0 B10R0.23 C=CCC(CC(C)C)C(=O)O MCULE-2926764647 [0,0,0,0,0,0|1,0,2]=3 1 B10R0.23 CC(=O)NC(CCO)C(=O)O MCULE-2399187108 [0,0,0,0,0,0|2,0,2]=4 2 B10R0.23 CC(=O)N[C@@H](CCS)C(=O)O MCULE-9792008044 [0,0,0,0,0,0|2,0,2]=4 3 B10R0.23 CC(C)CC(CCO)C(=O)[O-] MCULE-4548605892 [0,0,0,0,0,0|2,0,1]=3 4 B10R0.23 CC(C)CC(CCO)C(=O)[O-] MCULE-9161317315 [0,0,0,0,0,0|2,0,1]=3 5 B10R0.23 CC(C)CC(NC=O)C(=O)O MCULE-2113425622 [0,0,0,0,0,0|3,0,1]=4 6 B10R0.23 CC(C)CC(NC=O)C(=O)O MCULE-2665861320 [0,0,0,0,0,0|3,0,1]=4 7 B10R0.23 CC(C)C[C@@H](N=[N+]=[N-])C(=O)O MCULE-7741769150 [0,0,0,0,0,0|4,0,0]=4 8 B10R0.23 CC(C)C[C@@H](N=[N+]=[N-])C(=O)O MCULE-7970110124 [0,0,0,0,0,0|4,0,0]=4 9 B10R0.23 CC(C)C[C@@H](NC=O)C(=O)O MCULE-2403549316 [0,0,0,0,0,0|3,0,1]=4 10 B10R0.23 CC(C)C[C@@H](NC=O)C(=O)O MCULE-7982298582 [0,0,0,0,0,0|3,0,1]=4 11 B10R0.23 CC(C)C[C@H](N=[N+]=[N-])C(=O)O MCULE-1965043467 [0,0,0,0,0,0|4,0,0]=4 12 B10R0.23 CC(C)C[C@H](N=[N+]=[N-])C(=O)O MCULE-3924327145 [0,0,0,0,0,0|4,0,0]=4 13 B10R0.23 CC(C)C[C@H](NC=O)C(=O)O MCULE-3604975300 [0,0,0,0,0,0|3,0,1]=4 14 B10R0.23 CC(C)C[C@H](NC=O)C(=O)O MCULE-7489305926 [0,0,0,0,0,0|3,0,1]=4 15 B10R0.23 CCC=C(CC(=O)O)C(=O)O MCULE-1387104032 [0,0,0,0,0,0|1,0,3]=4 16 B10R0.23 CCCC(CC(=O)C)C(=O)O MCULE-7988753662 [0,0,0,0,0,0|0,0,2]=2 17 B10R0.23 CCCC(CC(=O)O)C(=O)O MCULE-5222720019 [0,0,0,0,0,0|1,0,1]=2 18 B10R0.23 CCCC(CC(C)C)C(=O)O MCULE-1147118949 [0,0,0,0,0,0|1,0,0]=1 19 B10R0.23 CCCC(NC(=O)C)C(=O)O MCULE-3719218412 [0,0,0,0,0,0|1,0,2]=3 20 B10R0.23 CCCC(NC(=O)N)C(=O)O MCULE-3451078854 [0,0,0,0,0,0|2,0,2]=4 21 B10R0.23 CCC[C@@H](NC(=O)C)C(=O)O MCULE-7396030806 [0,0,0,0,0,0|1,0,2]=3 22 B10R0.23 CCC[C@@H](NC(=O)C)C(=O)O MCULE-7424603595 [0,0,0,0,0,0|1,0,2]=3 23 B10R0.23 CCC[C@@H](NC(=O)N)C(=O)O MCULE-4836272670 [0,0,0,0,0,0|2,0,2]=4 24 B10R0.23 CCC[C@H](NC(=O)C)C(=O)O MCULE-2905526129 [0,0,0,0,0,0|1,0,2]=3 25 B10R0.23 CCC[C@H](NC(=O)C)C(=O)O MCULE-6395010914 [0,0,0,0,0,0|1,0,2]=3 26 B10R0.23 CNCC(NC(=O)C)C(=O)O MCULE-4047191308 [0,0,0,0,0,0|2,0,2]=4 27 B10R0.23 CNC[C@H](NC(=O)C)C(=O)O MCULE-3833734431 [0,0,0,0,0,0|2,0,2]=4 28 B10R0.23 COCC(CC(=O)O)C(=O)O MCULE-7211279043 [0,0,0,0,0,0|2,0,1]=3 29 B10R0.23 COCC(NC(=O)C)C(=O)O MCULE-9763122983 [0,0,0,0,0,0|2,0,2]=4 30 B10R0.23 COC[C@@H](NC(=O)C)C(=O)O MCULE-2239598357 [0,0,0,0,0,0|2,0,2]=4 31 B10R0.23 COC[C@@H](NC(=O)C)C(=O)O MCULE-4278788977 [0,0,0,0,0,0|2,0,2]=4 32 B10R0.23 COC[C@H](NC(=O)C)C(=O)O MCULE-5146213386 [0,0,0,0,0,0|2,0,2]=4 33 B10R0.23 CSCC(NC(=O)C)C(=O)O MCULE-8059509909 [0,0,0,0,0,0|2,0,2]=4 34 B10R0.23 CSC[C@H](NC(=O)C)C(=O)O MCULE-1058369746 [0,0,0,0,0,0|2,0,2]=4 35 B9R0.14 C=CC(CCC)CC(=O)O MCULE-7907267151 [1,0,0,0,0,0|2,0,1]=4 36 B9R0.15 C=CCC(CCC)C(=O)O MCULE-5379398676 [1,0,0,0,0,0|0,0,2]=3 37 B9R0.15 CC(=O)N(CCO)CCO MCULE-1068519018 [1,0,0,0,0,0|3,0,0]=4 38 B9R0.15 CCC=C(CCC)C(=O)O MCULE-6379126755 [1,0,0,0,0,0|0,0,2]=3 39 B9R0.15 CCCC(CCC)C(=O)C MCULE-3853377484 [1,0,0,0,0,0|1,0,0]=2 40 B9R0.15 CCCC(CCC)C(=O)Cl MCULE-4979211332 [1,0,0,0,0,0|1,0,0]=2 41 B9R0.15 CCCC(CCC)C(=O)N MCULE-7316825141 [1,0,0,0,0,0|1,0,0]=2 42 B9R0.15 CCCC(CCC)C(=O)O MCULE-7136317196 [1,0,0,0,0,0|0,0,0]=1 43 B9R0.15 CCCC(CCC)C(=O)[O-] MCULE-4799083200 [1,0,0,0,0,0|0,0,1]=2 44 B9R0.15 CCCC(NC=O)C(=O)O MCULE-7516123408 [1,0,0,0,0,0|1,0,2]=4 45 B9R0.15 CCCC(OCC)C(=O)O MCULE-7197686501 [1,0,0,0,0,0|1,0,0]=2 46 B9R0.15 CCCC(SCC)C(=O)[O-] MCULE-3750013296 [1,0,0,0,0,0|1,0,1]=3 47 B9R0.15 CCCC(SCC)C(=O)[O-] MCULE-5882369366 [1,0,0,0,0,0|1,0,1]=3 48 B9R0.15 CCCN(CCC)C(=O)C MCULE-3393111489 [1,0,0,0,0,0|2,0,0]=3 49 B9R0.15 CCCN(CCC)C(=O)Cl MCULE-6057450753 [1,0,0,0,0,0|2,0,0]=3 50 B9R0.15 CCNC(CCN)C(=O)N MCULE-3086906812 [1,0,0,0,0,0|3,0,0]=4 51 B9R0.15 CCOC(OCC)C(=O)C MCULE-3350106544 [1,0,0,0,0,0|3,0,0]=4 52 B9R0.15 CCOC(OCC)C(=O)N MCULE-5576939683 [1,0,0,0,0,0|3,0,0]=4 53 B9R0.15 CCOC(OCC)C(=O)O MCULE-9319913793 [1,0,0,0,0,0|2,0,0]=3 54 B9R0.15 CCSC(SCC)C(=O)N MCULE-3034304577 [1,0,0,0,0,0|3,0,0]=4 55 B9R0.15 COCC(COC)C(=O)O MCULE-6082875325 [1,0,0,0,0,0|2,0,0]=3 56 B9R0.15 NC(=O)N(CCO)CCO MCULE-7535606627 [1,0,0,0,0,0|3,0,0]=4 57 B9R0.15 NCCC(CCN)C(=O)O MCULE-3747615668 [1,0,0,0,0,0|2,0,0]=3 58 B9R0.15 NCCC(CCN)C(=O)O MCULE-8055618051 [1,0,0,0,0,0|2,0,0]=3 59 B9R0.39 CC(C)CC(C#N)C(=O)O MCULE-2645522679 [1,0,0,0,0,0|2,0,1]=4 60 B9R0.39 CC(C)CC(CN)C(=O)O MCULE-3679366313 [1,0,0,0,0,0|2,0,0]=3 61 B9R0.39 CC(C)CC(CN)C(=O)O MCULE-4357118038 [1,0,0,0,0,0|2,0,0]=3 62 B9R0.39 CC(C)CC(CN)C(=O)O MCULE-5464779902 [1,0,0,0,0,0|2,0,0]=3 63 B9R0.39 CC(C)C[C@@H](CN)C(=O)O MCULE-1199418849 [1,0,0,0,0,0|2,0,0]=3 64 B9R0.39 CC(C)C[C@@H](CN)C(=O)O MCULE-2007636867 [1,0,0,0,0,0|2,0,0]=3 65 B9R0.39 CC(C)C[C@@H](CN)C(=O)O MCULE-3151357434 [1,0,0,0,0,0|2,0,0]=3 66 B9R0.39 CC(C)C[C@@H](CN)C(=O)O MCULE-6826376648 [1,0,0,0,0,0|2,0,0]=3 67 B9R0.39 CC(C)C[C@@H](CO)C(=O)O MCULE-8614733501 [1,0,0,0,0,0|2,0,0]=3 68 B9R0.39 CC(C)C[C@H](CN)C(=O)O MCULE-1897946062 [1,0,0,0,0,0|2,0,0]=3 69 B9R0.39 CC(C)C[C@H](CN)C(=O)O MCULE-5204739284 [1,0,0,0,0,0|2,0,0]=3 70 B9R0.39 CC(C)C[C@H](CN)C(=O)O MCULE-5587093761 [1,0,0,0,0,0|2,0,0]=3 71 B9R0.39 CC(C)C[C@H](CN)C(=O)O MCULE-6247275234 [1,0,0,0,0,0|2,0,0]=3 72 B9R0.39 CC(C)C[C@H](CO)C(=O)O MCULE-3078607450 [1,0,0,0,0,0|2,0,0]=3 73 B9R0.39 CCC(CC(=O)O)C(=O)O MCULE-6275256194 [1,0,0,0,0,0|1,0,1]=3 74 B9R0.39 CCC(CC(C)C)C(=O)O MCULE-5215518236 [1,0,0,0,0,0|1,0,0]=2 75 B9R0.39 CCC(CC(F)F)C(=O)O MCULE-2440123997 [1,0,0,0,0,0|2,0,0]=3 76 B9R0.39 CCC(NC(=O)C)C(=O)O MCULE-1309294109 [1,0,0,0,0,0|1,0,2]=4 77 B9R0.39 CCC(NC(=O)C)C(=O)O MCULE-9698129539 [1,0,0,0,0,0|1,0,2]=4 78 B9R0.39 CCC(NC(C)C)C(=O)O MCULE-7235932783 [1,0,0,0,0,0|2,0,0]=3 79 B9R0.39 CCC(NC(C)C)C(=O)O MCULE-7934342287 [1,0,0,0,0,0|2,0,0]=3 80 B9R0.39 CC[C@@H](NC(=O)C)C(=O)O MCULE-4606830483 [1,0,0,0,0,0|1,0,2]=4 81 B9R0.39 CC[C@@H](NC(=O)C)C(=O)O MCULE-7396715663 [1,0,0,0,0,0|1,0,2]=4 82 B9R0.39 CNC(CC(=O)O)C(=O)O MCULE-5049531079 [1,0,0,0,0,0|2,0,1]=4 83 B9R0.39 CNC(CC(C)C)C(=O)O MCULE-4940999271 [1,0,0,0,0,0|2,0,0]=3 84 B9R0.39 CNC(CC(C)C)C(=O)O MCULE-7266045564 [1,0,0,0,0,0|2,0,0]=3 85 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O MCULE-4725692041 [1,0,0,0,0,0|2,0,1]=4 86 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O MCULE-6356483886 [1,0,0,0,0,0|2,0,1]=4 87 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O MCULE-9428412153 [1,0,0,0,0,0|2,0,1]=4 88 B9R0.39 CN[C@@H](CC(C)C)C(=O)N MCULE-7907533997 [1,0,0,0,0,0|3,0,0]=4 89 B9R0.39 CN[C@@H](CC(C)C)C(=O)N MCULE-8591020499 [1,0,0,0,0,0|3,0,0]=4 90 B9R0.39 CN[C@@H](CC(C)C)C(=O)O MCULE-2758691344 [1,0,0,0,0,0|2,0,0]=3 91 B9R0.39 CN[C@@H](CC(C)C)C(=O)O MCULE-3349649810 [1,0,0,0,0,0|2,0,0]=3 92 B9R0.39 CN[C@@H](CC(C)C)C(=O)O MCULE-4487326533 [1,0,0,0,0,0|2,0,0]=3 93 B9R0.39 CN[C@@H](CC(C)C)C(=O)O MCULE-7740057854 [1,0,0,0,0,0|2,0,0]=3 94 B9R0.39 CN[C@H](CC(=O)O)C(=O)O MCULE-1405442072 [1,0,0,0,0,0|2,0,1]=4 95 B9R0.39 CN[C@H](CC(=O)O)C(=O)O MCULE-8611804669 [1,0,0,0,0,0|2,0,1]=4 96 B9R0.39 CN[C@H](CC(=O)O)C(=O)O MCULE-9080466863 [1,0,0,0,0,0|2,0,1]=4 97 B9R0.39 CN[C@H](CC(C)C)C(=O)O MCULE-2279011654 [1,0,0,0,0,0|2,0,0]=3 98 B9R0.39 CN[C@H](CC(C)C)C(=O)O MCULE-2290136385 [1,0,0,0,0,0|2,0,0]=3 99 B9R0.39 CN[C@H](CC(C)C)C(=O)O MCULE-2552934491 [1,0,0,0,0,0|2,0,0]=3 100 B9R0.39 CN[C@H](CC(C)C)C(=O)O MCULE-8319051174 [1,0,0,0,0,0|2,0,0]=3 101 B9R0.39 COC(CC(=O)O)C(=O)O MCULE-3778948045 [1,0,0,0,0,0|2,0,1]=4 102 B9R0.39 COC(CC(C)C)C(=O)O MCULE-4497994493 [1,0,0,0,0,0|2,0,0]=3 103 B9R0.39 NCC(CC(=O)O)C(=O)O MCULE-1683659350 [1,0,0,0,0,0|2,0,1]=4 104 B9R0.39 NCC(CC(=O)O)C(=O)O MCULE-8428141166 [1,0,0,0,0,0|2,0,1]=4 105 B9R0.39 O=C(O)CC(CS)C(=O)O MCULE-7352825049 [1,0,0,0,0,0|2,0,1]=4 106 B11R0.32 CC(=O)C(CC(C)C)CN(C)C MCULE-2100881066 [0,1,0,0,0,0|3,0,0]=4 107 B11R0.32 CC(=O)NC(CC(C)C)C(=O)O MCULE-7375828849 [0,1,0,0,0,0|1,0,2]=4 108 B11R0.32 CC(=O)NC(CC(C)C)C(=O)O MCULE-8541961335 [0,1,0,0,0,0|1,0,2]=4 109 B11R0.32 CC(=O)N[C@@H](CC(C)C)C(=O)O MCULE-3541053611 [0,1,0,0,0,0|1,0,2]=4 110 B11R0.32 CC(=O)N[C@@H](CC(C)C)C(=O)O MCULE-9082534218 [0,1,0,0,0,0|1,0,2]=4 111 B11R0.32 CC(=O)N[C@H](CC(C)C)C(=O)O MCULE-8998784853 [0,1,0,0,0,0|1,0,2]=4 112 B11R0.32 CC(=O)S[C@@H](CC(C)C)C(=O)O MCULE-8202562834 [0,1,0,0,0,0|1,0,2]=4 113 B11R0.32 CC(C)CC(CC(=O)O)C(=O)O MCULE-4610463681 [0,1,0,0,0,0|1,0,1]=3 114 B11R0.32 CC(C)CC(CC(C)C)C(=O)O MCULE-8986413010 [0,1,0,0,0,0|1,0,0]=2 115 B11R0.32 CC(C)C[C@H](NC(C)C)C(=O)O MCULE-8416697546 [0,1,0,0,0,0|2,0,0]=3 116 B11R0.32 [C@H](CC(C)C)(NC(=O)C)C(=O)O MCULE-9509726558 [0,1,0,0,0,0|1,0,2]=4 117 B11R0.115 CCC(C)C(NC(=O)C)C(=O)O MCULE-4181667774 [0,1,0,0,0,0|1,0,2]=4 118 B11R0.115 CC[C@H](C)[C@@H](NC(=O)C)C(=O)O MCULE-5204918668 [0,1,0,0,0,0|1,0,2]=4 119 B11R0.115 CC[C@H](C)[C@H](NC(=O)C)C(=O)O MCULE-1874701839 [0,1,0,0,0,0|1,0,2]=4 120 B11R0.115 CC[C@H](C)[C@H](NC(=O)C)C(=O)O MCULE-2741794137 [0,1,0,0,0,0|1,0,2]=4 121 B11R0.115 CC[C@H](C)[C@H](NC(=O)C)C(=O)O MCULE-6557323131 [0,1,0,0,0,0|1,0,2]=4 122 B11R0.115 [C@@H](C)(CC)[C@@H](NC(=O)C)C(=O)O MCULE-5237529088 [0,1,0,0,0,0|1,0,2]=4 123 B11R0.115 [C@@H](NC(=O)C)(C(=O)O)C(C)CC MCULE-8702697039 [0,1,0,0,0,0|1,0,2]=4 124 B11R0.115 [C@H](C)(CC)[C@@H](NC(=O)C)C(=O)O MCULE-2360572915 [0,1,0,0,0,0|1,0,2]=4 125 B11R0.160 C=CCCC(CC(C)C)C(=O)O MCULE-5690484976 [0,1,0,0,0,0|1,0,1]=3 126 B11R0.160 CC(=O)N[C@@H](CCCN)C(=O)O MCULE-1427956391 [0,1,0,0,0,0|1,0,2]=4 127 B11R0.160 CC(=O)N[C@@H](CCCN)C(=O)O MCULE-1647417475 [0,1,0,0,0,0|1,0,2]=4 128 B11R0.160 CCCCC(CC(=O)O)C(=O)O MCULE-6663725829 [0,1,0,0,0,0|1,0,1]=3 129 B11R0.160 CCCCC(NC(=O)C)C(=O)O MCULE-1796227277 [0,1,0,0,0,0|1,0,2]=4 130 B11R0.160 CCCCC(NC(=O)C)C(=O)O MCULE-2709462387 [0,1,0,0,0,0|1,0,2]=4 131 B11R0.160 CCCC[C@@H](NC(=O)C)C(=O)O MCULE-5788818981 [0,1,0,0,0,0|1,0,2]=4 132 B11R0.160 CCCC[C@@H](NC(=O)C)C(=O)O MCULE-8915739057 [0,1,0,0,0,0|1,0,2]=4 133 B11R0.160 CCCC[C@H](NC(=O)C)C(=O)O MCULE-3651693998 [0,1,0,0,0,0|1,0,2]=4 134 B11R0.160 CCCC[C@H](NC(=O)C)C(=O)O MCULE-4560203101 [0,1,0,0,0,0|1,0,2]=4 135 B11R0.160 CCSCC(NC(=O)C)C(=O)O MCULE-9115578925 [0,1,0,0,0,0|1,0,2]=4 136 B11R0.160 CCSC[C@H](NC(=O)C)C(=O)O MCULE-5694706376 [0,1,0,0,0,0|1,0,2]=4 137 B11R0.160 COCCC(NC(=O)C)C(=O)O MCULE-9296272594 [0,1,0,0,0,0|1,0,2]=4 138 B11R0.160 CSCCC(NC(=O)C)C(=O)O MCULE-6118079123 [0,1,0,0,0,0|1,0,2]=4 139 B11R0.160 CSCC[C@@H](NC(=O)C)C(=O)O MCULE-3164935915 [0,1,0,0,0,0|1,0,2]=4 140 B11R0.160 