 [0,0,0,0,2,0|2,0,0]=4 532 B7R0.16 O=C(O)C(Cl)C(=O)O MCULE-9776364495 [0,0,0,0,2,0|1,1,0]=4 533 B7R0.16 O=C(O)C(F)C(=O)O MCULE-9969055570 [0,0,0,0,2,0|1,0,0]=3 534 B7R0.16 O=C(O)C(O)C(=O)O MCULE-4232935518 [0,0,0,0,2,0|2,0,0]=4 535 B9R0.55 CC(=O)NCCCC(=O)O MCULE-3194803041 [1,0,0,0,0,1|1,0,1]=4 536 B9R0.55 N=C(N)NCCCC(=O)O MCULE-6633038701 [1,0,0,0,0,1|1,0,0]=3 537 B9R0.55 NC(=O)NCCCC(=O)O MCULE-4986363363 [1,0,0,0,0,1|0,0,2]=4 538 B9R0.55 O=C(O)/C=C/CCC(=O)O MCULE-8825957011 [1,0,0,0,0,1|2,0,0]=4 539 B9R0.55 O=C(O)C=CCCC(=O)O MCULE-7591781771 [1,0,0,0,0,1|2,0,0]=4 540 B9R0.55 O=C(O)CCCCC(=O)O MCULE-1336748609 [1,0,0,0,0,1|2,0,0]=4 541 B9R0.55 O=C(O)CCCCC(=O)O MCULE-3664126855 [1,0,0,0,0,1|2,0,0]=4 542 B9R0.55 O=C(O)CCCCC(=O)O MCULE-6331125687 [1,0,0,0,0,1|2,0,0]=4 543 B9R0.55 O=C(O)CCCCC(=O)O MCULE-7006255210 [1,0,0,0,0,1|2,0,0]=4 544 B9R0.55 O=C(O)CCCCC(=O)O MCULE-7155960751 [1,0,0,0,0,1|2,0,0]=4 545 B9R0.55 O=C(O)CNNCC(=O)O MCULE-8753369145 [1,0,0,0,0,1|2,0,0]=4 546 B11R0.29 CC(=N)NCCC[C@H](N)C(=O)O MCULE-5358658112 [0,0,0,0,0,2|2,0,0]=4 547 B11R0.29 CC(=N)NCCC[C@H](N)C(=O)O MCULE-5606810596 [0,0,0,0,0,2|2,0,0]=4 548 B11R0.29 CC(=N)NCCC[C@H](N)C(=O)O MCULE-7980342928 [0,0,0,0,0,2|2,0,0]=4 549 B11R0.29 CC(=N)NCCC[C@H](N)C(=O)O MCULE-8195408633 [0,0,0,0,0,2|2,0,0]=4 550 B11R0.29 CC(=N)NCCC[C@H](N)C(=O)O MCULE-8216004356 [0,0,0,0,0,2|2,0,0]=4 551 B11R0.29 N=C(N)NCCCC(N)C(=O)O MCULE-3125760737 [0,0,0,0,0,2|2,0,0]=4 552 B11R0.29 N=C(N)NCCCC(N)C(=O)O MCULE-5122302808 [0,0,0,0,0,2|2,0,0]=4 553 B11R0.29 N=C(N)NCCCC(N)C(=O)O MCULE-6153263942 [0,0,0,0,0,2|2,0,0]=4 554 B11R0.29 N=C(N)NCCCC(N)C(=O)O MCULE-9072241723 [0,0,0,0,0,2|2,0,0]=4 555 B11R0.29 N=C(N)NCCC[C@@H](N)C(=O)O MCULE-1262352579 [0,0,0,0,0,2|2,0,0]=4 556 B11R0.29 N=C(N)NCCC[C@@H](N)C(=O)O MCULE-3838347198 [0,0,0,0,0,2|2,0,0]=4 557 B11R0.29 N=C(N)NCCC[C@@H](N)C(=O)O MCULE-8676148534 [0,0,0,0,0,2|2,0,0]=4 558 B11R0.29 N=C(N)NCCC[C@@H](N)C(=O)O MCULE-9872369459 [0,0,0,0,0,2|2,0,0]=4 559 B11R0.29 N=C(N)NCCC[C@H](N)C(=O)O MCULE-1290049418 [0,0,0,0,0,2|2,0,0]=4 560 B11R0.29 N=C(N)NCCC[C@H](N)C(=O)O MCULE-4214642097 [0,0,0,0,0,2|2,0,0]=4 561 B11R0.29 N=C(N)NCCC[C@H](N)C(=O)O MCULE-5108123240 [0,0,0,0,0,2|2,0,0]=4 562 B11R0.29 N=C(N)NCCC[C@H](O)C(=O)O MCULE-5530430751 [0,0,0,0,0,2|2,0,0]=4 563 B11R0.29 N=C(N)NOCCC(N)C(=O)O MCULE-4434498846 [0,0,0,0,0,2|2,0,0]=4 564 B11R0.29 N=C(N)NOCCC(N)C(=O)O MCULE-8379182275 [0,0,0,0,0,2|2,0,0]=4 565 B11R0.29 N=C(N)NOCC[C@H](N)C(=O)O MCULE-4133667223 [0,0,0,0,0,2|2,0,0]=4 566 B11R0.29 N=C(N)NOCC[C@H](N)C(=O)O MCULE-5293692556 [0,0,0,0,0,2|2,0,0]=4 567 B11R0.29 N=C(N)NOCC[C@H](N)C(=O)O MCULE-5682580831 [0,0,0,0,0,2|2,0,0]=4 568 B11R0.29 N=C(N)NOCC[C@H](N)C(=O)O MCULE-8698650428 [0,0,0,0,0,2|2,0,0]=4 569 B11R0.29 [C@H](N)(CCCNC(=N)N)C(=O)O MCULE-3794564775 [0,0,0,0,0,2|2,0,0]=4