0 B11R1.74 CC(C)C1CC(=O)NC(=O)C1 MCULE-2708217447 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.74 CC1=CC(=CC(=O)N1)C(=O)O MCULE-5062152880 [0,0,0,0,0,0|2,0,2]=4 2 B11R1.74 CC1=CC(=O)C=C(N1)C(=O)O MCULE-5508133838 [0,0,0,0,0,0|2,0,2]=4 3 B11R1.74 CC1=CC(=O)NC(=C1)C(=O)O MCULE-8099474609 [0,0,0,0,0,0|2,0,2]=4 4 B11R1.74 CC1=NC(=CC(=O)N1)C(=O)O MCULE-3984714130 [0,0,0,0,0,0|1,0,3]=4 5 B11R1.74 CC1=NC(=O)NC(=C1)C(=O)O MCULE-7921673628 [0,0,0,0,0,0|1,0,3]=4 6 B11R1.74 CC1CC(NC(=S)N1)C(=O)O MCULE-6244565305 [0,0,0,0,0,0|1,1,1]=3 7 B11R1.74 C[C@@H]1C[C@H](NC(=S)N1)C(=O)O MCULE-3527131237 [0,0,0,0,0,0|1,1,1]=3 8 B11R1.74 C[C@@H]1C[C@H](NC(=S)N1)C(=O)O MCULE-5042056278 [0,0,0,0,0,0|1,1,1]=3 9 B11R1.74 N=C1NC(=O)C=C(S1)C(=O)O MCULE-4278089351 [0,0,0,0,0,0|2,0,2]=4 10 B11R1.74 N=C1NC(=O)CC(S1)C(=O)O MCULE-5822428129 [0,0,0,0,0,0|2,0,0]=2 11 B11R1.74 NC(=O)C1=CC(=O)NC(=O)N1 MCULE-6215871295 [0,0,0,0,0,0|1,0,2]=3 12 B11R1.74 NC(=O)C1=NC(=O)NC(=O)N1 MCULE-1501109502 [0,0,0,0,0,0|2,0,1]=3 13 B11R1.74 O=C1C=C(C=C(N1)Cl)C(=O)O MCULE-5716078367 [0,0,0,0,0,0|2,0,2]=4 14 B11R1.74 O=C1C=C(N=C(N1)C(=O)O)O MCULE-6837849203 [0,0,0,0,0,0|2,0,2]=4 15 B11R1.74 O=C1C=C(NC(=O)N1)C(=O)O MCULE-1013719295 [0,0,0,0,0,0|0,0,2]=2 16 B11R1.74 O=C1C=C(NC(=O)N1)C(=O)O MCULE-1063581454 [0,0,0,0,0,0|0,0,2]=2 17 B11R1.74 O=C1C=C(NC(=O)N1)C(=O)O MCULE-4166125392 [0,0,0,0,0,0|0,0,2]=2 18 B11R1.74 O=C1C=C(NC(=O)N1)C(=O)O MCULE-5733155947 [0,0,0,0,0,0|0,0,2]=2 19 B11R1.74 O=C1C=C(NC(=O)N1)C(=O)O MCULE-8576554569 [0,0,0,0,0,0|0,0,2]=2 20 B11R1.74 O=C1C=C(NC(=S)N1)C(=O)O MCULE-6748638642 [0,0,0,0,0,0|0,1,2]=3 21 B11R1.74 O=C1C=C(NC(=[Se])N1)C(=O)O MCULE-7353883477 [0,0,0,0,0,0|0,1,2]=3 22 B11R1.74 O=C1C=C([NH2+]C(=O)N1)C(=O)O MCULE-8213749858 [0,0,0,0,0,0|0,0,3]=3 23 B11R1.74 O=C1CC(=O)CC(C1)C(=O)Cl MCULE-5961631621 [0,0,0,0,0,0|3,0,0]=3 24 B11R1.74 O=C1CC(=O)CC(C1)C(=O)O MCULE-2619134082 [0,0,0,0,0,0|2,0,0]=2 25 B11R1.74 O=C1CC(CC(=O)N1)C(=O)O MCULE-5623787674 [0,0,0,0,0,0|1,0,0]=1 26 B11R1.74 O=C1CC(CC(=O)N1)C(F)F MCULE-9121810276 [0,0,0,0,0,0|3,0,1]=4 27 B11R1.74 O=C1CC(NC(=O)N1)C(=O)O MCULE-8091289320 [0,0,0,0,0,0|0,0,0]=0 28 B11R1.74 O=C1C[C@@H](NC(=O)N1)C(=O)O MCULE-4074220021 [0,0,0,0,0,0|0,0,0]=0 29 B11R1.74 O=C1C[C@@H](NC(=O)N1)C(=O)O MCULE-7764195040 [0,0,0,0,0,0|0,0,0]=0 30 B11R1.74 O=C1C[C@H](NC(=O)N1)C(=O)O MCULE-6513392402 [0,0,0,0,0,0|0,0,0]=0 31 B11R1.74 O=C1C[C@H](NC(=O)N1)C(=O)O MCULE-7404763627 [0,0,0,0,0,0|0,0,0]=0 32 B11R1.74 O=C1N=C(NC(=O)N1)C(=O)O MCULE-6395275914 [0,0,0,0,0,0|1,0,1]=2 33 B10R1.8 C=CC1=CC(=O)NC(=O)N1 MCULE-7194319105 [1,0,0,0,0,0|1,0,2]=4 34 B10R1.8 CCC1CC(=O)NC(=O)C1 MCULE-5960815996 [1,0,0,0,0,0|2,0,1]=4 35 B10R1.8 O=C1C/C(=N\O)/NC(=O)N1 MCULE-3947010417 [1,0,0,0,0,0|1,0,1]=3 36 B10R1.8 O=C1C=C(NC(=O)N1)CO MCULE-5458955186 [1,0,0,0,0,0|0,0,3]=4 37 B10R1.8 O=C1CC(=O)CC(C1)CO MCULE-2890708656 [1,0,0,0,0,0|2,0,1]=4 38 B10R1.8 O=CC1=CC(=O)NC(=O)N1 MCULE-5989318185 [1,0,0,0,0,0|0,0,2]=3 39 B10R1.8 O=CC1=CC(=O)NC(=S)N1 MCULE-9142470762 [1,0,0,0,0,0|0,1,2]=4 40 B10R1.8 O=CN1CC(=O)NC(=O)C1 MCULE-4664574956 [1,0,0,0,0,0|2,0,0]=3 41 B10R1.113 CC(=O)C1CCNC(=O)C1 MCULE-9774471516 [1,0,0,0,0,0|2,0,1]=4 42 B10R1.113 CC1=NCCC(N1)C(=O)O MCULE-8417553503 [1,0,0,0,0,0|1,0,2]=4 43 B10R1.113 CC1=N[C@@H](CCN1)C(=O)O MCULE-2656568536 [1,0,0,0,0,0|1,0,2]=4 44 B10R1.113 CC1=N[C@@H](CCN1)C(=O)O MCULE-4918579312 [1,0,0,0,0,0|1,0,2]=4 45 B10R1.113 O=C(O)C1CS(=O)CCN1 MCULE-2725116552 [1,0,0,0,0,0|2,0,1]=4 46 B10R1.113 O=C(O)C1CS(=O)CCN1 MCULE-7493333189 [1,0,0,0,0,0|2,0,1]=4 47 B10R1.113 O=C1C=C(C=CN1)C(=O)O MCULE-8873155750 [1,0,0,0,0,0|1,0,2]=4 48 B10R1.113 O=C1C=CCC(C1)C(=O)O MCULE-3511234259 [1,0,0,0,0,0|2,0,0]=3 49 B10R1.113 O=C1C=CN=C(N1)C(=O)O MCULE-1040826314 [1,0,0,0,0,0|2,0,1]=4 50 B10R1.113 O=C1CC(=CC=N1)C(=O)O MCULE-3789271459 [1,0,0,0,0,0|1,0,2]=4 51 B10R1.113 O=C1CC(CCN1)C(=O)O MCULE-8037650535 [1,0,0,0,0,0|1,0,1]=3 52 B10R1.113 O=C1CC(CNN1)C(=O)O