CSCC[C@@H](NC(=O)C)C(=O)O MCULE-9459431743 [0,1,0,0,0,0|1,0,2]=4 141 B11R0.160 CSCC[C@H](NC(=O)C)C(=O)O MCULE-8710138272 [0,1,0,0,0,0|1,0,2]=4 142 B11R0.160 O=C(O)CC(NCCO)C(=O)O MCULE-9792724168 [0,1,0,0,0,0|2,0,1]=4 143 B11R0.160 [C@@H](CCSC)(NC(=O)C)C(=O)O MCULE-5012891970 [0,1,0,0,0,0|1,0,2]=4 144 B11R0.236 CCCC(NC(=O)CCl)C(=O)O MCULE-4178827028 [0,1,0,0,0,0|1,0,2]=4 145 B11R0.236 CCCC(NC(=O)CN)C(=O)O MCULE-3680152818 [0,1,0,0,0,0|1,0,2]=4 146 B11R0.236 CCC[C@H](NC(=O)CCl)C(=O)O MCULE-2223443521 [0,1,0,0,0,0|1,0,2]=4 147 B11R1.74 CC(=O)C1CC(CC(C1)C)C MCULE-3304279258 [0,0,0,1,0,0|2,0,0]=3 148 B11R1.74 CC1CC(CC(C1)C(=O)O)C MCULE-4414065035 [0,0,0,1,0,0|1,0,0]=2 149 B11R1.74 CC1CC(CC(O1)C)C(=O)O MCULE-8718069513 [0,0,0,1,0,0|0,0,0]=1 150 B11R1.74 CC1CN(CC(O1)C(=O)O)C MCULE-1120383485 [0,0,0,1,0,0|3,0,0]=4 151 B11R1.74 CC1CN(CC(O1)C(=O)O)C MCULE-4331152110 [0,0,0,1,0,0|3,0,0]=4 152 B11R1.74 C[C@@H]1CC(C[C@@H](C1)C)C(=O)O MCULE-8476320504 [0,0,0,1,0,0|1,0,0]=2 153 B11R1.74 C[C@@H]1C[C@@H](C[C@@H](C1)C)C(=O)O MCULE-7313940085 [0,0,0,1,0,0|1,0,0]=2 154 B11R1.74 C[C@H]1CC(C[C@H](N1)C)C(=O)O MCULE-2237943409 [0,0,0,1,0,0|1,0,0]=2 155 B11R1.74 C[C@H]1CC(C[C@H](N1)C)C(=O)O MCULE-4813276637 [0,0,0,1,0,0|1,0,0]=2 156 B11R1.74 C[C@H]1CC(C[C@H](O1)C)C(=O)O MCULE-3337799083 [0,0,0,1,0,0|0,0,0]=1 157 B11R1.74 C[C@H]1CN(C[C@H](O1)C)C(=O)Cl MCULE-7854438558 [0,0,0,1,0,0|2,0,0]=3 158 B11R1.86 CC(=O)CC1CCCCC1=O MCULE-3575915774 [0,0,0,1,0,0|1,0,2]=4 159 B11R1.86 CC(C)CC1CCCCC1O MCULE-5256349727 [0,0,0,1,0,0|2,0,1]=4 160 B11R1.86 CC(C)CC1NCCNC1=O MCULE-3430905518 [0,0,0,1,0,0|3,0,0]=4 161 B11R1.86 CC(C)CN1CCCCC1=O MCULE-9241165779 [0,0,0,1,0,0|3,0,0]=4 162 B11R1.86 CC(O)CC1CCCCN1C MCULE-3186311886 [0,0,0,1,0,0|3,0,0]=4 163 B11R1.86 CN(C)CC1CCCCC1=O MCULE-2290738401 [0,0,0,1,0,0|3,0,0]=4 164 B11R1.86 C[C@H](O)C[C@@H]1CCCCN1C MCULE-1823823531 [0,0,0,1,0,0|3,0,0]=4 165 B11R1.86 C[C@H](O)C[C@@H]1CCCCN1C MCULE-4140894566 [0,0,0,1,0,0|3,0,0]=4 166 B11R1.86 C[C@H](O)C[C@H]1CCCCN1C MCULE-2144718958 [0,0,0,1,0,0|3,0,0]=4 167 B11R1.86 C[C@H](O)C[C@H]1CCCCN1C MCULE-4299162576 [0,0,0,1,0,0|3,0,0]=4 168 B11R1.86 C[NH+](C)CC1CCCCC1=O MCULE-7035082192 [0,0,0,1,0,0|3,0,0]=4 169 B11R1.86 O=C(O)CC1CCCCC1=O MCULE-2872066455 [0,0,0,1,0,0|2,0,1]=4 170 B11R1.86 O=C(O)CN1CCCOC1=O MCULE-2943592143 [0,0,0,1,0,0|2,0,1]=4 171 B11R1.178 CC(=O)N1CCCC1C(=O)O MCULE-1813411528 [0,0,0,1,0,0|1,0,2]=4 172 B11R1.178 CC(=O)N1CCCC1C(=O)O MCULE-9022800854 [0,0,0,1,0,0|1,0,2]=4 173 B11R1.178 CC(=O)N1CCC[C@@H]1C(=O)O MCULE-1405603447 [0,0,0,1,0,0|1,0,2]=4 174 B11R1.178 CC(=O)N1CCC[C@@H]1C(=O)O MCULE-9216589773 [0,0,0,1,0,0|1,0,2]=4 175 B11R1.178 CC(=O)N1CCC[C@H]1C(=O)O MCULE-1169221802 [0,0,0,1,0,0|1,0,2]=4 176 B11R1.178 CC(=O)N1CCC[C@H]1C(=O)O MCULE-9915147289 [0,0,0,1,0,0|1,0,2]=4 177 B11R1.178 CC(C)C1CNCC1C(=O)O MCULE-5419643735 [0,0,0,1,0,0|2,0,0]=3 178 B11R1.178 CC(C)C1CNCC1C(=O)O MCULE-7569761775 [0,0,0,1,0,0|2,0,0]=3 179 B11R1.178 CC(C)C1NCCC1C(=O)O MCULE-6302830859 [0,0,0,1,0,0|2,0,0]=3 180 B11R1.178 CC(C)C1NCCC1C(=O)O MCULE-8242793194 [0,0,0,1,0,0|2,0,0]=3 181 B11R1.178 CC(C)N1CCCC1C(=O)N MCULE-4454222423 [0,0,0,1,0,0|3,0,0]=4 182 B11R1.178 CC(C)N1CCCC1C(=O)O MCULE-2119413242 [0,0,0,1,0,0|2,0,0]=3 183 B11R1.178 CC(C)N1CCCC1C(=O)O MCULE-6929026583 [0,0,0,1,0,0|2,0,0]=3 184 B11R1.178 CC(C)N1CCC[C@@H]1C(=O)O MCULE-8319338511 [0,0,0,1,0,0|2,0,0]=3 185 B11R1.178 CC(C)N1CCC[C@@H]1C(=O)O MCULE-8583036106 [0,0,0,1,0,0|2,0,0]=3 186 B11R1.178 CC(C)N1CCC[C@H]1C(=O)O MCULE-7602604909 [0,0,0,1,0,0|2,0,0]=3 187 B11R1.178 CC(C)N1CCC[C@H]1C(=O)O MCULE-9348214683 [0,0,0,1,0,0|2,0,0]=3 188 B11R1.178 CC(C)[C@H]1CNC[C@@H]1C(=O)O MCULE-1469912477 [0,0,0,1,0,0|2,0,0]=3 189 B11R1.178 CC(C)[C@H]1CNC[C@@H]1C(=O)O MCULE-2313554686 [0,0,0,1,0,0|2,0,0]=3 190 B11R1.178 CC(C)[C@H]1CNC[C@@H]1C(=O)O MCULE-7557854435 [0,0,0,1,0,0|2,0,0]=3 191 B11R1.178 CC(C)[C@H]1CNC[C@@H]1C(=O)O MCULE-8561355438 [0,0,0,1,0,0|2,0,0]=3 192 B11R1.178 CC(C)[C@H]1CNC[C@@H]1C(=O)O MCULE-9451071180 [0,0,0,1,0,0|2,0,0]=3 193 B11R1.178 O=C(O)C1CCCC1C(=O)O MCULE-1370613174 [0,0,0,1,0,0|1,0,1]=3 194 B11R1.178 O=C(O)C1CCNC1C(=O)O MCULE-2316581520 [0,0,0,1,0,0|2,0,1]=4 195 B11R1.178 O=C(O)C1CCNC1C(=O)O MCULE-9331741117 [0,0,0,1,0,0|2,0,1]=4 196 B11R1.178 O=C(O)C1COCC1C(=O)O MCULE-4469020347 [0,0,0,1,0,0|2,0,1]=4 197 B11R1.178 O=C(O)[C@@H]1CCCN1C(=O)O MCULE-1970767326 [0,0,0,1,0,0|2,0,1]=4 198 B11R1.178 O=C(O)[C@@H]1CCC[C@H]1C(=O)O MCULE-5772739452 [0,0,0,1,0,0|1,0,1]=3 199 B11R1.178 O=C(O)[C@@H]1CCC[C@H]1C(=O)O MCULE-6923663809 [0,0,0,1,0,0|1,0,1]=3 200 B11R1.178 O=C(O)[C@@H]1CNC[C@@H]1C(=O)O MCULE-7094844570 [0,0,0,1,0,0|2,0,1]=4 201 B11R1.178 O=C(O)[C@@H]1COC[C@@H]1C(=O)O MCULE-2959853524 [0,0,0,1,0,0|2,0,1]=4 202 B11R1.178 O=C(O)[C@@H]1COC[C@H]1C(=O)O MCULE-9190757159 [0,0,0,1,0,0|2,0,1]=4 203 B11R1.178 O=C(O)[C@H]1CCC[C@H]1C(=O)O MCULE-2898188373 [0,0,0,1,0,0|1,0,1]=3 204 B11R1.178 O=C(O)[C@H]1COC[C@@H]1C(=O)O MCULE-4154653911 [0,0,0,1,0,0|2,0,1]=4 205 B11R1.178 O=C(O)[C@H]1COC[C@@H]1C(=O)O MCULE-5321587208 [0,0,0,1,0,0|2,0,1]=4 206 B11R1.182 CCCC1CN(CCC1=O)C MCULE-2190429302 [0,0,0,1,0,0|3,0,0]=4 207 B11R1.184 CC1(CC(C(=O)N1)CCBr)C MCULE-8648945257 [0,0,0,1,0,0|3,0,0]=4 208 B11R1.184 CC1(OC(=O)[C@@H](O1)CCO)C MCULE-3850668628 [0,0,0,1,0,0|3,0,0]=4 209 B11R1.497 CC(=O)C1CCCCC(=O)C1 MCULE-8090726810 [0,0,0,1,0,0|1,0,2]=4 210 B11R1.497 CC(=O)N1CCNCC(C1)O MCULE-6634305760 [0,0,0,1,0,0|3,0,0]=4 211 B11R1.497 CC(=O)N1CCNCC(C1)O MCULE-8301515073 [0,0,0,1,0,0|3,0,0]=4 212 B11R1.497 NC1CCCCC(C1)C(=O)O MCULE-6764464855 [0,0,0,1,0,0|1,0,0]=2 213 B11R1.497 O=C(O)C1CCCCC(C1)O MCULE-8775414897 [0,0,0,1,0,0|0,0,0]=1 214 B11R1.497 O=C1CCCCC(C1)C(=O)O MCULE-7646723801 [0,0,0,1,0,0|0,0,2]=3 215 B11R1.497 O=C1CCCCC(N1)C(=O)O MCULE-3462654668 [0,0,0,1,0,0|1,0,2]=4 216 B11R1.645 CC(C)CC1CC(=O)OC1=O MCULE-5567066644 [0,0,0,1,0,0|2,0,1]=4 217 B11R1.645 CC(O)CN1CC(OC1=O)C MCULE-2947492543 [0,0,0,1,0,0|1,0,0]=2 218 B11R1.730 CC(=O)C1CCOC(C1)(C)C MCULE-6929681629 [0,0,0,1,0,0|3,0,0]=4 219 B11R1.730 CC1(CC(CCN1)C(=O)O)C MCULE-8159392480 [0,0,0,1,0,0|2,0,0]=3 220 B11R1.730 CC1(CC(CCO1)C(=O)Cl)C MCULE-1487251101 [0,0,0,1,0,0|3,0,0]=4 221 B11R1.730 CC1(CC(CCO1)C(=O)O)C MCULE-5978480117 [0,0,0,1,0,0|2,0,0]=3 222 B11R1.730 CC1(CCC=C(C1)C(=O)O)C MCULE-7732020212 [0,0,0,1,0,0|1,0,2]=4 223 B11R1.730 CC1(CCCC(C1)C(=O)O)C MCULE-1597122526 [0,0,0,1,0,0|1,0,0]=2 224 B11R1.730 CC1(CCCC(C1)N(=O)=O)C MCULE-7126787436 [0,0,0,1,0,0|2,0,1]=4 225 B11R1.730 CC1(CCCC(O1)C(=O)O)C MCULE-6134883479 [0,0,0,1,0,0|2,0,0]=3 226 B11R1.730 CC1(CCCN(C1)C(=O)Cl)C MCULE-7087297832 [0,0,0,1,0,0|3,0,0]=4 227 B11R1.730 CC1(CCNC(C1)C(=O)O)C MCULE-1186852121 [0,0,0,1,0,0|2,0,0]=3 228 B11R1.730 CC1(CCNC(C1)C(=O)O)C MCULE-5031883785 [0,0,0,1,0,0|2,0,0]=3 229 B11R1.730 CC1(CNCC(O1)C(=O)O)C MCULE-3850941228 [0,0,0,1,0,0|3,0,0]=4 230 B11R1.730 CC1(CNCC(O1)C(=O)O)C MCULE-4368873526 [0,0,0,1,0,0|3,0,0]=4 231 B11R1.730 CC1(COCC(N1)C(=O)O)C MCULE-9878578908 [0,0,0,1,0,0|3,0,0]=4 232 B11R1.730 CC1(COCC(O1)C(=O)O)C MCULE-8209803482 [0,0,0,1,0,0|3,0,0]=4 233 B11R1.730 O=C(O)C1CC(CCN1)(F)F MCULE-2772004848 [0,0,0,1,0,0|3,0,0]=4 234 B11R1.730 O=C(O)C1CC(CCN1)(F)F MCULE-5000214371 [0,0,0,1,0,0|3,0,0]=4 235 B11R1.730 O=C(O)C1CCCC(C1)(F)F MCULE-2685730195 [0,0,0,1,0,0|2,0,0]=3 236 B11R1.730 O=C(O)C1CCCS(=O)(=O)C1 MCULE-2941931058 [0,0,0,1,0,0|2,0,1]=4 237 B11R1.730 O=C(O)C1CNCC(C1)(F)F MCULE-1061763206 [0,0,0,1,0,0|3,0,0]=4 238 B11R1.730 O=C(O)C1CNCC(C1)(F)F MCULE-4420284602 [0,0,0,1,0,0|3,0,0]=4 239 B11R1.730 O=C(O)[C@@H]1CC(CCN1)(F)F MCULE-1496564772 [0,0,0,1,0,0|3,0,0]=4 240 B11R1.730 O=C(O)[C@@H]1CC(CCN1)(F)F MCULE-5121648329 [0,0,0,1,0,0|3,0,0]=4 241 B11R1.730 O=C(O)[C@@H]1CC(CCN1)(F)F MCULE-5853696607 [0,0,0,1,0,0|3,0,0]=4 242 B11R1.730 O=C(O)[C@@H]1CC(CCN1)(F)F MCULE-8207836720 [0,0,0,1,0,0|3,0,0]=4 243 B11R1.806 NCCC(NC1CC1)C(=O)O MCULE-1301904937 [0,0,0,1,0,0|3,0,0]=4 244 B11R1.929 CC(=O)CC1(CCC1)C(=O)O MCULE-7740494752 [0,0,0,1,0,0|0,0,2]=3 245 B11R1.929 CC(=O)NC1(CCC1)C(=O)O MCULE-6384958791 [0,0,0,1,0,0|1,0,2]=4 246 B11R1.929 CC(C)CC1(CCC1)C(=O)O MCULE-3957124047 [0,0,0,1,0,0|1,0,0]=2 247 B11R1.929 CC(C)CC1(COC1)C(=O)O MCULE-8636222041 [0,0,0,1,0,0|2,0,0]=3 248 B11R1.929 CC(C)OC1(CCC1)C(=O)O MCULE-6262373745 [0,0,0,1,0,0|2,0,0]=3 249 B11R1.929 CC(C)OC1(CNC1)C(=O)O MCULE-5844141906 [0,0,0,1,0,0|3,0,0]=4 250 B11R1.929 CC(C)OC1(CNC1)C(=O)O MCULE-6278292197 [0,0,0,1,0,0|3,0,0]=4 251 B11R1.929 O=C(O)C1(CCC1)CC(F)F MCULE-9734476572 [0,0,0,1,0,0|2,0,0]=3 252 B11R1.929 O=C(O)CC1(CCC1)C(=O)O MCULE-5638680542 [0,0,0,1,0,0|1,0,1]=3 253 B9R0.33 C=CCC(C(=O)O)C(C)C MCULE-6557819980 [0,0,0,0,1,0|1,0,2]=4 254 B9R0.33 CC(C)C(CCN)C(=O)O MCULE-5177043751 [0,0,0,0,1,0|2,0,0]=3 255 B9R0.33 CC(C)C(CCN)C(=O)O MCULE-7075545898 [0,0,0,0,1,0|2,0,0]=3 256 B9R0.33 CC(O)[C@@H](N=[N+]=[N-])C(=O)O MCULE-6579264985 [0,0,0,0,1,0|3,0,0]=4 257 B9R0.33 CC(O)[C@@H](N=[N+]=[N-])C(=O)O MCULE-6992196456 [0,0,0,0,1,0|3,0,0]=4 258 B9R0.33 CCCC(C(=O)N)N(C)C MCULE-4951647411 [0,0,0,0,1,0|3,0,0]=4 259 B9R0.33 CCCC(C(=O)O)C(=O)O MCULE-5699074158 [0,0,0,0,1,0|1,0,1]=3 260 B9R0.33 CCCC(C(=O)O)C(C)C MCULE-9298455866 [0,0,0,0,1,0|1,0,0]=2 261 B9R0.33 CCCC(C(=O)O)N(C)C MCULE-1361270877 [0,0,0,0,1,0|2,0,0]=3 262 B9R0.33 CCC[C@@H](C(=O)O)N(C)C MCULE-5821588618 [0,0,0,0,1,0|2,0,0]=3 263 B9R0.33 CCC[C@@H](C(=O)O)N(C)C MCULE-6045614611 [0,0,0,0,1,0|2,0,0]=3 264 B9R0.33 CCC[C@H](C(=O)O)N(C)C MCULE-3627937276 [0,0,0,0,1,0|2,0,0]=3 265 B9R0.33 CCC[C@H](C(=O)O)N(C)C MCULE-6264285545 [0,0,0,0,1,0|2,0,0]=3 266 B9R0.33 CCNC(C(=O)O)C(C)C MCULE-2742420034 [0,0,0,0,1,0|2,0,0]=3 267 B9R0.33 CCNC(C(=O)O)C(C)C MCULE-6750636271 [0,0,0,0,1,0|2,0,0]=3 268 B9R0.33 CCN[C@H](C(=O)N)C(C)C MCULE-9689603957 [0,0,0,0,1,0|3,0,0]=4 269 B9R0.33 CCOC(C(=O)O)C(C)C MCULE-7127552205 [0,0,0,0,1,0|2,0,0]=3 270 B9R0.33 CCSC(C(=O)O)C(C)C MCULE-3558131875 [0,0,0,0,1,0|2,0,0]=3 271 B9R0.33 CN(C)C(CCN)C(=O)O MCULE-8339128470 [0,0,0,0,1,0|3,0,0]=4 272 B9R0.33 CN(C)[C@@H](CCN)C(=O)O MCULE-1062850066 [0,0,0,0,1,0|3,0,0]=4 273 B9R0.33 CN(C)[C@@H](CCN)C(=O)O MCULE-3495896981 [0,0,0,0,1,0|3,0,0]=4 274 B9R0.33 CN(C)[C@@H](CCO)C(=O)O MCULE-5311348966 [0,0,0,0,1,0|3,0,0]=4 275 B9R0.33 COCC(C(=O)O)N(C)C MCULE-4810605036 [0,0,0,0,1,0|3,0,0]=4 276 B9R0.33 COCC(C(=O)O)N(C)C MCULE-7502849046 [0,0,0,0,1,0|3,0,0]=4 277 B11R0.35 CCCC(CC(=O)O)CC(=O)O MCULE-6540318880 [0,0,0,0,0,1|1,0,1]=3 278 B11R0.35 CCCN(CC(C)O)CC(C)O MCULE-3775241848 [0,0,0,0,0,1|2,0,1]=4 279 B11R0.146 CCCC(=CCC(C)C)C(=O)O MCULE-2326280646 [0,0,0,0,0,1|1,0,1]=3 280 B11R0.146 CCCC(CCC(=O)C)C(=O)O MCULE-7919400845 [0,0,0,0,0,1|0,0,2]=3 281 B11R0.146 CCCC(CCC(=O)O)C(=O)C MCULE-2427095523 [0,0,0,0,0,1|2,0,1]=4 282 B8R0.5 CC(O)CC(O)CCO MCULE-4888514297 [2,0,0,0,0,0|1,0,0]=3 283 B8R0.5 CCCC(=O)CC(C)C MCULE-1475988710 [2,0,0,0,0,0|1,0,1]=4 284 B8R0.5 CCCC(C)CC(C)C MCULE-4080546731 [2,0,0,0,0,0|1,0,1]=4 285 B8R0.5 CCCC(C)CC(C)O MCULE-3968478752 [2,0,0,0,0,0|0,0,1]=3 286 B8R0.5 CCCC(O)CC(=O)O MCULE-3158579605 [2,0,0,0,0,0|1,0,1]=4 287 B8R0.5 CCNC(=O)CC(C)O MCULE-1959743741 [2,0,0,0,0,0|1,0,1]=4 288 B8R0.5 CCOC(=O)CC(C)O MCULE-5738582973 [2,0,0,0,0,0|1,0,1]=4 289 B8R0.5 CCOC(=O)CC(C)O MCULE-7412227285 [2,0,0,0,0,0|1,0,1]=4 290 B8R0.5 CCOC(=O)C[C@@H](C)O MCULE-2482059514 [2,0,0,0,0,0|1,0,1]=4 291 B8R0.5 CCOC(=O)C[C@@H](C)O MCULE-7632639859 [2,0,0,0,0,0|1,0,1]=4 292 B8R0.5 CCOC(=O)C[C@H](C)O MCULE-7934535288 [2,0,0,0,0,0|1,0,1]=4 293 B8R0.5 CCOC(=O)C[C@H](C)O MCULE-8099928659 [2,0,0,0,0,0|1,0,1]=4 294 B8R0.5 COCC(O)CC(C)C MCULE-8774838486 [2,0,0,0,0,0|2,0,0]=4 295 B8R0.16 CCC(CO)CC(C)C MCULE-9608291376 [2,0,0,0,0,0|1,0,1]=4 296 B8R0.16 COC(C=O)CC(C)C MCULE-3050869989 [2,0,0,0,0,0|2,0,0]=4 297 B8R0.22 CCCC(C#N)CCC MCULE-2112995188 [2,0,0,0,0,0|1,0,1]=4 298 B8R0.22 CCCC(C=O)CCC MCULE-6309806380 [2,0,0,0,0,0|0,0,0]=2 299 B8R0.22 CCCC(CBr)CCC MCULE-6937043566 [2,0,0,0,0,0|1,0,1]=4 300 B8R0.22 CCCC(CC)CCC MCULE-5910646657 [2,0,0,0,0,0|1,0,1]=4 301 B8R0.22 CCCC(CCO)SC MCULE-8834379385 [2,0,0,0,0,0|2,0,0]=4 302 B8R0.22 CCCC(CN)CCO MCULE-4682534414 [2,0,0,0,0,0|1,0,1]=4 303 B8R0.22 CCCC(CO)CCC MCULE-2670894441 [2,0,0,0,0,0|0,0,1]=3 304 B8R0.22 CCCN(C=O)CCC MCULE-8028235265 [2,0,0,0,0,0|1,0,0]=3 305 B8R0.22 CCCN(CCC)N=O MCULE-8973096480 [2,0,0,0,0,0|2,0,0]=4 306 B8R0.22 CCSC(C=O)SCC MCULE-8444076277 [2,0,0,0,0,0|2,0,0]=4 307 B8R0.15 C=CCC(CC)C(=O)O MCULE-8599414655 [2,0,0,0,0,0|0,0,2]=4 308 B8R0.15 CCC(CCN)C(=O)O MCULE-3540595708 [2,0,0,0,0,0|1,0,0]=3 309 B8R0.15 CCC(CCN)C(=O)O MCULE-6369668711 [2,0,0,0,0,0|1,0,0]=3 310 B8R0.15 CCCC(C#N)C(=O)O MCULE-8231205596 [2,0,0,0,0,0|1,0,1]=4 311 B8R0.15 CCCC(CC)C(=O)C MCULE-3483794250 [2,0,0,0,0,0|1,0,0]=3 312 B8R0.15 CCCC(CC)C(=O)O MCULE-2070546888 [2,0,0,0,0,0|0,0,0]=2 313 B8R0.15 CCCC(CO)C(=O)O MCULE-2653026260 [2,0,0,0,0,0|0,0,0]=2 314 B8R0.15 CCCC(NC)C(=O)O MCULE-5292420123 [2,0,0,0,0,0|1,0,0]=3 315 B8R0.15 CCCC(NC)C(=O)O MCULE-5734283547 [2,0,0,0,0,0|1,0,0]=3 316 B8R0.15 CCCC(NC)C(=O)O MCULE-9559460593 [2,0,0,0,0,0|1,0,0]=3 317 B8R0.15 CCCC(NO)C(=O)O MCULE-7484331195 [2,0,0,0,0,0|1,0,0]=3 318 B8R0.15 CCCC(OC)C(=O)O MCULE-6875744280 [2,0,0,0,0,0|1,0,0]=3 319 B8R0.15 CCC[C@@H](NC)C(=O)O MCULE-3394704356 [2,0,0,0,0,0|1,0,0]=3 320 B8R0.15 CCC[C@@H](NC)C(=O)O MCULE-8140893147 [2,0,0,0,0,0|1,0,0]=3 321 B8R0.15 CCC[C@H](CO)C(=O)O MCULE-1805025355 [2,0,0,0,0,0|0,0,0]=2 322 B8R0.15 CCC[C@H](CO)C(=O)O MCULE-3449491143 [2,0,0,0,0,0|0,0,0]=2 323 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-1028689544 [2,0,0,0,0,0|1,0,0]=3 324 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-4848752673 [2,0,0,0,0,0|1,0,0]=3 325 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-5585839502 [2,0,0,0,0,0|1,0,0]=3 326 B8R0.15 CCC[C@H](NO)C(=O)O MCULE-7455558431 [2,0,0,0,0,0|1,0,0]=3 327 B8R0.15 CCOC(CBr)C(=O)O MCULE-5345866284 [2,0,0,0,0,0|2,0,0]=4 328 B8R0.15 CCOC(CC)C(=O)N MCULE-8093014638 [2,0,0,0,0,0|2,0,0]=4 329 B8R0.15 CCOC(CC)C(=O)O MCULE-1674742787 [2,0,0,0,0,0|1,0,0]=3 330 B8R0.15 CNC(CCN)C(=O)O MCULE-6687313255 [2,0,0,0,0,0|2,0,0]=4 331 B8R0.15 CNC(COC)C(=O)O MCULE-4091913769 [2,0,0,0,0,0|2,0,0]=4 332 B8R0.15 CNC(COC)C(=O)O MCULE-6745647660 [2,0,0,0,0,0|2,0,0]=4 333 B8R0.15 CN[C@@H](CCO)C(=O)O MCULE-4209872941 [2,0,0,0,0,0|1,0,0]=3 334 B8R0.15 CN[C@@H](CCO)C(=O)O MCULE-7202916887 [2,0,0,0,0,0|1,0,0]=3 335 B8R0.15 CN[C@H](CCO)C(=O)O MCULE-1874728709 [2,0,0,0,0,0|1,0,0]=3 336 B8R0.15 CN[C@H](CCO)C(=O)O MCULE-3716592032 [2,0,0,0,0,0|1,0,0]=3 337 B8R0.15 COC(CCN)C(=O)O MCULE-1510512790 [2,0,0,0,0,0|2,0,0]=4 338 B8R0.15 COCC(OC)C(=O)O MCULE-5776685365 [2,0,0,0,0,0|2,0,0]=4 339 B8R0.23 C(N)(CC(C)C)C(=O)O MCULE-7664540924 [2,0,0,0,0,0|2,0,0]=4 340 B8R0.23 C=C(C)CC(C)C(=O)O MCULE-7268483710 [2,0,0,0,0,0|1,0,1]=4 341 B8R0.23 C=C(C)C[C@H](C)C(=O)O MCULE-9053114079 [2,0,0,0,0,0|1,0,1]=4 342 B8R0.23 CC(=O)C(C)CC(C)C MCULE-9956513410 [2,0,0,0,0,0|2,0,0]=4 343 B8R0.23 CC(=O)CC(C)C(=O)O MCULE-4640477792 [2,0,0,0,0,0|0,0,2]=4 344 B8R0.23 CC(C)CC(Br)C(=O)O MCULE-2778142655 [2,0,0,0,0,0|2,0,0]=4 345 B8R0.23 CC(C)CC(Br)C(=O)O MCULE-7689846956 [2,0,0,0,0,0|2,0,0]=4 346 B8R0.23 CC(C)CC(C)C(=O)O MCULE-7217536279 [2,0,0,0,0,0|1,0,0]=3 347 B8R0.23 CC(C)CC(Cl)C(=O)O MCULE-6347367806 [2,0,0,0,0,0|2,0,0]=4 348 B8R0.23 CC(C)CC(F)C(=O)O MCULE-6908911956 [2,0,0,0,0,0|2,0,0]=4 349 B8R0.23 CC(C)CC(N)C(=O)O MCULE-2550986320 [2,0,0,0,0,0|2,0,0]=4 350 B8R0.23 CC(C)CC(N)C(=O)O MCULE-7657212416 [2,0,0,0,0,0|2,0,0]=4 351 B8R0.23 CC(C)CC(O)C(=O)O MCULE-3638762911 [2,0,0,0,0,0|2,0,0]=4 352 B8R0.23 CC(C)CC(O)C(=O)O MCULE-4315013875 [2,0,0,0,0,0|2,0,0]=4 353 B8R0.23 CC(C)C[C@@H](Br)C(=O)O MCULE-2325122781 [2,0,0,0,0,0|2,0,0]=4 354 B8R0.23 CC(C)C[C@@H](Cl)C(=O)O MCULE-6797937420 [2,0,0,0,0,0|2,0,0]=4 355 B8R0.23 CC(C)C[C@@H](N)C(=O)O MCULE-3041792060 [2,0,0,0,0,0|2,0,0]=4 356 B8R0.23 CC(C)C[C@@H](N)C(=O)O MCULE-8280206722 [2,0,0,0,0,0|2,0,0]=4 357 B8R0.23 CC(C)C[C@@H](O)C(=O)O MCULE-4108530385 [2,0,0,0,0,0|2,0,0]=4 358 B8R0.23 CC(C)C[C@@H](O)C(=O)O MCULE-5253943571 [2,0,0,0,0,0|2,0,0]=4 359 B8R0.23 CC(C)C[C@H](Br)C(=O)O MCULE-4423121396 [2,0,0,0,0,0|2,0,0]=4 360 B8R0.23 CC(C)C[C@H](Br)C(=O)O MCULE-7601821889 [2,0,0,0,0,0|2,0,0]=4 361 B8R0.23 CC(C)C[C@H](Cl)C(=O)O MCULE-1038344796 [2,0,0,0,0,0|2,0,0]=4 362 B8R0.23 CC(C)C[C@H](Cl)C(=O)O MCULE-9007168250 [2,0,0,0,0,0|2,0,0]=4 363 B8R0.23 CC(C)C[C@H](N)C(=O)O MCULE-4718215038 [2,0,0,0,0,0|2,0,0]=4 364 B8R0.23 CC(C)C[C@H](N)C(=O)O MCULE-4930237913 [2,0,0,0,0,0|2,0,0]=4 365 B8R0.23 CC(C)C[C@H](N)C(=O)O MCULE-8722899457 [2,0,0,0,0,0|2,0,0]=4 366 B8R0.23 CC(C)C[C@H](O)C(=O)O MCULE-1740362996 [2,0,0,0,0,0|2,0,0]=4 367 B8R0.23 CC(C)C[C@H](O)C(=O)O MCULE-4466965907 [2,0,0,0,0,0|2,0,0]=4 368 B8R0.23 CC(C)NC(C)C(=O)O MCULE-1412835872 [2,0,0,0,0,0|2,0,0]=4 369 B8R0.23 CC(C)NC(C)C(=O)O MCULE-5184634957 [2,0,0,0,0,0|2,0,0]=4 370 B8R0.23 CC(C)OC(C)C(=O)O MCULE-6571129429 [2,0,0,0,0,0|2,0,0]=4 371 B8R0.23 CC(C)SC(C)C(=O)O MCULE-1620493707 [2,0,0,0,0,0|2,0,0]=4 372 B8R0.23 CC(CC(=O)O)C(=O)O MCULE-4824634360 [2,0,0,0,0,0|1,0,1]=4 373 B8R0.23 CC(CC(=O)O)C(=O)O MCULE-8116748590 [2,0,0,0,0,0|1,0,1]=4 374 B8R0.23 CC(CC(F)F)C(=O)O MCULE-2211206695 [2,0,0,0,0,0|2,0,0]=4 375 B8R0.23 CC(CN(C)C)C(=O)O MCULE-7139783268 [2,0,0,0,0,0|2,0,0]=4 376 B8R0.23 CC(CN(C)C)C(=O)O MCULE-7716649676 [2,0,0,0,0,0|2,0,0]=4 377 B8R0.23 CC(CS(=O)C)C(=O)O MCULE-4855592077 [2,0,0,0,0,0|1,0,1]=4 378 B8R0.23 C[C@@H](CC(=O)O)C(=O)O MCULE-1711994689 [2,0,0,0,0,0|1,0,1]=4 379 B8R0.23 C[C@@H](CC(=O)O)C(=O)O MCULE-6107805812 [2,0,0,0,0,0|1,0,1]=4 380 B8R0.23 C[C@H](CC(=O)O)C(=O)O MCULE-2738295504 [2,0,0,0,0,0|1,0,1]=4 381 B8R0.23 C[C@H](CC(=O)O)C(=O)O MCULE-4544789339 [2,0,0,0,0,0|1,0,1]=4 382 B8R0.23 C[C@H](Cl)C[C@H](N)C(=O)O MCULE-5195061270 [2,0,0,0,0,0|2,0,0]=4 383 B8R0.23 C[C@H](Cl)C[C@H](N)C(=O)O MCULE-5975065356 [2,0,0,0,0,0|2,0,0]=4 384 B10R0.70 CC(C)CN(C=O)CC(C)C MCULE-4013086029 [1,1,0,0,0,0|2,0,0]=4 385 B10R0.70 CC(O)CN(CC(C)O)N=O MCULE-5370691006 [1,1,0,0,0,0|2,0,0]=4 386 B10R0.87 CCCCC(CC)CC(C)O MCULE-1114030969 [1,1,0,0,0,0|1,0,1]=4 387 B10R0.30 CCCC(C(=O)O)C(=O)OC MCULE-8198154173 [1,1,0,0,0,0|1,0,1]=4 388 B10R0.73 C=CC(=O)N(CCC)CCC MCULE-1899020688 [1,1,0,0,0,0|2,0,0]=4 389 B10R0.73 CCCC(CCC)C(=O)OC MCULE-9182422484 [1,1,0,0,0,0|0,0,0]=2 390 B10R0.73 CCCC(CCC)[C@@H](N)CO MCULE-3408380731 [1,1,0,0,0,0|1,0,1]=4 391 B10R0.73 CCCC(CCC)[C@@H](N)CO MCULE-3475100331 [1,1,0,0,0,0|1,0,1]=4 392 B10R0.73 CCCN(CCC)C(=O)CCl MCULE-8922100571 [1,1,0,0,0,0|2,0,0]=4 393 B10R0.73 CCCN(CCC)C(=O)CN MCULE-8320562692 [1,1,0,0,0,0|2,0,0]=4 394 B10R0.73 CCCN(CCC)C(=O)CN MCULE-8805842533 [1,1,0,0,0,0|2,0,0]=4 395 B10R0.73 CCCN(CCC)C(=O)CO MCULE-9948129265 [1,1,0,0,0,0|1,0,0]=3 396 B10R0.73 COC(=O)C(CCN)CCN MCULE-3230951312 [1,1,0,0,0,0|2,0,0]=4 397 B10R0.73 COC(=O)C(CCN)CCN MCULE-7725875217 [1,1,0,0,0,0|2,0,0]=4 398 B10R0.88 CCCC(CCCO)C(=O)O MCULE-4581279785 [1,1,0,0,0,0|0,0,0]=2 399 B10R0.88 CCCC(CCCO)C(=O)[O-] MCULE-5352096496 [1,1,0,0,0,0|0,0,1]=3 400 B10R0.88 CCCCC(CCC)C(=O)C MCULE-9579571137 [1,1,0,0,0,0|1,0,0]=3 401 B10R0.88 CCCCC(CCC)C(=O)O MCULE-6453713560 [1,1,0,0,0,0|0,0,0]=2 402 B10R0.88 CCCCC(OCC)C(=O)O MCULE-8965525992 [1,1,0,0,0,0|1,0,0]=3 403 B10R0.103 CC(CCN)(CCN)C(=O)O MCULE-3684247171 [1,1,0,0,0,0|2,0,0]=4 404 B10R0.103 CC(CCN)(CCN)C(=O)O MCULE-9327329576 [1,1,0,0,0,0|2,0,0]=4 405 B10R0.103 CCCC(C)(CCC)C(=O)O MCULE-1572608465 [1,1,0,0,0,0|0,0,0]=2 406 B10R0.103 CCCC(N)(CCC)C(=O)O MCULE-3861431976 [1,1,0,0,0,0|0,0,0]=2 407 B10R0.103 CCCC(N)(CCC)C(=O)O MCULE-8407628230 [1,1,0,0,0,0|0,0,0]=2 408 B10R0.103 CCCC(O)(CCC)C(=O)O MCULE-2628616078 [1,1,0,0,0,0|0,0,0]=2 409 B10R0.103 COCC(N)(COC)C(=O)O MCULE-4566255309 [1,1,0,0,0,0|2,0,0]=4 410 B10R0.103 COCC(O)(COC)C(=O)O MCULE-1633041453 [1,1,0,0,0,0|2,0,0]=4 411 B10R0.95 CCC(CC(C)(C)C)C(=O)O MCULE-7241334010 [1,1,0,0,0,0|1,0,0]=3 412 B10R0.95 CCC(CC(F)(F)F)C(=O)O MCULE-9453874078 [1,1,0,0,0,0|2,0,0]=4 413 B10R0.95 CNC(CC(C)(C)C)C(=O)O MCULE-4693699304 [1,1,0,0,0,0|2,0,0]=4 414 B10R0.95 CNC(CC(C)(C)F)C(=O)O MCULE-5096286175 [1,1,0,0,0,0|2,0,0]=4 415 B10R0.119 CC(C)CC(C)(CN)C(=O)O MCULE-4889115578 [1,1,0,0,0,0|2,0,0]=4 416 B10R0.119 CC(C)CC(C)(CN)C(=O)O MCULE-7111781517 [1,1,0,0,0,0|2,0,0]=4 417 B10R0.119 CC(C)CC(N)(CO)C(=O)O MCULE-4659989671 [1,1,0,0,0,0|2,0,0]=4 418 B10R0.119 CCC(C)(CC(=O)O)C(=O)O MCULE-5857208842 [1,1,0,0,0,0|1,0,1]=4 419 B10R0.162 CC(=O)C(CC(C)C)C(=O)O MCULE-5706548618 [1,1,0,0,0,0|1,0,1]=4 420 B10R0.162 CC(C)C(CC(=O)O)C(=O)O MCULE-8647740549 [1,1,0,0,0,0|1,0,1]=4 421 B10R0.162 CC(C)CC(C(=O)O)C(C)C MCULE-4248316159 [1,1,0,0,0,0|1,0,0]=3 422 B10R0.162 CC(C)CC(C(=O)O)N(C)C MCULE-8621033381 [1,1,0,0,0,0|2,0,0]=4 423 B10R0.162 CC(C)C[C@@H](C(=O)O)N(C)C MCULE-1873302176 [1,1,0,0,0,0|2,0,0]=4 424 B10R0.162 CC(C)C[C@@H](C(=O)O)N(C)C MCULE-3984621368 [1,1,0,0,0,0|2,0,0]=4 425 B10R0.162 