MCULE-4653652849 [1,0,0,0,0,0|2,0,0]=3 53 B10R1.113 O=C1CC(CNN1)C(=O)O MCULE-5555795045 [1,0,0,0,0,0|2,0,0]=3 54 B10R1.113 O=C1CCCC(C1)C(=O)O MCULE-6286773194 [1,0,0,0,0,0|2,0,1]=4 55 B10R1.113 O=C1CCCC(N1)C(=O)O MCULE-9444010827 [1,0,0,0,0,0|1,0,1]=3 56 B10R1.113 O=C1CCCC(N1)C(=O)O MCULE-9607599809 [1,0,0,0,0,0|1,0,1]=3 57 B10R1.113 O=C1CCC[C@@H](C1)C(=O)O MCULE-5396925186 [1,0,0,0,0,0|2,0,1]=4 58 B10R1.113 O=C1CCC[C@@H](N1)C(=O)O MCULE-3091454903 [1,0,0,0,0,0|1,0,1]=3 59 B10R1.113 O=C1CCC[C@@H](N1)C(=O)O MCULE-5853502175 [1,0,0,0,0,0|1,0,1]=3 60 B10R1.113 O=C1CCC[C@H](C1)C(=O)O MCULE-8936667281 [1,0,0,0,0,0|2,0,1]=4 61 B10R1.113 O=C1CCC[C@H](N1)C(=O)O MCULE-6509598163 [1,0,0,0,0,0|1,0,1]=3 62 B10R1.113 O=C1CCC[C@H](N1)C(=O)O MCULE-7646943695 [1,0,0,0,0,0|1,0,1]=3 63 B10R1.113 O=C1CCNC(C1)C(=O)O MCULE-6916176336 [1,0,0,0,0,0|1,0,1]=3 64 B10R1.113 O=C1CCNC(C1)C(=O)O MCULE-9262761817 [1,0,0,0,0,0|1,0,1]=3 65 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-1115212106 [1,0,0,0,0,0|1,0,1]=3 66 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-5896394571 [1,0,0,0,0,0|1,0,1]=3 67 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-5937606037 [1,0,0,0,0,0|1,0,1]=3 68 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-7073629862 [1,0,0,0,0,0|1,0,1]=3 69 B10R1.113 O=C1CNCC(N1)C(=O)O MCULE-4117148380 [1,0,0,0,0,0|2,0,0]=3 70 B10R1.113 O=C1CNC[C@@H](N1)C(=O)O MCULE-3006600193 [1,0,0,0,0,0|2,0,0]=3 71 B10R1.113 O=C1CNC[C@H](N1)C(=O)O MCULE-4345470043 [1,0,0,0,0,0|2,0,0]=3 72 B10R1.113 O=C1CSCC(N1)C(=O)O MCULE-7630386798 [1,0,0,0,0,0|2,0,0]=3 73 B10R1.113 O=C1CSC[C@H](N1)C(=O)O MCULE-1412113570 [1,0,0,0,0,0|2,0,0]=3 74 B10R1.113 O=C1C[C@@H](CCN1)C(=O)O MCULE-5205458306 [1,0,0,0,0,0|1,0,1]=3 75 B10R1.113 O=C1C[C@H](CCN1)C(=O)O MCULE-6254957663 [1,0,0,0,0,0|1,0,1]=3 76 B10R1.113 O=C1C[C@H](CCN1)C(=O)O MCULE-9670666580 [1,0,0,0,0,0|1,0,1]=3 77 B10R1.113 O=C1N=CC=C(N1)C(=O)O MCULE-6042406465 [1,0,0,0,0,0|0,0,3]=4 78 B10R1.113 