CC(C)C[C@@H](C(=O)O)N(C)C MCULE-9030900716 [1,1,0,0,0,0|2,0,0]=4 426 B10R0.162 CC(C)C[C@H](C(=O)O)N(C)C MCULE-9275409593 [1,1,0,0,0,0|2,0,0]=4 427 B10R0.162 CC(C)NC(C(=O)O)C(C)C MCULE-3597742159 [1,1,0,0,0,0|2,0,0]=4 428 B10R0.162 CC(C)NC(C(=O)O)C(C)C MCULE-7004359902 [1,1,0,0,0,0|2,0,0]=4 429 B10R0.17 CCCCC(C(=O)O)C(=O)O MCULE-4493343687 [0,1,0,0,1,0|1,0,1]=4 430 B10R0.17 CCCCC(C(=O)O)C(C)C MCULE-9724362832 [0,1,0,0,1,0|1,0,0]=3 431 B10R0.17 CCCCC(C(=O)O)N(C)C MCULE-6841521624 [0,1,0,0,1,0|2,0,0]=4 432 B10R0.17 CCCC[C@H](C(=O)O)N(C)C MCULE-9240540420 [0,1,0,0,1,0|2,0,0]=4 433 B10R0.17 CCCNC(C(=O)O)C(C)C MCULE-3668478974 [0,1,0,0,1,0|1,0,0]=3 434 B10R0.17 CCCNC(C(=O)O)C(C)C MCULE-6730955968 [0,1,0,0,1,0|1,0,0]=3 435 B10R0.17 CSCCC(C(=O)O)N(C)C MCULE-9926404769 [0,1,0,0,1,0|2,0,0]=4 436 B10R0.17 CSCC[C@@H](C(=O)O)N(C)C MCULE-5085715326 [0,1,0,0,1,0|2,0,0]=4 437 B10R0.17 CSCC[C@H](C(=O)O)N(C)C MCULE-7026121281 [0,1,0,0,1,0|2,0,0]=4 438 B10R0.17 NCCCC(C(=O)O)C(=O)O MCULE-4043949471 [0,1,0,0,1,0|1,0,1]=4 439 B10R0.118 CCC(C)C(C(=O)O)N(C)C MCULE-9389725198 [0,1,0,0,1,0|2,0,0]=4 440 B10R0.149 CCCC(C)(C(=O)O)N(C)C MCULE-6567289499 [0,1,0,0,1,0|2,0,0]=4 441 B12R0.41 CC(C)CC(CC(=O)O)CC(=O)O MCULE-7888882967 [0,1,0,0,0,1|1,0,1]=4 442 B12R0.55 O=C(O)CCC(CCCS)C(=O)O MCULE-4196522800 [0,1,0,0,0,1|1,0,1]=4 443 B12R0.55 O=C(O)CC[C@H](CCCS)C(=O)O MCULE-4737028793 [0,1,0,0,0,1|1,0,1]=4 444 B12R0.138 CC(C)CC(CCC(=O)O)C(=O)O MCULE-5689039654 [0,1,0,0,0,1|1,0,1]=4 445 B12R0.400 CCCC(NC(=O)C(C)Br)C(=O)O MCULE-5347231839 [0,1,0,0,0,1|1,0,1]=4 446 B12R0.400 CCCC(NC(=O)C(C)N)C(=O)O MCULE-4668902120 [0,1,0,0,0,1|1,0,1]=4 447 B12R0.403 CCCC(CCC(=O)NO)C(=O)O MCULE-3864916891 [0,1,0,0,0,1|1,0,1]=4 448 B12R0.393 CC(C)(C)CC(CC(=O)O)C(=O)O MCULE-9332320504 [0,2,0,0,0,0|1,0,1]=4 449 B12R0.393 CC(C)CC(CC(F)(F)F)C(=O)O MCULE-9017339993 [0,2,0,0,0,0|2,0,0]=4 450 B12R0.694 CC(C)CC(N)(CC(C)C)C(=O)O MCULE-4201228691 [0,2,0,0,0,0|1,0,0]=3 451 B12R0.253 CCCCC(C(=O)O)C(C)C(=O)O MCULE-8704830895 [0,2,0,0,0,0|1,0,1]=4 452 B12R0.120 C=CCCNC(CC(C)C)C(=O)O MCULE-4113021249 [0,2,0,0,0,0|1,0,1]=4 453 B12R0.120 C=CCCN[C@@H](CC(C)C)C(=O)O MCULE-1070947899 [0,2,0,0,0,0|1,0,1]=4 454 B12R0.120 CCCCNC(CC(C)C)C(=O)O MCULE-8193550563 [0,2,0,0,0,0|1,0,0]=3 455 B12R0.120 CCCCNC(CC(C)C)C(=O)O MCULE-8921683556 [0,2,0,0,0,0|1,0,0]=3 456 B12R0.120 CCCCSC(CC(=O)O)C(=O)O MCULE-8785216159 [0,2,0,0,0,0|1,0,1]=4 457 B10R1.8 CC1CC(CC(C1)C=O)C MCULE-8057927767 [1,0,0,1,0,0|1,0,0]=3 458 B10R1.8 CC1CC(CC(C1)CO)C MCULE-5331575122 [1,0,0,1,0,0|1,0,1]=4 459 B10R1.8 CC1CC(CC(N1)C)CO MCULE-5120639213 [1,0,0,1,0,0|1,0,1]=4 460 B10R1.8 CC1CC(CC(N1)C)CO MCULE-8192770059 [1,0,0,1,0,0|1,0,1]=4 461 B10R1.8 CC1CC(CC(O1)C)C#N MCULE-4948232033 [1,0,0,1,0,0|1,0,1]=4 462 B10R1.8 CC1CC(CC(O1)C)C=O MCULE-6382970154 [1,0,0,1,0,0|0,0,0]=2 463 B10R1.8 CC1CC(CC(O1)C)CN MCULE-1319687929 [1,0,0,1,0,0|1,0,1]=4 464 B10R1.8 CC1CC(CC(O1)C)CO MCULE-2203719785 [1,0,0,1,0,0|0,0,1]=3 465 B10R1.8 CC1CC(CC(O1)C)NN MCULE-6562613875 [1,0,0,1,0,0|2,0,0]=4 466 B10R1.8 CC1CC(CC(O1)C)NN MCULE-9875780953 [1,0,0,1,0,0|2,0,0]=4 467 B10R1.8 CNC1CC(OC(C1)C)C MCULE-7282628972 [1,0,0,1,0,0|2,0,0]=4 468 B10R1.8 C[C@H]1CC(C[C@H](O1)C)CBr MCULE-5205147785 [1,0,0,1,0,0|1,0,1]=4 469 B10R1.8 C[C@H]1CC(C[C@H](O1)C)CO MCULE-8494561530 [1,0,0,1,0,0|0,0,1]=3 470 B10R1.10 CCCC1CCCC(C1)O MCULE-6301598723 [1,0,0,1,0,0|1,0,1]=4 471 B10R1.18 CC(O)CC1CCCCN1 MCULE-5900716273 [1,0,0,1,0,0|2,0,0]=4 472 B10R1.18 CC(O)CC1COCCN1 MCULE-9693602239 [1,0,0,1,0,0|1,0,1]=4 473 B10R1.18 C[C@@H](O)CC1CCCCC1 MCULE-4273662766 [1,0,0,1,0,0|1,0,1]=4 474 B10R1.18 C[C@H](O)CC1CCCCC1 MCULE-7528064890 [1,0,0,1,0,0|1,0,1]=4 475 B10R1.64 CC(C)CC1CCCC1=O MCULE-4871640559 [1,0,0,1,0,0|1,0,0]=3 476 B10R1.64 CC(C)CC1COCC1=O MCULE-8917165045 [1,0,0,1,0,0|2,0,0]=4 477 B10R1.64 CC(N)CN1CCCC1=O MCULE-5095143827 [1,0,0,1,0,0|2,0,0]=4 478 B10R1.64 CC(O)CC1CCNC1=O MCULE-2151582713 [1,0,0,1,0,0|1,0,0]=3 479 B10R1.64 CC(O)CN1CCCC1=O MCULE-1938738117 [1,0,0,1,0,0|1,0,0]=3 480 B10R1.64 CC(O)CN1CCNC1=O MCULE-5335839906 [1,0,0,1,0,0|2,0,0]=4 481 B10R1.64 CN(C)CC1CCCC1=O MCULE-5987666640 [1,0,0,1,0,0|2,0,0]=4 482 B10R1.64 CN(C)CC1CCCC1=O MCULE-9641760477 [1,0,0,1,0,0|2,0,0]=4 483 B10R1.64 C[C@H](N)CN1CCCC1=O MCULE-1860315177 [1,0,0,1,0,0|2,0,0]=4 484 B10R1.64 C[C@H](N)CN1CCCC1=O MCULE-2817634784 [1,0,0,1,0,0|2,0,0]=4 485 B10R1.64 C[C@H](N)CN1CCCC1=O MCULE-4282969334 [1,0,0,1,0,0|2,0,0]=4 486 B10R1.64 C[C@H](N)CN1CCCC1=O MCULE-4689124690 [1,0,0,1,0,0|2,0,0]=4 487 B10R1.64 O=C(O)CC1CCCC1=O MCULE-9371811615 [1,0,0,1,0,0|1,0,1]=4 488 B10R1.130 CCCN1CC(CC1=O)N MCULE-1814384667 [1,0,0,1,0,0|2,0,0]=4 489 B10R1.130 CCCN1CC(CC1=O)N MCULE-3769290383 [1,0,0,1,0,0|2,0,0]=4 490 B10R1.130 CCCN1C[C@H](CC1=O)O MCULE-6013783989 [1,0,0,1,0,0|1,0,0]=3 491 B10R1.171 CC1(CC(CCO1)C=O)C MCULE-7681885506 [1,0,0,1,0,0|2,0,0]=4 492 B10R1.171 CC1(CCCC(C1)C=O)C MCULE-2204954553 [1,0,0,1,0,0|1,0,0]=3 493 B10R1.171 CC1(CCCC(C1)CO)C MCULE-8689403766 [1,0,0,1,0,0|1,0,1]=4 494 B10R1.171 CC1(C[C@H](CCO1)C=O)C MCULE-3961352621 [1,0,0,1,0,0|2,0,0]=4 495 B10R1.171 O=CC1CCCC(C1)(F)F MCULE-9271394081 [1,0,0,1,0,0|2,0,0]=4 496 B10R1.4 C=CCC1CCCOC1=O MCULE-4559726552 [1,0,0,1,0,0|0,0,2]=4 497 B10R1.4 CCCC1CCCCC1=O MCULE-3320705054 [1,0,0,1,0,0|1,0,0]=3 498 B10R1.4 CCCC1CCCCC1O MCULE-7446006713 [1,0,0,1,0,0|1,0,1]=4 499 B10R1.4 CCCC1NCCNC1=O MCULE-9907026950 [1,0,0,1,0,0|2,0,0]=4 500 B10R1.4 CCOC1CCCCC1=O MCULE-9251299042 [1,0,0,1,0,0|2,0,0]=4 501 B10R1.4 NCCN1CCCOC1=O MCULE-4521838716 [1,0,0,1,0,0|2,0,0]=4 502 B10R1.4 NCCN1CCCOC1=O MCULE-9880721224 [1,0,0,1,0,0|2,0,0]=4 503 B10R1.4 O=C1CCCCN1CCO MCULE-2557885455 [1,0,0,1,0,0|2,0,0]=4 504 B10R1.4 O=C1NCCCC1CCO MCULE-7839494483 [1,0,0,1,0,0|1,0,0]=3 505 B10R1.4 O=C1NCCNC1CCO MCULE-4480568908 [1,0,0,1,0,0|2,0,0]=4 506 B10R1.58 N[C@@H]1C[C@@H](C[C@H]1O)C(=O)O MCULE-2019095795 [1,0,0,1,0,0|1,0,0]=3 507 B10R1.58 N[C@@H]1C[C@@H](C[C@H]1O)C(=O)O MCULE-7012514700 [1,0,0,1,0,0|1,0,0]=3 508 B10R1.58 O=C(O)C1CC(C(C1)Br)Br MCULE-6168529373 [1,0,0,1,0,0|2,0,0]=4 509 B10R1.113 CC(=O)C1CCCN(C1)C MCULE-4171786992 [1,0,0,1,0,0|2,0,0]=4 510 B10R1.113 CC(=O)C1CCCN(C1)C MCULE-6409364695 [1,0,0,1,0,0|2,0,0]=4 511 B10R1.113 CC(=O)N1CCCC(C1)C MCULE-5497136448 [1,0,0,1,0,0|2,0,0]=4 512 B10R1.113 CC(=O)N1CCCC(C1)O MCULE-4557043332 [1,0,0,1,0,0|2,0,0]=4 513 B10R1.113 CC(=O)N1CCC[C@@H](C1)O MCULE-1777848146 [1,0,0,1,0,0|2,0,0]=4 514 B10R1.113 CC(=O)N1CCC[C@@H](C1)O MCULE-5198604448 [1,0,0,1,0,0|2,0,0]=4 515 B10R1.113 CC(=O)N1CCC[C@H](C1)O MCULE-4329362874 [1,0,0,1,0,0|2,0,0]=4 516 B10R1.113 CC(=O)N1CCC[C@H](C1)O MCULE-8344466566 [1,0,0,1,0,0|2,0,0]=4 517 B10R1.113 CC1=CCCC(C1)C(=O)O MCULE-1528958679 [1,0,0,1,0,0|0,0,2]=4 518 B10R1.113 CC1CC(CCN1)C(=O)O MCULE-7720743223 [1,0,0,1,0,0|1,0,0]=3 519 B10R1.113 CC1CC(CCN1)C(=O)O MCULE-8584436669 [1,0,0,1,0,0|1,0,0]=3 520 B10R1.113 CC1CC(CCO1)C(=O)O MCULE-8051149188 [1,0,0,1,0,0|0,0,0]=2 521 B10R1.113 CC1CCCC(C1)C(=O)O MCULE-1709216331 [1,0,0,1,0,0|0,0,0]=2 522 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-2752928027 [1,0,0,1,0,0|1,0,0]=3 523 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-7361502591 [1,0,0,1,0,0|1,0,0]=3 524 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-7906995060 [1,0,0,1,0,0|1,0,0]=3 525 B10R1.113 CC1CCCC(O1)C(=O)O MCULE-2545962496 [1,0,0,1,0,0|1,0,0]=3 526 B10R1.113 CC1CCCN(C1)C(=O)Cl MCULE-9803843077 [1,0,0,1,0,0|2,0,0]=4 527 B10R1.113 CC1CCNC(C1)C(=O)N MCULE-8372541866 [1,0,0,1,0,0|2,0,0]=4 528 B10R1.113 CC1CCNC(C1)C(=O)O MCULE-7170086856 [1,0,0,1,0,0|1,0,0]=3 529 B10R1.113 CC1CNCC(C1)C(=O)O MCULE-6208683659 [1,0,0,1,0,0|1,0,0]=3 530 B10R1.113 CC1CNCC(O1)C(=O)O MCULE-4851002529 [1,0,0,1,0,0|2,0,0]=4 531 B10R1.113 CC1COCC(N1)C(=O)O MCULE-6739051094 [1,0,0,1,0,0|2,0,0]=4 532 B10R1.113 CN1CCCC(C1)C(=O)Cl MCULE-2256974113 [1,0,0,1,0,0|2,0,0]=4 533 B10R1.113 CN1CCCC(C1)C(=O)Cl MCULE-6072454792 [1,0,0,1,0,0|2,0,0]=4 534 B10R1.113 CN1CCCC(C1)C(=O)N MCULE-2482020070 [1,0,0,1,0,0|2,0,0]=4 535 B10R1.113 CN1CCCC(C1)C(=O)O MCULE-2577677138 [1,0,0,1,0,0|1,0,0]=3 536 B10R1.113 CN1CCCC(C1)C(=O)O MCULE-9093982856 [1,0,0,1,0,0|1,0,0]=3 537 B10R1.113 CN1CCC[C@@H](C1)C(=O)O MCULE-3472059995 [1,0,0,1,0,0|1,0,0]=3 538 B10R1.113 CN1CCC[C@@H](C1)C(=O)O MCULE-3661518240 [1,0,0,1,0,0|1,0,0]=3 539 B10R1.113 CN1CCC[C@@H](C1)C(=O)O MCULE-4244061094 [1,0,0,1,0,0|1,0,0]=3 540 B10R1.113 CN1CCC[C@H](C1)C(=O)O MCULE-1368409828 [1,0,0,1,0,0|1,0,0]=3 541 B10R1.113 CN1CCC[C@H](C1)C(=O)O MCULE-2079226353 [1,0,0,1,0,0|1,0,0]=3 542 B10R1.113 CN1CCNC(C1)C(=O)O MCULE-2247528725 [1,0,0,1,0,0|2,0,0]=4 543 B10R1.113 CN1CCNC(C1)C(=O)O MCULE-9094338983 [1,0,0,1,0,0|2,0,0]=4 544 B10R1.113 CN1CCN[C@@H](C1)C(=O)O MCULE-5238925665 [1,0,0,1,0,0|2,0,0]=4 545 B10R1.113 CN1CCN[C@@H](C1)C(=O)O MCULE-6341643779 [1,0,0,1,0,0|2,0,0]=4 546 B10R1.113 CN1CCN[C@H](C1)C(=O)O MCULE-1518073789 [1,0,0,1,0,0|2,0,0]=4 547 B10R1.113 CN1CCN[C@H](C1)C(=O)O MCULE-8312508233 [1,0,0,1,0,0|2,0,0]=4 548 B10R1.113 CN1CCOC(C1)C(=O)O MCULE-5046751827 [1,0,0,1,0,0|2,0,0]=4 549 B10R1.113 CN1CCOC(C1)C(=O)O MCULE-8819512874 [1,0,0,1,0,0|2,0,0]=4 550 B10R1.113 CS(=O)C1CCCC(C1)O MCULE-2451665084 [1,0,0,1,0,0|2,0,0]=4 551 B10R1.113 C[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-4534640450 [1,0,0,1,0,0|0,0,0]=2 552 B10R1.113 C[C@@H]1CCC[C@@H](N1)C(=O)O MCULE-6827473516 [1,0,0,1,0,0|1,0,0]=3 553 B10R1.113 C[C@@H]1CCC[C@@H](N1)C(=O)O MCULE-6916060172 [1,0,0,1,0,0|1,0,0]=3 554 B10R1.113 C[C@@H]1CCC[C@H](C1)C(=O)O MCULE-2658835025 [1,0,0,1,0,0|0,0,0]=2 555 B10R1.113 C[C@@H]1CCN[C@@H](C1)C(=O)O MCULE-6382189211 [1,0,0,1,0,0|1,0,0]=3 556 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-3220705725 [1,0,0,1,0,0|1,0,0]=3 557 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-4368703620 [1,0,0,1,0,0|1,0,0]=3 558 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-5852226290 [1,0,0,1,0,0|1,0,0]=3 559 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-8448888283 [1,0,0,1,0,0|1,0,0]=3 560 B10R1.113 C[C@@H]1CNC[C@@H](C1)C(=O)O MCULE-6787897599 [1,0,0,1,0,0|1,0,0]=3 561 B10R1.113 C[C@@H]1CNC[C@@H](C1)C(=O)O MCULE-7011808441 [1,0,0,1,0,0|1,0,0]=3 562 B10R1.113 C[C@@H]1CNC[C@@H](O1)C(=O)O MCULE-1640808929 [1,0,0,1,0,0|2,0,0]=4 563 B10R1.113 C[C@@H]1CNC[C@@H](O1)C(=O)O MCULE-5152957457 [1,0,0,1,0,0|2,0,0]=4 564 B10R1.113 C[C@@H]1CNC[C@H](C1)C(=O)O MCULE-8762702780 [1,0,0,1,0,0|1,0,0]=3 565 B10R1.113 C[C@@H]1C[C@@H](CCN1)C(=O)O MCULE-6500795104 [1,0,0,1,0,0|1,0,0]=3 566 B10R1.113 C[C@@H]1C[C@@H](CCN1)C(=O)O MCULE-9135304432 [1,0,0,1,0,0|1,0,0]=3 567 B10R1.113 C[C@H]1CCC[C@@H](C1)C(=O)O MCULE-2151963828 [1,0,0,1,0,0|0,0,0]=2 568 B10R1.113 C[C@H]1CCC[C@H](C1)C(=O)O MCULE-9191189376 [1,0,0,1,0,0|0,0,0]=2 569 B10R1.113 C[C@H]1CCN[C@@H](C1)C(=O)O MCULE-3797871093 [1,0,0,1,0,0|1,0,0]=3 570 B10R1.113 C[C@H]1CCN[C@@H](C1)C(=O)O MCULE-3813657182 [1,0,0,1,0,0|1,0,0]=3 571 B10R1.113 C[C@H]1CCN[C@H](C1)C(=O)O MCULE-8048617173 [1,0,0,1,0,0|1,0,0]=3 572 B10R1.113 C[C@H]1CNC[C@@H](C1)C(=O)O MCULE-9182357479 [1,0,0,1,0,0|1,0,0]=3 573 B10R1.113 C[C@H]1CNC[C@H](C1)C(=O)O MCULE-7208949681 [1,0,0,1,0,0|1,0,0]=3 574 B10R1.113 C[C@H]1C[C@H](CCN1)C(=O)O MCULE-3777490064 [1,0,0,1,0,0|1,0,0]=3 575 B10R1.113 C[C@H]1C[C@H](CCN1)C(=O)O MCULE-7587755997 [1,0,0,1,0,0|1,0,0]=3 576 B10R1.113 NC(=O)C1CCCC(C1)N MCULE-5887465193 [1,0,0,1,0,0|2,0,0]=4 577 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-1352569589 [1,0,0,1,0,0|2,0,0]=4 578 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-3084012877 [1,0,0,1,0,0|2,0,0]=4 579 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-3571668618 [1,0,0,1,0,0|2,0,0]=4 580 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-3930179934 [1,0,0,1,0,0|2,0,0]=4 581 B10R1.113 NC1CCCC(C1)C(=O)O MCULE-1721377644 [1,0,0,1,0,0|1,0,0]=3 582 B10R1.113 NC1CCCC(C1)C(=O)O MCULE-3598251126 [1,0,0,1,0,0|1,0,0]=3 583 B10R1.113 NC1CCOC(C1)C(=O)O MCULE-7071803947 [1,0,0,1,0,0|2,0,0]=4 584 B10R1.113 NC1CCOC(C1)C(=O)O MCULE-7129710557 [1,0,0,1,0,0|2,0,0]=4 585 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-5563204448 [1,0,0,1,0,0|1,0,0]=3 586 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-5798146682 [1,0,0,1,0,0|1,0,0]=3 587 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-8105249419 [1,0,0,1,0,0|1,0,0]=3 588 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-9161171059 [1,0,0,1,0,0|1,0,0]=3 589 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-2713838733 [1,0,0,1,0,0|1,0,0]=3 590 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-2810146308 [1,0,0,1,0,0|1,0,0]=3 591 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-3141762073 [1,0,0,1,0,0|1,0,0]=3 592 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-6970045085 [1,0,0,1,0,0|1,0,0]=3 593 B10R1.113 N[C@@H]1CCO[C@H](C1)C(=O)O MCULE-5264166397 [1,0,0,1,0,0|2,0,0]=4 594 B10R1.113 N[C@@H]1CCO[C@H](C1)C(=O)O MCULE-6153195788 [1,0,0,1,0,0|2,0,0]=4 595 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-3283868687 [1,0,0,1,0,0|1,0,0]=3 596 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-5009823003 [1,0,0,1,0,0|1,0,0]=3 597 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-6716939610 [1,0,0,1,0,0|1,0,0]=3 598 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-8264766500 [1,0,0,1,0,0|1,0,0]=3 599 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-1016300044 [1,0,0,1,0,0|1,0,0]=3 600 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-2730367375 [1,0,0,1,0,0|1,0,0]=3 601 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-3326410223 [1,0,0,1,0,0|1,0,0]=3 602 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-3370817462 [1,0,0,1,0,0|1,0,0]=3 603 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-3467671648 [1,0,0,1,0,0|1,0,0]=3 604 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-7929171022 [1,0,0,1,0,0|1,0,0]=3 605 B10R1.113 O=C(O)C1=CC(CCC1)O MCULE-3053514968 [1,0,0,1,0,0|0,0,2]=4 606 B10R1.113 O=C(O)C1CC(CCN1)O MCULE-2758341308 [1,0,0,1,0,0|1,0,0]=3 607 B10R1.113 O=C(O)C1CC(CCN1)O MCULE-7585455422 [1,0,0,1,0,0|1,0,0]=3 608 B10R1.113 O=C(O)C1CCCC(C1)F MCULE-2589850350 [1,0,0,1,0,0|1,0,0]=3 609 B10R1.113 O=C(O)C1CCCC(C1)O MCULE-9068909742 [1,0,0,1,0,0|0,0,0]=2 610 B10R1.113 O=C(O)C1CNCC(C1)O MCULE-1307689360 [1,0,0,1,0,0|1,0,0]=3 611 B10R1.113 O=C(O)C1CNCC(C1)O MCULE-6671293935 [1,0,0,1,0,0|1,0,0]=3 612 B10R1.113 O=C(O)[C@@H]1CC=C[C@@H](C1)O MCULE-3205925226 [1,0,0,1,0,0|0,0,2]=4 613 B10R1.113 O=C(O)[C@@H]1CCC[C@@H](C1)O MCULE-1509835362 [1,0,0,1,0,0|0,0,0]=2 614 B10R1.113 O=C(O)[C@@H]1CCC[C@@H](C1)O MCULE-2282540668 [1,0,0,1,0,0|0,0,0]=2 615 B10R1.113 O=C(O)[C@@H]1CCC[C@H](C1)O MCULE-2678948022 [1,0,0,1,0,0|0,0,0]=2 616 B10R1.113 O=C(O)[C@@H]1CCC[C@H](C1)O MCULE-6048774329 [1,0,0,1,0,0|0,0,0]=2 617 B10R1.113 O=C(O)[C@@H]1C[C@@H](CCN1)O MCULE-1390000123 [1,0,0,1,0,0|1,0,0]=3 618 B10R1.113 O=C(O)[C@@H]1C[C@@H](CCN1)O MCULE-5873942206 [1,0,0,1,0,0|1,0,0]=3 619 B10R1.113 O=C(O)[C@@H]1C[C@H](CCN1)O MCULE-5317131791 [1,0,0,1,0,0|1,0,0]=3 620 B10R1.113 O=C(O)[C@H]1CCC[C@@H](C1)O MCULE-1308626340 [1,0,0,1,0,0|0,0,0]=2 621 B10R1.113 O=C(O)[C@H]1CCC[C@@H](C1)O MCULE-5789638591 [1,0,0,1,0,0|0,0,0]=2 622 B10R1.113 O=C(O)[C@H]1CCC[C@H](C1)O MCULE-3370494896 [1,0,0,1,0,0|0,0,0]=2 623 B10R1.113 O=C(O)[C@H]1CCC[C@H](C1)O MCULE-3728932412 [1,0,0,1,0,0|0,0,0]=2 624 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-1474484031 [1,0,0,1,0,0|1,0,0]=3 625 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-1820373402 [1,0,0,1,0,0|1,0,0]=3 626 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-4771226737 [1,0,0,1,0,0|1,0,0]=3 627 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-4907773186 [1,0,0,1,0,0|1,0,0]=3 628 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-8175624129 [1,0,0,1,0,0|1,0,0]=3 629 B10R1.113 O=C(O)[C@H]1C[C@H](CCN1)O MCULE-4751772547 [1,0,0,1,0,0|1,0,0]=3 630 B10R1.113 O=C(O)[C@H]1C[C@H](CCN1)O MCULE-6686826243 [1,0,0,1,0,0|1,0,0]=3 631 B10R1.113 O=C1CCCC(C1)C(=O)O MCULE-6286773194 [1,0,0,1,0,0|0,0,2]=4 632 B10R1.113 O=C1CCC[C@@H](C1)C(=O)O MCULE-5396925186 [1,0,0,1,0,0|0,0,2]=4 633 B10R1.113 O=C1CCC[C@H](C1)C(=O)O MCULE-8936667281 [1,0,0,1,0,0|0,0,2]=4 634 B10R1.113 [C@@H]1(CCCC(N1)C)C(=O)O MCULE-7930307305 [1,0,0,1,0,0|1,0,0]=3 635 B10R1.113 [C@H]1(CCCN(C1)C)C(=O)O MCULE-4364645223 [1,0,0,1,0,0|1,0,0]=3 636 B10R1.113 [C@H]1(CCC[C@H](C1)C(=O)O)N MCULE-2539251802 [1,0,0,1,0,0|1,0,0]=3 637 B10R1.113 [C@H]1(CCC[C@H](C1)C(=O)O)N MCULE-4407634771 [1,0,0,1,0,0|1,0,0]=3 638 B10R1.290 CCOC(C(=O)O)C1CC1 MCULE-4609509575 [1,0,0,1,0,0|1,0,0]=3 639 B10R1.348 CC(=O)C1CCCCCC1 MCULE-9324503120 [1,0,0,1,0,0|1,0,0]=3 640 B10R1.348 CC(=O)N1CCCCCC1 MCULE-4232660324 [1,0,0,1,0,0|2,0,0]=4 641 B10R1.348 CC(O)C1CCCCCC1 MCULE-6112396200 [1,0,0,1,0,0|1,0,1]=4 642 B10R1.348 C[C@@H](O)C1CCCCCC1 MCULE-7903519728 [1,0,0,1,0,0|1,0,1]=4 643 B10R1.348 C[C@H](O)C1CCCCCC1 MCULE-5041888426 [1,0,0,1,0,0|1,0,1]=4 644 B10R1.348 N=C(N)C1CCCCCC1 MCULE-2361950713 [1,0,0,1,0,0|2,0,0]=4 645 B10R1.348 N=C(N)C1CCCCCC1 MCULE-8756683037 [1,0,0,1,0,0|2,0,0]=4 646 B10R1.348 NC(=O)C1CCCCCC1 MCULE-2005648941 [1,0,0,1,0,0|1,0,0]=3 647 B10R1.348 NC(=O)C1CCCCNC1 MCULE-6748059498 [1,0,0,1,0,0|2,0,0]=4 648 B10R1.348 NC(=O)C1CCCCNC1 MCULE-8697140088 [1,0,0,1,0,0|2,0,0]=4 649 B10R1.348 NC(=O)N1CCCCCC1 MCULE-6181473782 [1,0,0,1,0,0|2,0,0]=4 650 B10R1.348 O=C(Cl)C1CCCCCC1 MCULE-4659434885 [1,0,0,1,0,0|1,0,0]=3 651 B10R1.348 O=C(Cl)N1CCCCCC1 MCULE-3861437886 [1,0,0,1,0,0|2,0,0]=4 652 B10R1.348 O=C(O)C1=CCCCCC1 MCULE-5438079704 [1,0,0,1,0,0|0,0,2]=4 653 B10R1.348 O=C(O)C1=CCCOCC1 MCULE-6315041103 [1,0,0,1,0,0|0,0,2]=4 654 B10R1.348 O=C(O)C1CCC=CCC1 MCULE-6767000432 [1,0,0,1,0,0|0,0,2]=4 655 B10R1.348 O=C(O)C1CCCCCC1 MCULE-7903672891 [1,0,0,1,0,0|0,0,0]=2 656 B10R1.348 O=C(O)C1CCCCCN1 MCULE-2741684183 [1,0,0,1,0,0|1,0,0]=3 657 B10R1.348 O=C(O)C1CCCCCN1 MCULE-7374703751 [1,0,0,1,0,0|1,0,0]=3 658 B10R1.348 O=C(O)C1CCCCNC1 MCULE-3392190626 [1,0,0,1,0,0|1,0,0]=3 659 B10R1.348 O=C(O)C1CCCCNC1 MCULE-7795043703 [1,0,0,1,0,0|1,0,0]=3 660 B10R1.348 O=C(O)C1CCCNCC1 MCULE-7690110773 [1,0,0,1,0,0|1,0,0]=3 661 B10R1.348 O=C(O)C1CCCNCC1 MCULE-9766781803 [1,0,0,1,0,0|1,0,0]=3 662 B10R1.348 O=C(O)C1CCCOCC1 MCULE-9318516869 [1,0,0,1,0,0|0,0,0]=2 663 B10R1.348 O=C(O)C1CNCCCN1 MCULE-3558230210 [1,0,0,1,0,0|2,0,0]=4 664 B10R1.348 O=C(O)C1CNCCCN1 MCULE-6835715048 [1,0,0,1,0,0|2,0,0]=4 665 B10R1.348 O=C(O)C1CNCCCO1 MCULE-2282415374 [1,0,0,1,0,0|2,0,0]=4 666 B10R1.348 O=C(O)C1CNCCCO1 MCULE-3064687044 [1,0,0,1,0,0|2,0,0]=4 667 B10R1.348 O=C(O)C1COCCOC1 MCULE-7686530449 [1,0,0,1,0,0|2,0,0]=4 668 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-2016813857 [1,0,0,1,0,0|1,0,0]=3 669 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-2504826586 [1,0,0,1,0,0|1,0,0]=3 670 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-4939523441 [1,0,0,1,0,0|1,0,0]=3 671 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-8497154031 [1,0,0,1,0,0|1,0,0]=3 672 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-1709248067 [1,0,0,1,0,0|1,0,0]=3 673 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-4607599990 [1,0,0,1,0,0|1,0,0]=3 674 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-4947785395 [1,0,0,1,0,0|1,0,0]=3 675 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-8502245212 [1,0,0,1,0,0|1,0,0]=3 676 B10R1.348 O=C(O)[C@H]1CCCNCC1 MCULE-2658567129 [1,0,0,1,0,0|1,0,0]=3 677 B10R1.381 C=CCC1(CCC1)C(=O)O MCULE-4876623874 [1,0,0,1,0,0|0,0,2]=4 678 B10R1.381 CCCC1(CCC1)C(=O)O MCULE-8526884552 [1,0,0,1,0,0|0,0,0]=2 679 B10R1.381 CCOC1(CCC1)C(=O)O MCULE-7740928333 [1,0,0,1,0,0|1,0,0]=3 680 B10R1.381 CCOC1(CNC1)C(=O)O MCULE-4696253234 [1,0,0,1,0,0|2,0,0]=4 681 B10R1.381 CCOC1(CNC1)C(=O)O MCULE-7655133096 [1,0,0,1,0,0|2,0,0]=4 682 B10R1.381 COCC1(CCC1)C(=O)O MCULE-8526778585 [1,0,0,1,0,0|1,0,0]=3 683 B10R1.381 N#CCC1(CCC1)C(=O)O MCULE-1795898166 [1,0,0,1,0,0|1,0,1]=4 684 B10R1.381 NCCC1(CCC1)C(=O)O MCULE-2668268208 [1,0,0,1,0,0|1,0,0]=3 685 B10R1.381 NCCC1(CCC1)C(=O)O MCULE-4514960092 [1,0,0,1,0,0|1,0,0]=3 686 B10R1.381 O=C(O)C1(CCC1)CCF MCULE-9718996460 [1,0,0,1,0,0|1,0,0]=3 687 B10R1.30 CCC1CC(CCC1=O)C MCULE-9407073298 [1,0,0,1,0,0|2,0,0]=4 688 B10R1.30 CCN1CC(CNC1=O)O MCULE-6464229406 [1,0,0,1,0,0|2,0,0]=4 689 B10R1.33 CNC1CC(OC1=O)(C)C MCULE-1786341770 [1,0,0,1,0,0|2,0,0]=4 690 B10R1.33 CNC1CC(OC1=O)(C)C MCULE-2918613657 [1,0,0,1,0,0|2,0,0]=4 691 B10R1.59 CC1CC(C(=O)O1)C(=O)O MCULE-5538965549 [1,0,0,1,0,0|1,0,1]=4 692 B10R1.59 CC1CC(C(O1)C(=O)O)C MCULE-6609295709 [1,0,0,1,0,0|2,0,0]=4 693 B10R1.59 CC1CC(C(O1)C)C(=O)O MCULE-4495071251 [1,0,0,1,0,0|0,0,0]=2 694 B10R1.59 CC1CC(N(C1)C)C(=O)O MCULE-1544526499 [1,0,0,1,0,0|2,0,0]=4 695 B10R1.59 CC1CC(N(C1)C)C(=O)O MCULE-4035906246 [1,0,0,1,0,0|2,0,0]=4 696 B10R1.59 CN1CC(CC1C(=O)O)N MCULE-7362090633 [1,0,0,1,0,0|2,0,0]=4 