O=C1NC(CCO1)C(=O)O MCULE-4281750243 [1,0,0,0,0,0|1,0,1]=3 79 B10R1.113 O=C1NCCC(N1)C(=O)O MCULE-6196729766 [1,0,0,0,0,0|0,0,1]=2 80 B10R1.113 O=C1NCCC(O1)C(=O)O MCULE-1272116406 [1,0,0,0,0,0|1,0,1]=3 81 B10R1.113 O=C1N[C@@H](CCO1)C(=O)O MCULE-7121690603 [1,0,0,0,0,0|1,0,1]=3 82 B12R1.11 COC1=CC(=O)CC(C1)C(=O)O MCULE-7454705594 [0,1,0,0,0,0|2,0,1]=4 83 B12R1.358 COC(=O)C1=NC(=O)NC(=O)C1 MCULE-6331218405 [0,1,0,0,0,0|0,0,2]=3 84 B12R1.358 COC(=O)C1CC(=O)CC(=O)C1 MCULE-3720845870 [0,1,0,0,0,0|2,0,0]=3 85 B12R1.358 COC(=O)[C@@H]1C[C@@H](NC(=S)N1)C MCULE-3838248245 [0,1,0,0,0,0|1,1,1]=4 86 B12R1.358 O=C1C=C(NC(=O)N1)C(=O)NO MCULE-3155918779 [0,1,0,0,0,0|0,0,2]=3 87 B12R1.511 CC1=C(NC(=O)NC1=O)C(=O)O MCULE-3566351709 [0,1,0,0,0,0|0,0,2]=3 88 B12R1.511 CC1CC(N(C(=S)N1)C)C(=O)O MCULE-8611434336 [0,1,0,0,0,0|1,1,1]=4 89 B12R1.511 NC1=C(NC(=O)NC1=O)C(=O)O MCULE-8801103464 [0,1,0,0,0,0|0,0,2]=3 90 B12R1.511 O=C1NC(=O)C(=C(N1)C(=O)O)F MCULE-2856865842 [0,1,0,0,0,0|0,0,2]=3 91 B12R1.1005 CN1C(=O)C=C(NC1=O)C(=O)O MCULE-3579685567 [0,1,0,0,0,0|0,0,2]=3 92 B12R1.1005 CN1C(=O)CC(NC1=O)C(=O)O MCULE-2446459229 [0,1,0,0,0,0|0,0,0]=1 93 B12R1.1005 CN1C(=O)CC(NC1=O)C(=O)O MCULE-7100531134 [0,1,0,0,0,0|0,0,0]=1 94 B12R1.1005 CN1C(=O)C[C@H](NC1=O)C(=O)O MCULE-6596161512 [0,1,0,0,0,0|0,0,0]=1 95 B12R1.1005 CN1C(=O)C[C@H](NC1=O)C(=O)O MCULE-9696693758 [0,1,0,0,0,0|0,0,0]=1 96 B12R1.3005 O=C1CS(=O)(=O)CC(N1)C(=O)O MCULE-9633141025 [0,1,0,0,0,0|2,0,0]=3 97 B12R1.3005 O=C1CS(=O)(=O)C[C@H](N1)C(=O)O MCULE-4378467096 [0,1,0,0,0,0|2,0,0]=3 98 B10R0.23 C#CCC(NC(=O)C)C(=O)O MCULE-9409389398 [0,0,1,0,0,0|2,0,1]=4 99 B10R0.23 C=CCC(NC(=O)C)C(=O)O MCULE-7609607910 [0,0,1,0,0,0|2,0,0]=3 100 B10R0.23 CC(=O)NC(CCO)C(=O)O MCULE-2399187108 [0,0,1,0,0,0|1,0,2]=4 101 B10R0.23 CC(=O)N[C@@H](CCS)C(=O)O MCULE-9792008044 [0,0,1,0,0,0|1,1,1]=4 102 B10R0.23 CC(C)CC(NC=O)C(=O)O MCULE-2113425622 [0,0,1,0,0,0|2,0,1]=4 103 B10R0.23 CC(C)CC(NC=O)C(=O)O MCULE-2665861320 [0,0,1,0,0,0|2,0,1]=4 104 B10R0.23 CC(C)C[C@@H](NC=O)C(=O)O MCULE-2403549316 [0,0,1,0,0,0|2,0,1]=4 105 B10R0.23 CC(C)C[C@@H](NC=O)C(=O)O MCULE-7982298582 [0,0,1,0,0,0|2,0,1]=4 106 B10R0.23 CC(C)C[C@H](NC=O)C(=O)O MCULE-3604975300 [0,0,1,0,0,0|2,0,1]=4 107 B10R0.23 CC(C)C[C@H](NC=O)C(=O)O MCULE-7489305926 [0,0,1,0,0,0|2,0,1]=4 108 B10R0.23 CCCC(NC(=O)C)C(=O)O MCULE-3719218412 [0,0,1,0,0,0|2,0,1]=4 109 B10R0.23 CCCC(NC(=O)N)C(=O)O MCULE-3451078854 [0,0,1,0,0,0|1,0,1]=3 110 B10R0.23 CCC[C@@H](NC(=O)C)C(=O)O MCULE-7396030806 [0,0,1,0,0,0|2,0,1]=4 111 B10R0.23 CCC[C@@H](NC(=O)C)C(=O)O MCULE-7424603595 [0,0,1,0,0,0|2,0,1]=4 112 B10R0.23 CCC[C@@H](NC(=O)N)C(=O)O MCULE-4836272670 [0,0,1,0,0,0|1,0,1]=3 113 B10R0.23 CCC[C@H](NC(=O)C)C(=O)O MCULE-2905526129 [0,0,1,0,0,0|2,0,1]=4 114 B10R0.23 CCC[C@H](NC(=O)C)C(=O)O MCULE-6395010914 [0,0,1,0,0,0|2,0,1]=4 115 B10R0.23 CNCC(NC(=O)C)C(=O)O MCULE-4047191308 [0,0,1,0,0,0|3,0,0]=4 116 B10R0.23 CNC[C@H](NC(=O)C)C(=O)O MCULE-3833734431 [0,0,1,0,0,0|3,0,0]=4 117 B10R0.23 COCC(NC(=O)C)C(=O)O MCULE-9763122983 [0,0,1,0,0,0|3,0,0]=4 118 B10R0.23 COC[C@@H](NC(=O)C)C(=O)O MCULE-2239598357 [0,0,1,0,0,0|3,0,0]=4 119 B10R0.23 COC[C@@H](NC(=O)C)C(=O)O MCULE-4278788977 [0,0,1,0,0,0|3,0,0]=4 120 B10R0.23 COC[C@H](NC(=O)C)C(=O)O MCULE-5146213386 [0,0,1,0,0,0|3,0,0]=4 121 B10R0.23 CSCC(NC(=O)C)C(=O)O MCULE-8059509909 [0,0,1,0,0,0|3,0,0]=4 122 B10R0.23 CSC[C@H](NC(=O)C)C(=O)O MCULE-1058369746 [0,0,1,0,0,0|3,0,0]=4 123 B10R0.23 O=CNC(CC(=O)O)C(=O)O MCULE-1319737382 [0,0,1,0,0,0|1,0,0]=2 124 B10R0.26 C=CCS(=O)CC(N)C(=O)O MCULE-1644221115 [0,0,1,0,0,0|3,0,0]=4 125 B10R0.26 C=CCS(=O)C[C@H](N)C(=O)O MCULE-5403139844 [0,0,1,0,0,0|3,0,0]=4 126 B10R0.26 C=CCS(=O)C[C@H](N)C(=O)O MCULE-6091538783 [0,0,1,0,0,0|3,0,0]=4 127 B10R0.26 C=CC[S@](=O)C[C@H](N)C(=O)O MCULE-2127698614 [0,0,1,0,0,0|3,0,0]=4 128 B10R0.26 C=CC[S@](=O)C[C@H](N)C(=O)O MCULE-6116290976 [0,0,1,0,0,0|3,0,0]=4 129 B10R0.26 CC=CS(=O)C[C@H](N)C(=O)O