697 B10R1.59 CN1CC(CC1C(=O)O)O MCULE-6963505872 [1,0,0,1,0,0|1,0,0]=3 698 B10R1.59 CN1C[C@@H](C[C@@H]1C(=O)O)O MCULE-7645006550 [1,0,0,1,0,0|1,0,0]=3 699 B10R1.59 CN1C[C@@H](C[C@H]1C(=O)O)F MCULE-1701571164 [1,0,0,1,0,0|2,0,0]=4 700 B10R1.59 CN1C[C@@H](C[C@H]1C(=O)O)F MCULE-3801669792 [1,0,0,1,0,0|2,0,0]=4 701 B10R1.59 CN1C[C@@H](C[C@H]1C(=O)O)O MCULE-4289101461 [1,0,0,1,0,0|1,0,0]=3 702 B10R1.59 CN1C[C@@H](C[C@H]1C(=O)O)O MCULE-5652344615 [1,0,0,1,0,0|1,0,0]=3 703 B10R1.59 CN1C[C@H](C[C@@H]1C(=O)O)O MCULE-4231676044 [1,0,0,1,0,0|1,0,0]=3 704 B10R1.59 CN1C[C@H](C[C@H]1C(=O)O)N MCULE-7565756526 [1,0,0,1,0,0|2,0,0]=4 705 B10R1.59 CN1C[C@H](C[C@H]1C(=O)O)N MCULE-8931908939 [1,0,0,1,0,0|2,0,0]=4 706 B10R1.59 CN1C[C@H](C[C@H]1C(=O)O)O MCULE-2551559641 [1,0,0,1,0,0|1,0,0]=3 707 B10R1.59 CN1C[C@H](C[C@H]1C(=O)O)O MCULE-4981449681 [1,0,0,1,0,0|1,0,0]=3 708 B10R1.59 C[C@@H]1C[C@H](N(C1)C)C(=O)O MCULE-3249388528 [1,0,0,1,0,0|2,0,0]=4 709 B10R1.59 C[C@@H]1C[C@H](N(C1)C)C(=O)O MCULE-5892295670 [1,0,0,1,0,0|2,0,0]=4 710 B10R1.59 C[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-1379494499 [1,0,0,1,0,0|2,0,0]=4 711 B10R1.59 C[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-1502363575 [1,0,0,1,0,0|2,0,0]=4 712 B10R1.59 C[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-1565262465 [1,0,0,1,0,0|2,0,0]=4 713 B10R1.59 C[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-4515635703 [1,0,0,1,0,0|2,0,0]=4 714 B10R1.59 [C@H]1(C[C@H](CN1C)C)C(=O)O MCULE-6457651208 [1,0,0,1,0,0|2,0,0]=4 715 B10R1.234 O=C(O)C1(CC(C1)O)CO MCULE-2858031975 [1,0,0,1,0,0|1,0,0]=3 716 B10R1.242 CC1(CC1(CN)C(=O)O)C MCULE-6453482430 [1,0,0,1,0,0|2,0,0]=4 717 B10R1.242 CCC1(CC1(F)F)C(=O)O MCULE-5814762349 [1,0,0,1,0,0|2,0,0]=4 718 B10R1.282 CC1C(C1C(=O)O)C(=O)O MCULE-6282240195 [1,0,0,1,0,0|1,0,1]=4 719 B10R1.359 CC(=O)N1CCC(C1)(C)O MCULE-8587632489 [1,0,0,1,0,0|2,0,0]=4 720 B10R1.359 CC1(CC(CO1)C(=O)O)C MCULE-2939144976 [1,0,0,1,0,0|2,0,0]=4 721 B10R1.359 CC1(CCC(C1)C(=O)O)C MCULE-9978136872 [1,0,0,1,0,0|1,0,0]=3 722 B10R1.359 CC1(CCC(N1)C(=O)O)C MCULE-5310172848 [1,0,0,1,0,0|2,0,0]=4 723 B10R1.359 CC1(CCC(N1)C(=O)O)C MCULE-5921965282 [1,0,0,1,0,0|2,0,0]=4 724 B10R1.359 CC1(CCC(O1)C(=O)O)C MCULE-6347581531 [1,0,0,1,0,0|2,0,0]=4 725 B10R1.359 CC1(CNC(C1)C(=O)O)C MCULE-3559457457 [1,0,0,1,0,0|2,0,0]=4 726 B10R1.359 CC1(CNC(C1)C(=O)O)C MCULE-4286050645 [1,0,0,1,0,0|2,0,0]=4 727 B10R1.359 CC1(CN[C@@H](C1)C(=O)O)C MCULE-2704032687 [1,0,0,1,0,0|2,0,0]=4 728 B10R1.359 CC1(CN[C@@H](C1)C(=O)O)C MCULE-3701263335 [1,0,0,1,0,0|2,0,0]=4 729 B10R1.359 CC1(CN[C@@H](C1)C(=O)O)C MCULE-5777695775 [1,0,0,1,0,0|2,0,0]=4 730 B10R1.359 CC1(CN[C@@H](C1)C(=O)O)C MCULE-7930268339 [1,0,0,1,0,0|2,0,0]=4 731 B10R1.359 CC1(CN[C@H](C1)C(=O)O)C MCULE-5601172836 [1,0,0,1,0,0|2,0,0]=4 732 B10R1.359 CC1(CN[C@H](C1)C(=O)O)C MCULE-5795533452 [1,0,0,1,0,0|2,0,0]=4 733 B10R1.359 CC1(CN[C@H](C1)C(=O)O)C MCULE-6871769907 [1,0,0,1,0,0|2,0,0]=4 734 B10R1.359 CC1(COC(C1)C(=O)O)C MCULE-3465757314 [1,0,0,1,0,0|2,0,0]=4 735 B10R1.359 O=C(O)C1CCC(C1)(F)F MCULE-3866141496 [1,0,0,1,0,0|2,0,0]=4 736 B10R1.359 O=C(O)C1CCC(C1)(F)F MCULE-9447411120 [1,0,0,1,0,0|2,0,0]=4 737 B10R1.359 O=C(O)[C@@H]1CCC(C1)(F)F MCULE-1982062527 [1,0,0,1,0,0|2,0,0]=4 738 B10R1.359 O=C(O)[C@@H]1CCC(C1)(F)F MCULE-8436417104 [1,0,0,1,0,0|2,0,0]=4 739 B10R1.359 O=C(O)[C@H]1CCC(C1)(F)F MCULE-1884661502 [1,0,0,1,0,0|2,0,0]=4 740 B10R1.359 O=C(O)[C@H]1CCC(C1)(F)F MCULE-4373169739 [1,0,0,1,0,0|2,0,0]=4 741 B10R1.361 C1(CCN1C(C)C)C(=O)O MCULE-2301490448 [1,0,0,1,0,0|2,0,0]=4 742 B10R1.361 CC(C)N1CCC1C(=O)O MCULE-3327703206 [1,0,0,1,0,0|2,0,0]=4 743 B10R1.361 CC(C)N1CC[C@H]1C(=O)O MCULE-1726046033 [1,0,0,1,0,0|2,0,0]=4 744 B10R1.361 CC(C)N1CC[C@H]1C(=O)O MCULE-3879944736 [1,0,0,1,0,0|2,0,0]=4 745 B10R1.361 O=C(O)C1CCC1C(=O)O MCULE-6136792366 [1,0,0,1,0,0|1,0,1]=4 746 B10R1.361 O=C(O)[C@@H]1CC[C@H]1C(=O)O MCULE-2743190923 [1,0,0,1,0,0|1,0,1]=4 747 B10R1.361 O=C(O)[C@@H]1CC[C@H]1C(=O)O MCULE-6841335407 [1,0,0,1,0,0|1,0,1]=4 748 B10R1.361 O=C(O)[C@H]1CC[C@@H]1C(=O)O MCULE-3432000151 [1,0,0,1,0,0|1,0,1]=4 749 B10R1.361 O=C(O)[C@H]1CC[C@@H]1C(=O)O MCULE-6937334278 [1,0,0,1,0,0|1,0,1]=4 750 B10R1.361 O=C(O)[C@H]1CC[C@H]1C(=O)O MCULE-8609403409 [1,0,0,1,0,0|1,0,1]=4 751 B10R1.361 [C@@H]1(CC[C@@H]1C(=O)O)C(=O)O MCULE-4637916300 [1,0,0,1,0,0|1,0,1]=4 752 B10R1.442 CC(C)CC1(CC1)C(=O)O MCULE-1543671076 [1,0,0,1,0,0|1,0,0]=3 753 B10R1.442 CN(C)CC1(CC1)C(=O)O MCULE-2228137213 [1,0,0,1,0,0|2,0,0]=4 754 B10R1.442 CN(C)CC1(CC1)C(=O)O MCULE-2894449552 [1,0,0,1,0,0|2,0,0]=4 755 B10R1.442 O=C(O)C1(CC1)CC(F)F MCULE-6814970241 [1,0,0,1,0,0|2,0,0]=4 756 B10R1.442 O=C(O)CC1(CC1)C(=O)O MCULE-5389842845 [1,0,0,1,0,0|1,0,1]=4 757 B10R1.469 CCC(CC1CC1)C(=O)O MCULE-1890976497 [1,0,0,1,0,0|1,0,0]=3 758 B10R1.469 CCC(NC1CC1)C(=O)O MCULE-7285104702 [1,0,0,1,0,0|2,0,0]=4 759 B10R1.469 NCC(CC1CC1)C(=O)O MCULE-2099794535 [1,0,0,1,0,0|2,0,0]=4 760 B10R1.469 NCC(CC1CC1)C(=O)O MCULE-7748639429 [1,0,0,1,0,0|2,0,0]=4 761 B10R1.61 CC(=O)C1CCCCC1C MCULE-9283684652 [0,0,0,1,1,0|2,0,0]=4 762 B10R1.61 CC(=O)C1CCCCC1F MCULE-4625331195 [0,0,0,1,1,0|2,0,0]=4 763 B10R1.61 CC(=O)C1CCCCC1N MCULE-2419182932 [0,0,0,1,1,0|2,0,0]=4 764 B10R1.61 CC(=O)C1CCCCC1N MCULE-6311029678 [0,0,0,1,1,0|2,0,0]=4 765 B10R1.61 CC(C)C1CCCCC1=O MCULE-1690446832 [0,0,0,1,1,0|2,0,0]=4 766 B10R1.61 CC1=C(CCCO1)C(=O)O MCULE-1778977864 [0,0,0,1,1,0|0,0,2]=4 767 B10R1.61 CC1CCCCC1C(=O)Cl MCULE-7597713129 [0,0,0,1,1,0|2,0,0]=4 768 B10R1.61 CC1CCCCC1C(=O)O MCULE-3305682191 [0,0,0,1,1,0|1,0,0]=3 769 B10R1.61 CC1CCNCC1C(=O)O MCULE-8748624987 [0,0,0,1,1,0|2,0,0]=4 770 B10R1.61 CC1CCNCC1C(=O)O MCULE-9934986088 [0,0,0,1,1,0|2,0,0]=4 771 B10R1.61 CC1CNCCC1C(=O)O MCULE-4662714630 [0,0,0,1,1,0|2,0,0]=4 772 B10R1.61 CC1CNCCC1C(=O)O MCULE-7019458300 [0,0,0,1,1,0|2,0,0]=4 773 B10R1.61 CC1COCCC1C(=O)O MCULE-3541844170 [0,0,0,1,1,0|2,0,0]=4 774 B10R1.61 CC1NCCCC1C(=O)O MCULE-1657397096 [0,0,0,1,1,0|1,0,0]=3 775 B10R1.61 CC1NCCCC1C(=O)O MCULE-3297923255 [0,0,0,1,1,0|1,0,0]=3 776 B10R1.61 CC1OCCCC1C(=O)O MCULE-1412449239 [0,0,0,1,1,0|0,0,0]=2 777 B10R1.61 CC1OCCNC1C(=O)O MCULE-7650728786 [0,0,0,1,1,0|1,0,0]=3 778 B10R1.61 CC1OCCNC1C(=O)O MCULE-7980002158 [0,0,0,1,1,0|1,0,0]=3 779 B10R1.61 CN1CCCCC1C(=O)O MCULE-3456275150 [0,0,0,1,1,0|2,0,0]=4 780 B10R1.61 CN1CCCCC1C(=O)O MCULE-6372652181 [0,0,0,1,1,0|2,0,0]=4 781 B10R1.61 CN1CCCCC1C(=O)O MCULE-7834522939 [0,0,0,1,1,0|2,0,0]=4 782 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-2245294368 [0,0,0,1,1,0|2,0,0]=4 783 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-2258119449 [0,0,0,1,1,0|2,0,0]=4 784 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-4757725445 [0,0,0,1,1,0|2,0,0]=4 785 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-9648696079 [0,0,0,1,1,0|2,0,0]=4 786 B10R1.61 CN1CCCC[C@H]1C(=O)O MCULE-5396822712 [0,0,0,1,1,0|2,0,0]=4 787 B10R1.61 CN1CCCC[C@H]1C(=O)O MCULE-5529863786 [0,0,0,1,1,0|2,0,0]=4 788 B10R1.61 C[C@@H]1NCCC[C@@H]1C(=O)O MCULE-5453839569 [0,0,0,1,1,0|1,0,0]=3 789 B10R1.61 C[C@@H]1NCCC[C@@H]1C(=O)O MCULE-8712948607 [0,0,0,1,1,0|1,0,0]=3 790 B10R1.61 C[C@@H]1NCCC[C@H]1C(=O)O MCULE-4097586923 [0,0,0,1,1,0|1,0,0]=3 791 B10R1.61 C[C@@H]1OCCN[C@@H]1C(=O)O MCULE-5754974970 [0,0,0,1,1,0|1,0,0]=3 792 B10R1.61 C[C@@H]1OCCN[C@@H]1C(=O)O MCULE-9389286375 [0,0,0,1,1,0|1,0,0]=3 793 B10R1.61 C[C@H]1NCCC[C@@H]1C(=O)O MCULE-1705027594 [0,0,0,1,1,0|1,0,0]=3 794 B10R1.61 C[C@H]1NCCC[C@H]1C(=O)O MCULE-8221283836 [0,0,0,1,1,0|1,0,0]=3 795 B10R1.61 C[C@H]1NCCC[C@H]1C(=O)O MCULE-8542699735 [0,0,0,1,1,0|1,0,0]=3 796 B10R1.61 C[C@H]1OCCC[C@H]1C(=O)O MCULE-9860065784 [0,0,0,1,1,0|0,0,0]=2 797 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-1879170734 [0,0,0,1,1,0|1,0,0]=3 798 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-4061314927 [0,0,0,1,1,0|1,0,0]=3 799 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-4489336660 [0,0,0,1,1,0|1,0,0]=3 800 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-4667134552 [0,0,0,1,1,0|1,0,0]=3 801 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-5449945964 [0,0,0,1,1,0|1,0,0]=3 802 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-7387257453 [0,0,0,1,1,0|1,0,0]=3 803 B10R1.61 NC(=O)C1CCCCC1N MCULE-2662216069 [0,0,0,1,1,0|2,0,0]=4 804 B10R1.61 NC(=O)C1CCCCC1N MCULE-7467804033 [0,0,0,1,1,0|2,0,0]=4 805 B10R1.61 NC(=O)[C@@H]1CCCC[C@@H]1N MCULE-2263565157 [0,0,0,1,1,0|2,0,0]=4 806 B10R1.61 NC(=O)[C@@H]1CCCC[C@@H]1N MCULE-4928808183 [0,0,0,1,1,0|2,0,0]=4 807 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-3135295628 [0,0,0,1,1,0|2,0,0]=4 808 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-6221057684 [0,0,0,1,1,0|2,0,0]=4 809 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-8654148060 [0,0,0,1,1,0|2,0,0]=4 810 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-9581516213 [0,0,0,1,1,0|2,0,0]=4 811 B10R1.61 NC1CCCCC1C(=O)O MCULE-4736252154 [0,0,0,1,1,0|1,0,0]=3 812 B10R1.61 NC1CCCCC1C(=O)O MCULE-6203238767 [0,0,0,1,1,0|1,0,0]=3 813 B10R1.61 NC1COCCC1C(=O)O MCULE-3475622537 [0,0,0,1,1,0|2,0,0]=4 814 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-1790728170 [0,0,0,1,1,0|1,0,0]=3 815 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-3150171920 [0,0,0,1,1,0|1,0,0]=3 816 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-4600025587 [0,0,0,1,1,0|1,0,0]=3 817 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-9708582870 [0,0,0,1,1,0|1,0,0]=3 818 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-3088249896 [0,0,0,1,1,0|1,0,0]=3 819 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-4663931442 [0,0,0,1,1,0|1,0,0]=3 820 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-6017464144 [0,0,0,1,1,0|1,0,0]=3 821 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-9507759371 [0,0,0,1,1,0|1,0,0]=3 822 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-2040720562 [0,0,0,1,1,0|1,0,0]=3 823 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-5411687824 [0,0,0,1,1,0|1,0,0]=3 824 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-6353451287 [0,0,0,1,1,0|1,0,0]=3 825 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-9744443114 [0,0,0,1,1,0|1,0,0]=3 826 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-1070315128 [0,0,0,1,1,0|1,0,0]=3 827 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-2665445473 [0,0,0,1,1,0|1,0,0]=3 828 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-5776301031 [0,0,0,1,1,0|1,0,0]=3 829 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-7183400727 [0,0,0,1,1,0|1,0,0]=3 830 B10R1.61 N[C@H]1COCC[C@H]1C(=O)O MCULE-4608934385 [0,0,0,1,1,0|2,0,0]=4 831 B10R1.61 N[C@H]1COCC[C@H]1C(=O)O MCULE-7590284479 [0,0,0,1,1,0|2,0,0]=4 832 B10R1.61 O=C(O)C1CCCCC1=O MCULE-1684765148 [0,0,0,1,1,0|0,0,2]=4 833 B10R1.61 O=C(O)C1CCCCC1F MCULE-9495362772 [0,0,0,1,1,0|1,0,0]=3 834 B10R1.61 O=C(O)C1CCCCC1O MCULE-4502285714 [0,0,0,1,1,0|0,0,0]=2 835 B10R1.61 O=C(O)C1CCCCN1O MCULE-1338694603 [0,0,0,1,1,0|1,0,0]=3 836 B10R1.61 O=C(O)C1CCNCC1F MCULE-5749357486 [0,0,0,1,1,0|2,0,0]=4 837 B10R1.61 O=C(O)C1CCNCC1F MCULE-7431262807 [0,0,0,1,1,0|2,0,0]=4 838 B10R1.61 O=C(O)C1NCCCC1O MCULE-2981139992 [0,0,0,1,1,0|1,0,0]=3 839 B10R1.61 O=C(O)[C@@H]1NCCC[C@H]1O MCULE-2224593354 [0,0,0,1,1,0|1,0,0]=3 840 B10R1.61 O=C(O)[C@@H]1NCCC[C@H]1O MCULE-3743184576 [0,0,0,1,1,0|1,0,0]=3 841 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-2137327596 [0,0,0,1,1,0|1,0,0]=3 842 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-3028221093 [0,0,0,1,1,0|1,0,0]=3 843 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-3468221525 [0,0,0,1,1,0|1,0,0]=3 844 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-5449397815 [0,0,0,1,1,0|1,0,0]=3 845 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-2786788134 [0,0,0,1,1,0|1,0,0]=3 846 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-3262303247 [0,0,0,1,1,0|1,0,0]=3 847 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-4026886814 [0,0,0,1,1,0|1,0,0]=3 848 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-4165843552 [0,0,0,1,1,0|1,0,0]=3 849 B10R1.61 O=C([O-])C1CCCCN1O MCULE-1323846734 [0,0,0,1,1,0|1,0,1]=4 850 B10R1.61 O=N(=O)C1CCCCC1O MCULE-5815114332 [0,0,0,1,1,0|1,0,1]=4 851 B10R1.83 CC1(C(CC1C(=O)O)N)C MCULE-1760692606 [0,0,0,1,1,0|2,0,0]=4 852 B10R1.83 CC1(C(CC1C(=O)O)N)C MCULE-6477382898 [0,0,0,1,1,0|2,0,0]=4 853 B10R1.83 CC1([C@H](C[C@@H]1C(=O)O)N)C MCULE-1367965106 [0,0,0,1,1,0|2,0,0]=4 854 B10R1.83 CC1([C@H](C[C@@H]1C(=O)O)N)C MCULE-5181157821 [0,0,0,1,1,0|2,0,0]=4 855 B10R1.83 CC1([C@H](C[C@@H]1C(=O)O)N)C MCULE-9629419450 [0,0,0,1,1,0|2,0,0]=4 856 B10R1.83 CC1([C@H](C[C@H]1C(=O)O)N)C MCULE-1255189062 [0,0,0,1,1,0|2,0,0]=4 857 B10R1.83 CC1([C@H](C[C@H]1C(=O)O)N)C MCULE-1573159970 [0,0,0,1,1,0|2,0,0]=4 858 B10R1.83 CC1([C@H](C[C@H]1C(=O)O)N)C MCULE-3597897261 [0,0,0,1,1,0|2,0,0]=4 859 B10R1.83 CC1([C@H](C[C@H]1C(=O)O)N)C MCULE-5950701932 [0,0,0,1,1,0|2,0,0]=4 860 B10R1.83 CC1([C@H](C[C@H]1C(=O)O)N)C MCULE-6764578128 [0,0,0,1,1,0|2,0,0]=4 861 B10R1.83 CC1([C@H](C[C@H]1C(=O)O)N)C MCULE-8635317976 [0,0,0,1,1,0|2,0,0]=4 862 B10R1.83 CC1([C@H](C[C@H]1N)C(=O)O)C MCULE-2623468295 [0,0,0,1,1,0|2,0,0]=4 863 B10R1.83 CC1([C@H](C[C@H]1N)C(=O)O)C MCULE-4157898594 [0,0,0,1,1,0|2,0,0]=4 864 B10R1.83 CC1([C@H](C[C@H]1N)C(=O)O)C MCULE-8831652749 [0,0,0,1,1,0|2,0,0]=4 865 B10R1.83 CC1([C@H](C[C@H]1N)C(=O)O)C MCULE-8994723547 [0,0,0,1,1,0|2,0,0]=4 866 B10R1.128 CC1(CCCC1C(=O)O)C MCULE-4580682391 [0,0,0,1,1,0|1,0,0]=3 867 B10R1.128 CC1(CCCC1C(=O)O)N MCULE-6959799055 [0,0,0,1,1,0|1,0,0]=3 868 B10R1.128 CC1(CCCC1C(=O)O)N MCULE-7529713765 [0,0,0,1,1,0|1,0,0]=3 869 B10R1.128 CC1(CCNC1C(=O)O)C MCULE-4368125699 [0,0,0,1,1,0|2,0,0]=4 870 B10R1.128 CC1(CCNC1C(=O)O)C MCULE-9548940162 [0,0,0,1,1,0|2,0,0]=4 871 B10R1.128 CC1(CCN[C@@H]1C(=O)O)C MCULE-9288829524 [0,0,0,1,1,0|2,0,0]=4 872 B10R1.128 CC1(CCN[C@@H]1C(=O)O)C MCULE-9565122593 [0,0,0,1,1,0|2,0,0]=4 873 B10R1.128 CC1(CNCC1C(=O)O)C MCULE-3386370307 [0,0,0,1,1,0|2,0,0]=4 874 B10R1.128 CC1(CNCC1C(=O)O)C MCULE-6121405177 [0,0,0,1,1,0|2,0,0]=4 875 B10R1.128 CC1(CNC[C@@H]1C(=O)O)C MCULE-2007377437 [0,0,0,1,1,0|2,0,0]=4 876 B10R1.128 CC1(CNC[C@@H]1C(=O)O)C MCULE-2184930829 [0,0,0,1,1,0|2,0,0]=4 877 B10R1.128 CC1(CNC[C@H]1C(=O)O)C MCULE-1263349937 [0,0,0,1,1,0|2,0,0]=4 878 B10R1.128 CC1(CNC[C@H]1C(=O)O)C MCULE-7547643584 [0,0,0,1,1,0|2,0,0]=4 879 B10R1.128 CC1(OCCC1C(=O)O)C MCULE-4433776174 [0,0,0,1,1,0|2,0,0]=4 880 B10R1.128 C[C@]1(CCC[C@@H]1C(=O)O)N MCULE-2638855066 [0,0,0,1,1,0|1,0,0]=3 881 B10R1.128 C[C@]1(CCC[C@@H]1C(=O)O)N MCULE-7472901526 [0,0,0,1,1,0|1,0,0]=3 882 B10R1.128 C[N+]1(CCCC1C(=O)O)C MCULE-4111590223 [0,0,0,1,1,0|2,0,0]=4 883 B10R1.128 C[N+]1(CCC[C@H]1C(=O)O)C MCULE-8126384491 [0,0,0,1,1,0|2,0,0]=4 884 B10R1.128 O=C(O)C1CCCC1(F)F MCULE-3687597013 [0,0,0,1,1,0|2,0,0]=4 885 B10R1.187 CCCN1C(=O)CCC1O MCULE-6879311728 [0,0,0,1,1,0|2,0,0]=4 886 B10R1.357 CN(C)C(C(=O)O)C1CC1 MCULE-1393608765 [0,0,0,1,1,0|2,0,0]=4 887 B10R1.357 CN(C)[C@H](C(=O)O)C1CC1 MCULE-9576218231 [0,0,0,1,1,0|2,0,0]=4 888 B10R1.357 O=C(O)C(C(=O)O)C1CC1 MCULE-7949932488 [0,0,0,1,1,0|1,0,1]=4 889 B10R1.364 CC(C)C1(CCC1)C(=O)O MCULE-5390430803 [0,0,0,1,1,0|1,0,0]=3 890 B10R1.364 CC(C)C1(COC1)C(=O)O MCULE-8424161253 [0,0,0,1,1,0|2,0,0]=4 891 B10R1.364 CN(C)C1(CCC1)C(=O)O MCULE-2624761605 [0,0,0,1,1,0|2,0,0]=4 892 B10R1.364 CN(C)C1(CCC1)C(=O)O MCULE-5134554212 [0,0,0,1,1,0|2,0,0]=4 893 B10R1.364 O=C(O)C1(CCC1)C(=O)O MCULE-2598974796 [0,0,0,1,1,0|1,0,1]=4 894 B10R1.364 O=C(O)C1(CCC1)C(F)F MCULE-8084773789 [0,0,0,1,1,0|2,0,0]=4 895 B12R1.101 CC(=O)OC1CC(OC(O1)C)C MCULE-4957661317 [0,0,0,1,0,1|2,0,0]=4 896 B12R1.101 CC1CC(CC(O1)C)CC(=O)Cl MCULE-8474340422 [0,0,0,1,0,1|1,0,0]=3 897 B12R1.101 CC1CC(CC(O1)C)CC(=O)O MCULE-8495492526 [0,0,0,1,0,1|0,0,0]=2 898 B12R1.101 CC1CC(CN(C1)CC(=O)O)C MCULE-2538801181 [0,0,0,1,0,1|2,0,0]=4 899 B12R1.101 CC1CC(CN(C1)CC(=O)O)C MCULE-5326748867 [0,0,0,1,0,1|2,0,0]=4 900 B12R1.101 CC1CN(CC(O1)C)CC(=O)N MCULE-9879723410 [0,0,0,1,0,1|2,0,0]=4 901 B12R1.101 CC1CN(CC(O1)C)CC(=O)O MCULE-4920455027 [0,0,0,1,0,1|1,0,0]=3 902 B12R1.101 CC1CN(CC(O1)C)CC(=O)O MCULE-8382703968 [0,0,0,1,0,1|1,0,0]=3 903 B12R1.101 C[C@H]1CN(C[C@H](O1)C)CC(=O)O MCULE-8623250757 [0,0,0,1,0,1|1,0,0]=3 904 B12R1.392 CC(C)CN1CCCC1C(=O)O MCULE-4228889336 [0,0,0,1,0,1|2,0,0]=4 905 B12R1.392 CC(C)CN1CCC[C@H]1C(=O)O MCULE-2363163465 [0,0,0,1,0,1|2,0,0]=4 906 B12R1.392 CC(C)CN1CCC[C@H]1C(=O)O MCULE-2594145267 [0,0,0,1,0,1|2,0,0]=4 907 B12R1.392 CC(O)CN1CCC[C@H]1C(=O)O MCULE-1519984794 [0,0,0,1,0,1|1,0,0]=3 908 B12R1.1821 CC1(CC(CCO1)CC(=O)O)C MCULE-3148966239 [0,0,0,1,0,1|2,0,0]=4 909 B12R1.1821 CC1(CCCC(C1)CC(=O)O)C MCULE-4167404807 [0,0,0,1,0,1|1,0,0]=3 910 B12R1.1821 CC1(CCCC(O1)CC(=O)O)C MCULE-4104007715 [0,0,0,1,0,1|2,0,0]=4 911 B12R1.1821 O=C(O)CC1CCCC(C1)(F)F MCULE-3398256735 [0,0,0,1,0,1|2,0,0]=4 912 B12R1.1826 O=C(O)CC1(CCC1)CC(=O)O MCULE-7946056476 [0,0,0,1,0,1|1,0,1]=4 913 B12R1.258 CC(=O)N1CCCC(C1)C(=O)O MCULE-2326703264 [0,0,0,1,0,1|0,0,2]=4 914 B12R1.258 CC(=O)N1CCC[C@@H](C1)C(=O)O MCULE-2720998952 [0,0,0,1,0,1|0,0,2]=4 915 B12R1.258 CC(=O)N1CCC[C@@H](C1)C(=O)O MCULE-4356837818 [0,0,0,1,0,1|0,0,2]=4 916 B12R1.258 CC(=O)N1CCC[C@H](C1)C(=O)O MCULE-4379891928 [0,0,0,1,0,1|0,0,2]=4 917 B12R1.258 CC(=O)N1CCC[C@H](C1)C(=O)O MCULE-8013678613 [0,0,0,1,0,1|0,0,2]=4 918 B12R1.258 CC(C)C1CC(CCO1)C(=O)O MCULE-1572629530 [0,0,0,1,0,1|2,0,0]=4 919 B12R1.258 CC(C)N1CCCC(C1)C(=O)O MCULE-8181632552 [0,0,0,1,0,1|1,0,0]=3 920 B12R1.258 CC(C)N1CCCC(C1)C(=O)O MCULE-8953491391 [0,0,0,1,0,1|1,0,0]=3 921 B12R1.258 CC(C)N1CCOC(C1)C(=O)O MCULE-2744161065 [0,0,0,1,0,1|2,0,0]=4 922 B12R1.258 CC(C)N1CCOC(C1)C(=O)O MCULE-9484325546 [0,0,0,1,0,1|2,0,0]=4 923 B12R1.258 CN(C)C1CCCC(C1)C(=O)O MCULE-2517607993 [0,0,0,1,0,1|2,0,0]=4 924 B12R1.258 CN(C)[C@H]1CCC[C@H](C1)C(=O)O MCULE-9401048102 [0,0,0,1,0,1|2,0,0]=4 925 B12R1.258 O=C(O)C1CCCC(C1)C(=O)O MCULE-7196171464 [0,0,0,1,0,1|1,0,1]=4 926 B12R1.258 O=C(O)C1CCCC(N1)C(=O)O MCULE-1816268674 [0,0,0,1,0,1|1,0,1]=4 927 B12R1.258 O=C(O)[C@@H]1CCC[C@@H](N1)C(=O)O MCULE-3140137492 [0,0,0,1,0,1|1,0,1]=4 928 B12R1.258 O=C(O)[C@@H]1CCC[C@H](C1)C(=O)O MCULE-4449782615 [0,0,0,1,0,1|1,0,1]=4 929 B12R1.258 O=C(O)[C@@H]1CCC[C@H](C1)C(=O)O MCULE-8158708245 [0,0,0,1,0,1|1,0,1]=4 930 B12R1.258 O=C(O)[C@H]1CCC[C@@H](C1)C(=O)O MCULE-2075996893 [0,0,0,1,0,1|1,0,1]=4 931 B12R1.258 O=C(O)[C@H]1CCC[C@@H](C1)C(=O)O MCULE-2751748723 [0,0,0,1,0,1|1,0,1]=4 932 B12R1.258 O=C(O)[C@H]1CCC[C@@H](C1)C(=O)O MCULE-9442455281 [0,0,0,1,0,1|1,0,1]=4 933 B12R1.258 O=C(O)[C@H]1CCC[C@H](C1)C(=O)O MCULE-3306746591 [0,0,0,1,0,1|1,0,1]=4 934 B12R1.274 CCCC1CC(OC1=O)C(C)O MCULE-6381035805 [0,0,0,1,0,1|0,0,0]=2 935 B12R1.263 CS(=O)(=O)C1CCCC1C(=O)O MCULE-2056304673 [0,1,0,1,0,0|1,0,1]=4 936 B12R1.3005 C[C@H]1C[C@H](CC(C1)(C)C)C(=O)O MCULE-1133384955 [0,1,0,1,0,0|1,0,0]=3 937 B12R1.3096 CS(=O)(=O)CC1(CCC1)C(=O)O MCULE-8758508092 [0,1,0,1,0,0|1,0,1]=4 938 B12R1.3096 O=C(O)C1(CCC1)CC(F)(F)F MCULE-1072624762 [0,1,0,1,0,0|2,0,0]=4 939 B12R1.844 CC1(CC(C(=O)O1)CC(=O)O)C MCULE-5608114296 [0,1,0,1,0,0|1,0,1]=4 940 B12R1.850 CC(=O)N1CC(CC1C(=O)O)O MCULE-9681082607 [0,1,0,1,0,0|1,0,1]=4 941 B12R1.850 CC(=O)N1CC(C[C@H]1C(=O)O)O MCULE-5097508255 [0,1,0,1,0,0|1,0,1]=4 942 B12R1.850 CC(=O)N1C[C@@H](C[C@H]1C(=O)O)O MCULE-2576782102 [0,1,0,1,0,0|1,0,1]=4 943 B12R1.850 CC(=O)N1C[C@@H](C[C@H]1C(=O)O)O MCULE-5490909004 [0,1,0,1,0,0|1,0,1]=4 944 B12R1.850 CC1CC(C(C1)C(=O)O)C(=O)O MCULE-5449345895 [0,1,0,1,0,0|1,0,1]=4 945 B12R1.210 CC(C)CC1NCCCNC1=O MCULE-2395578966 [0,1,0,1,0,0|2,0,0]=4 946 B12R1.358 CC1CN(CC(O1)C)C(=O)CCl MCULE-2111293628 [0,1,0,1,0,0|2,0,0]=4 947 B12R1.358 CCC(=O)N1CC(OC(C1)C)C MCULE-7110648006 [0,1,0,1,0,0|2,0,0]=4 948 B12R1.358 COC(=O)[C@@H]1C[C@@H](N[C@@H](C1)C)C MCULE-1031031034 [0,1,0,1,0,0|1,0,0]=3 949 B12R1.358 COC(=O)[C@@H]1C[C@@H](N[C@@H](C1)C)C MCULE-7480824153 [0,1,0,1,0,0|1,0,0]=3 950 B12R1.358 C[C@H]1CN(C[C@H](O1)C)C(=O)CCl MCULE-7176874882 [0,1,0,1,0,0|2,0,0]=4 951 B12R1.368 COC(=O)C1CCCC1C(=O)O MCULE-9581431032 [0,1,0,1,0,0|0,0,2]=4 952 B12R1.368 COC(=O)C1CCCN1C(C)C MCULE-6185067522 [0,1,0,1,0,0|2,0,0]=4 953 B12R1.368 COC(=O)C1CCNC1C(C)C MCULE-1345475546 [0,1,0,1,0,0|2,0,0]=4 954 B12R1.368 COC(=O)C1CCNC1C(C)C MCULE-5424869245 [0,1,0,1,0,0|2,0,0]=4 955 B12R1.368 COC(=O)C1CNCC1C(C)C MCULE-1420095237 [0,1,0,1,0,0|2,0,0]=4 956 B12R1.368 COC(=O)C1CNCC1C(C)C MCULE-2508096476 [0,1,0,1,0,0|2,0,0]=4 957 B12R1.368 COC(=O)[C@@H]1CCC[C@H]1C(=O)O MCULE-3708284379 [0,1,0,1,0,0|0,0,2]=4 958 B12R1.368 COC(=O)[C@@H]1CCC[C@H]1C(=O)O MCULE-7207251404 [0,1,0,1,0,0|0,0,2]=4 959 B12R1.368 COC(=O)[C@H]1CCC[C@@H]1C(=O)O MCULE-2395296422 [0,1,0,1,0,0|0,0,2]=4 960 B12R1.368 COC(=O)[C@H]1CCC[C@H]1C(=O)O MCULE-1837515410 [0,1,0,1,0,0|0,0,2]=4 961 B12R1.368 COC(=O)[C@H]1CCC[C@H]1C(=O)O MCULE-4611068546 [0,1,0,1,0,0|0,0,2]=4 962 B12R1.368 COC(=O)[C@H]1CCC[C@H]1C(=O)O MCULE-7157008551 [0,1,0,1,0,0|0,0,2]=4 963 B12R1.368 COC(=O)[C@H]1CNC[C@@H]1C(C)C MCULE-3226896140 [0,1,0,1,0,0|2,0,0]=4 964 B12R1.368 COC(=O)[C@H]1CNC[C@@H]1C(C)C MCULE-8682134445 [0,1,0,1,0,0|2,0,0]=4 965 B12R1.368 COC(=O)[C@H]1CNC[C@@H]1C(C)C MCULE-9184387963 [0,1,0,1,0,0|2,0,0]=4 966 B12R1.368 COC(=O)[C@H]1CNC[C@@H]1C(C)C MCULE-9684399122 [0,1,0,1,0,0|2,0,0]=4 967 B12R1.1657 COC(=O)C1CCCCC(=O)C1 MCULE-4513192027 [0,1,0,1,0,0|0,0,2]=4 968 B12R1.1657 COC(=O)C1CCCCC(C1)N MCULE-4941616520 [0,1,0,1,0,0|1,0,0]=3 969 B12R1.1657 COC(=O)C1CCCCC(C1)O MCULE-1860574811 [0,1,0,1,0,0|0,0,0]=2 970 B12R1.1707 COC(=O)C1CCNC(C1)(C)C MCULE-1935838640 [0,1,0,1,0,0|2,0,0]=4 971 B12R1.1707 COC(=O)C1CCNC(C1)(C)C MCULE-5359203843 [0,1,0,1,0,0|2,0,0]=4 972 B12R1.1707 COC(=O)C1CCOC(C1)(C)C MCULE-9239662422 [0,1,0,1,0,0|2,0,0]=4 973 B12R1.261 CC(C)N1CCCCC1C(=O)O MCULE-1732607027 [0,1,0,1,0,0|2,0,0]=4 974 B12R1.261 CC(C)N1CCCCC1C(=O)O MCULE-7684924530 [0,1,0,1,0,0|2,0,0]=4 975 B12R1.261 CC(C)N1CCCC[C@H]1C(=O)O MCULE-7336169680 [0,1,0,1,0,0|2,0,0]=4 976 B12R1.261 CC(C)N1CCCC[C@H]1C(=O)O MCULE-8875686576 [0,1,0,1,0,0|2,0,0]=4 977 B12R1.261 CC(C)N1CCNCC1C(=O)O MCULE-7688172132 [0,1,0,1,0,0|2,0,0]=4 978 B12R1.261 O=C(O)C1CCCCC1C(=O)O MCULE-3185409075 [0,1,0,1,0,0|1,0,1]=4 979 B12R1.261 O=C(O)C1CCCNC1C(=O)O MCULE-3938002780 [0,1,0,1,0,0|1,0,1]=4 980 B12R1.261 O=C(O)C1CCCNC1C(=O)O MCULE-6316865811 [0,1,0,1,0,0|1,0,1]=4 981 B12R1.261 O=C(O)C1CCNCC1C(=O)O MCULE-6895708229 [0,1,0,1,0,0|1,0,1]=4 982 B12R1.261 O=C(O)C1CCNCC1C(=O)O MCULE-8118548559 [0,1,0,1,0,0|1,0,1]=4 983 B12R1.261 O=C(O)[C@@H]1CCCC[C@H]1C(=O)O MCULE-4895515726 [0,1,0,1,0,0|1,0,1]=4 984 B12R1.261 O=C(O)[C@@H]1CCCC[C@H]1C(=O)O MCULE-4906980900 [0,1,0,1,0,0|1,0,1]=4 985 B12R1.261 O=C(O)[C@@H]1CCCC[C@H]1C(=O)O MCULE-7747323415 [0,1,0,1,0,0|1,0,1]=4 986 B12R1.261 O=C(O)[C@H]1CCCC[C@@H]1C(=O)O MCULE-1184405040 [0,1,0,1,0,0|1,0,1]=4 987 B12R1.261 O=C(O)[C@H]1CCCC[C@@H]1C(=O)O MCULE-3346909877 [0,1,0,1,0,0|1,0,1]=4 988 B12R1.261 O=C(O)[C@H]1CCCC[C@H]1C(=O)O MCULE-9506589203 [0,1,0,1,0,0|1,0,1]=4 989 B12R1.261 O=C(O)[C@H]1CCCN[C@H]1C(=O)O MCULE-4882537337 [0,1,0,1,0,0|1,0,1]=4 990 B12R1.261 O=C(O)[C@H]1CCCN[C@H]1C(=O)O MCULE-6755541512 [0,1,0,1,0,0|1,0,1]=4 991 B12R1.261 O=C(O)[C@H]1NCCC[C@H]1C(=O)O MCULE-3174459162 [0,1,0,1,0,0|1,0,1]=4 992 B12R1.261 O=C(O)[C@H]1NCCC[C@H]1C(=O)O MCULE-5812717043 [0,1,0,1,0,0|1,0,1]=4 993 B12R1.2417 CCC1(OC(=O)CC1C(=O)O)C MCULE-4156934361 [0,1,0,1,0,0|1,0,1]=4 994 B12R1.1011 O=C1CCCCCC(C1)C(=O)O MCULE-3072060660 [0,1,0,1,0,0|0,0,2]=4 995 B12R1.3171 CC(=O)CC1(CCCC1)C(=O)O MCULE-7800919865 [0,1,0,1,0,0|0,0,2]=4 996 B12R1.3171 CC(C)CC1(CCCC1)C(=O)O MCULE-5516862845 [0,1,0,1,0,0|1,0,0]=3 997 B12R1.3171 O=C(O)CC1(CCCC1)C(=O)O MCULE-5558936340 [0,1,0,1,0,0|1,0,1]=4 998 B12R1.3006 CC1CC(CC(O1)C)(C)C(=O)O MCULE-4711291247 [0,1,0,1,0,0|0,0,0]=2 999 B12R1.3097 CC1(CCCC(C1)(F)F)C(=O)O MCULE-8130777169 [0,1,0,1,0,0|2,0,0]=4 1000 B12R1.3097 CC1(CCCC(C1)(N)C(=O)O)C MCULE-4405441646 [0,1,0,1,0,0|1,0,0]=3 1001 B12R1.3097 CC1(CCCC(C1)(O)C(=O)O)C MCULE-5633126153 [0,1,0,1,0,0|1,0,0]=3 1002 B12R1.626 COC1CCCCC(C1)C(=O)O MCULE-7462960246 [0,1,0,1,0,0|0,0,0]=2 1003 B12R1.766 CCC1C(CC(=O)N1C)C(=O)O MCULE-9837829461 [0,1,0,1,0,0|0,0,2]=4 1004 B12R1.1123 CCCC1CC(C(=O)NC1=O)C MCULE-8704647112 [0,1,0,1,0,0|1,0,1]=4 1005 B12R1.2219 COC(=O)CC1(CCC1)C(=O)O MCULE-4643817692 [0,1,0,1,0,0|0,0,2]=4 1006 B12R2.202 [C@@H]12C[C@H](CN1CCNC2=O)O MCULE-6268753688 [0,0,0,2,0,0|2,0,0]=4 1007 B12R2.1145 O=C(O)C1CC2CC(=O)C1C2 MCULE-9601771232 [0,0,0,2,0,0|0,0,2]=4 1008 B12R2.1145 O=C(O)C1CC2CC(=O)C1O2 MCULE-8904137795 [0,0,0,2,0,0|1,0,1]=4 1009 B12R2.1145 O=C(O)C1CC2CC(C1C2)O MCULE-9092645789 [0,0,0,2,0,0|0,0,0]=2 1010 B12R2.1145 O=C(O)C1CC2CC(C1O2)O MCULE-7550867505 [0,0,0,2,0,0|1,0,0]=3 1011 B12R2.1145 O=C(O)C1CC2CC1C(=O)O2 MCULE-4878928430 [0,0,0,2,0,0|1,0,1]=4 1012 B12R2.1145 O=C(O)C1C[C@H]2CC(=O)[C@@H]1C2 MCULE-8622443304 [0,0,0,2,0,0|0,0,2]=4 1013 B12R2.1145 O=C(O)[C@@H]1C[C@@H]2C[C@H]([C@H]1O2)O MCULE-7416371352 [0,0,0,2,0,0|1,0,0]=3 1014 B12R2.1145 O=C1C[C@H]2C[C@H]([C@@H]1O2)C(=O)O MCULE-9409997812 [0,0,0,2,0,0|1,0,1]=4 1015 B12R2.1145 [C@@H]12C[C@H]([C@@H](C1)C(=O)O2)C(=O)O MCULE-2764304664 [0,0,0,2,0,0|1,0,1]=4 1016 B12R2.1145 [C@@H]12O[C@@H](CC1=O)C[C@H]2C(=O)O MCULE-7942669188 [0,0,0,2,0,0|1,0,1]=4 1017 B12R2.1145 [C@@H]12O[C@@H](C[C@H]1O)C[C@H]2C(=O)O MCULE-5995832358 [0,0,0,2,0,0|1,0,0]=3 1018 B12R2.3178 CC1(C2C1C(NC2)C(=O)O)C MCULE-1420630837 [0,0,0,2,0,0|2,0,0]=4 1019 B12R2.3178 CC1(C2C1C(NC2)C(=O)O)C MCULE-7036364294 [0,0,0,2,0,0|2,0,0]=4 1020 B12R2.3178 CC1([C@@H]2[C@H]1[C@H](NC2)C(=O)O)C MCULE-1791013785 [0,0,0,2,0,0|2,0,0]=4 1021 B12R2.3178 CC1([C@@H]2[C@H]1[C@H](NC2)C(=O)O)C MCULE-6215833912 [0,0,0,2,0,0|2,0,0]=4 1022 B12R2.3178 CC1([C@@H]2[C@H]1[C@H](NC2)C(=O)O)C MCULE-7468658286 [0,0,0,2,0,0|2,0,0]=4 1023 B12R2.3178 CC1([C@H]2[C@H]1[C@H](NC2)C(=O)O)C MCULE-1022923026 [0,0,0,2,0,0|2,0,0]=4 1024 B12R2.3178 CC1([C@H]2[C@H]1[C@H](NC2)C(=O)O)C MCULE-1676737681 [0,0,0,2,0,0|2,0,0]=4 1025 B12R2.3178 [C@@H]1(NC[C@H]2[C@@H]1C2(C)C)C(=O)O MCULE-8174820607 [0,0,0,2,0,0|2,0,0]=4 1026 B12R2.3178 [C@H]12CN[C@@H]([C@H]1C2(C)C)C(=O)O MCULE-1116000746 [0,0,0,2,0,0|2,0,0]=4 1027 B12R2.3178 [C@H]12CN[C@@H]([C@H]1C2(C)C)C(=O)O MCULE-6741354575 [0,0,0,2,0,0|2,0,0]=4 1028 B12R2.253 CC(=O)C1CC2CCC(C2)C1 MCULE-6565157847 [0,0,0,2,0,0|2,0,0]=4 1029 B12R2.253 O=C(O)C1CC2CCC(C1)N2 MCULE-4898584624 [0,0,0,2,0,0|1,0,0]=3 1030 B12R2.253 O=C(O)C1CC2CCC(C1)N2 MCULE-8726253951 [0,0,0,2,0,0|1,0,0]=3 1031 B12R2.253 O=C(O)C1CC2CCC(C1)O2 MCULE-4617510506 [0,0,0,2,0,0|0,0,0]=2 1032 B12R2.253 O=C(O)C1CC2CCC(C2)C1 MCULE-1729016821 [0,0,0,2,0,0|1,0,0]=3 1033 B12R2.253 O=C(O)[C@@H]1C[C@@H]2CC[C@H](C1)O2 MCULE-2909105123 [0,0,0,2,0,0|0,0,0]=2 1034 B12R2.253 O=C(O)[C@H]1C[C@@H]2CC[C@H](C1)N2 MCULE-3620349430 [0,0,0,2,0,0|1,0,0]=3 1035 B12R2.253 O=C(O)[C@H]1C[C@@H]2CC[C@H](C1)N2 MCULE-9958120238 [0,0,0,2,0,0|1,0,0]=3 1036 B12R2.1356 O=C(O)[C@H]1NCC[C@@H]1C2CC2 MCULE-5344790771 [0,0,0,2,0,0|2,0,0]=4 1037 B12R2.1356 O=C(O)[C@H]1NCC[C@@H]1C2CC2 MCULE-6712244548 [0,0,0,2,0,0|2,0,0]=4 1038 B12R2.3934 O=C1NCC(CC12CNC2)O MCULE-1122767299 [0,0,0,2,0,0|2,0,0]=4 1039 B12R2.3934 O=C1NCC(CC12CNC2)O MCULE-9469567430 [0,0,0,2,0,0|2,0,0]=4 1040 B12R2.659 CC(C)C1NC(=O)C12CCC2 MCULE-5690950744 [0,0,0,2,0,0|2,0,0]=4 1041 B12R2.3098 O=C(O)C12CCCC(C1)(C2)O MCULE-3569695743 [0,0,0,2,0,0|0,0,0]=2 1042 B12R2.3181 O=C(O)C1CCCC2(C1)CC2 MCULE-4492465897 [0,0,0,2,0,0|1,0,0]=3 1043 B12R2.3181 O=C(O)[C@H]1CCCC2(C1)CC2 MCULE-6739136358 [0,0,0,2,0,0|1,0,0]=3 1044 B12R2.3222 O=C(O)C1(CCC1)CC2CC2 MCULE-9649318827 [0,0,0,2,0,0|1,0,0]=3 1045 B12R2.3222 O=C(O)C1(CCC1)NC2CC2 MCULE-5723139228 [0,0,0,2,0,0|2,0,0]=4 1046 B8R0.18 CC(C)C(CN)C(=O)O MCULE-4117902081 [1,0,0,0,1,0|2,0,0]=4 1047 B8R0.18 CC(C)C(CN)C(=O)O MCULE-7615812755 [1,0,0,0,1,0|2,0,0]=4 1048 B8R0.18 CC(C)C(CN)C(=O)O MCULE-7742033605 [1,0,0,0,1,0|2,0,0]=4 1049 B8R0.18 CC(C)C(CO)C(=O)O MCULE-3554430088 [1,0,0,0,1,0|2,0,0]=4 1050 B8R0.18 CC(C)[C@@H](CN)C(=O)O MCULE-1192054373 [1,0,0,0,1,0|2,0,0]=4 1051 B8R0.18 CC(C)[C@@H](CN)C(=O)O MCULE-3040043200 [1,0,0,0,1,0|2,0,0]=4 1052 B8R0.18 CC(C)[C@@H](CN)C(=O)O MCULE-4353846755 [1,0,0,0,1,0|2,0,0]=4 1053 B8R0.18 CC(C)[C@@H](CN)C(=O)O MCULE-6762829521 [1,0,0,0,1,0|2,0,0]=4 1054 B8R0.18 CC(C)[C@H](CN)C(=O)O MCULE-4384560751 [1,0,0,0,1,0|2,0,0]=4 1055 B8R0.18 CC(C)[C@H](CN)C(=O)O MCULE-4859224613 [1,0,0,0,1,0|2,0,0]=4 1056 B8R0.18 CC(C)[C@H](CN)C(=O)O MCULE-4974717674 [1,0,0,0,1,0|2,0,0]=4 1057 B8R0.18 CC(C)[C@H](CN)C(=O)O MCULE-7170111497 [1,0,0,0,1,0|2,0,0]=4 1058 B8R0.18 CCC(C(=O)C)C(C)C MCULE-3028115393 [1,0,0,0,1,0|2,0,0]=4 1059 B8R0.18 CCC(C(=O)O)C(=O)O MCULE-3288957588 [1,0,0,0,1,0|1,0,1]=4 1060 B8R0.18 CCC(C(=O)O)C(C)C MCULE-5914693527 [1,0,0,0,1,0|1,0,0]=3 1061 B8R0.18 CCC(C(=O)O)C(C)N MCULE-2976322800 [1,0,0,0,1,0|1,0,0]=3 1062 B8R0.18 CCC(C(=O)O)C(C)O MCULE-1064081188 [1,0,0,0,1,0|0,0,0]=2 1063 B8R0.18 CCC(C(=O)O)N(C)C MCULE-4235177725 [1,0,0,0,1,0|2,0,0]=4 1064 B8R0.18 CC[C@@H](C(=O)O)N(C)C MCULE-3756764540 [1,0,0,0,1,0|2,0,0]=4 1065 B8R0.18 CC[C@H](C(=O)O)N(C)C MCULE-4719850768 [1,0,0,0,1,0|2,0,0]=4 1066 B8R0.18 CNC(C(=O)O)C(C)C MCULE-2983512448 [1,0,0,0,1,0|2,0,0]=4 1067 B8R0.18 CNC(C(=O)O)C(C)C MCULE-5377326864 [1,0,0,0,1,0|2,0,0]=4 1068 B8R0.18 CNC(C(=O)O)C(C)C MCULE-7319327975 [1,0,0,0,1,0|2,0,0]=4 1069 B8R0.18 CNC(C(=O)O)C(C)O MCULE-8017224741 [1,0,0,0,1,0|1,0,0]=3 1070 B8R0.18 CN[C@@H](C(=O)O)C(C)C MCULE-4099145544 [1,0,0,0,1,0|2,0,0]=4 1071 B8R0.18 CN[C@@H](C(=O)O)C(C)C MCULE-4380404369 [1,0,0,0,1,0|2,0,0]=4 1072 B8R0.18 CN[C@@H](C(=O)O)C(C)C MCULE-9367123188 [1,0,0,0,1,0|2,0,0]=4 1073 B8R0.18 CN[C@@H](C(=O)O)C(C)C MCULE-9706333586 [1,0,0,0,1,0|2,0,0]=4 1074 B8R0.18 CN[C@H](C(=O)O)C(C)C MCULE-5443567819 [1,0,0,0,1,0|2,0,0]=4 1075 B8R0.18 CN[C@H](C(=O)O)C(C)C MCULE-5552228182 [1,0,0,0,1,0|2,0,0]=4 1076 B8R0.18 CN[C@H](C(=O)O)C(C)C MCULE-5767489702 [1,0,0,0,1,0|2,0,0]=4 1077 B8R0.18 CN[C@H](C(=O)O)C(C)C MCULE-8822349419 [1,0,0,0,1,0|2,0,0]=4 1078 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-5405618703 [1,0,0,0,1,0|1,0,0]=3 1079 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-6470355986 [1,0,0,0,1,0|1,0,0]=3 1080 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-7261692258 [1,0,0,0,1,0|1,0,0]=3 1081 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-7763091319 [1,0,0,0,1,0|1,0,0]=3 1082 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-8429501411 [1,0,0,0,1,0|1,0,0]=3 1083 B8R0.18 COC(C(=O)O)C(C)Br MCULE-9261088290 [1,0,0,0,1,0|2,0,0]=4 1084 B8R0.18 COC(C(=O)O)C(C)C MCULE-4922461673 [1,0,0,0,1,0|2,0,0]=4 1085 B8R0.18 COC(C(=O)O)C(C)C MCULE-6661618070 [1,0,0,0,1,0|2,0,0]=4 1086 B8R0.18 COC(C(=O)O)C(C)N MCULE-5882264486 [1,0,0,0,1,0|2,0,0]=4 1087 B8R0.18 CO[C@@H](C(=O)O)C(C)C MCULE-1619707717 [1,0,0,0,1,0|2,0,0]=4 1088 B8R0.18 CO[C@H](C(=O)O)C(C)C MCULE-2291773409 [1,0,0,0,1,0|2,0,0]=4 1089 B8R0.18 CSC(C(=O)O)C(C)C MCULE-9613087260 [1,0,0,0,1,0|2,0,0]=4 1090 B10R0.84 CCC(CCC(=O)C)C(=O)O MCULE-2983781440 [1,0,0,0,0,1|0,0,2]=4 1091 B10R0.84 CCC(CCC(C)C)C(=O)N MCULE-9855457734 [1,0,0,0,0,1|2,0,0]=4 1092 B10R0.84 CCC(CCC(C)C)C(=O)O MCULE-5167744478 [1,0,0,0,0,1|1,0,0]=3