MCULE-4397511090 [0,0,1,0,0,0|3,0,0]=4 130 B10R0.26 CCCC(=O)NC(C)C(=O)O MCULE-2171690490 [0,0,1,0,0,0|2,0,1]=4 131 B10R0.26 CCNC(=O)NC(C)C(=O)O MCULE-3484080527 [0,0,1,0,0,0|1,0,1]=3 132 B10R0.26 CCOC(=O)CC(N)C(=O)O MCULE-1325477968 [0,0,1,0,0,0|2,0,1]=4 133 B10R0.26 CCOC(=O)NC(C)C(=O)O MCULE-2656045762 [0,0,1,0,0,0|2,0,1]=4 134 B10R0.26 CCOC(=O)N[C@@H](C)C(=O)O MCULE-7713689747 [0,0,1,0,0,0|2,0,1]=4 135 B10R0.26 COCC(=O)NC(C)C(=O)O MCULE-8358486718 [0,0,1,0,0,0|3,0,0]=4 136 B10R0.96 C(=CC(=O)NC(=O)N)C(=O)O MCULE-4345604400 [0,0,1,0,0,0|0,0,2]=3 137 B10R0.96 C(=C\C(=O)NC(=O)N)\C(=O)O MCULE-8812884630 [0,0,1,0,0,0|0,0,2]=3 138 B10R0.96 CC(=CC(=O)NCC(=O)O)C MCULE-6309709603 [0,0,1,0,0,0|2,0,0]=3 139 B10R0.96 CC(=O)CC(=O)CCC(=O)O MCULE-6445854186 [0,0,1,0,0,0|2,0,0]=3 140 B10R0.96 CC(=O)CC(=O)NCC(=O)O MCULE-8793325864 [0,0,1,0,0,0|1,0,0]=2 141 B10R0.96 CC(C)CC(=O)NCC(=O)O MCULE-8338157738 [0,0,1,0,0,0|2,0,1]=4 142 B10R0.96 CC(C)NC(=O)CCC(=O)O MCULE-6515821068 [0,0,1,0,0,0|2,0,1]=4 143 B10R0.96 CC(C)NC(=O)NCC(=O)O MCULE-6956868357 [0,0,1,0,0,0|1,0,1]=3 144 B10R0.96 CN(C)NC(=O)CCC(=O)O MCULE-6532969482 [0,0,1,0,0,0|3,0,0]=4 145 B12R2.760 [C@@H]12C(=O)NC(=O)[C@@H]1[C@H]2C(=O)O MCULE-3054500179 [0,0,0,1,0,0|1,0,0]=2 146 B10R1.58 CN1CC(CC1=O)C(=O)O MCULE-2604682023 [0,0,0,0,1,0|3,0,0]=4 147 B10R1.58 CN1CC(NC1=O)C(=O)O MCULE-5672121272 [0,0,0,0,1,0|2,0,0]=3 148 B10R1.58 CN1CC(OC1=O)C(=O)O MCULE-1158187923 [0,0,0,0,1,0|3,0,0]=4 149 B10R1.58 CN1C[C@@H](CC1=O)C(=O)O MCULE-4410278134 [0,0,0,0,1,0|3,0,0]=4 150 B10R1.58 CN1C[C@H](NC1=O)C(=O)O MCULE-2436172057 [0,0,0,0,1,0|2,0,0]=3 151 B10R1.58 CN1C[C@H](NC1=O)C(=O)O MCULE-8618404133 [0,0,0,0,1,0|2,0,0]=3 152 B10R1.58 O=C(O)C1CC(=O)N(C1)O MCULE-1951815385 [0,0,0,0,1,0|2,0,1]=4 153 B10R1.58 O=C(O)[C@@H]1C[C@H](C(=O)N1)F MCULE-3594620408 [0,0,0,0,1,0|1,0,1]=3 154 B10R1.58 O=C(O)[C@@H]1C[C@H](C(=O)N1)F MCULE-7616817872 [0,0,0,0,1,0|1,0,1]=3 155 B10R1.58 O=C1NC(CC1F)C(=O)O MCULE-5782471146 [0,0,0,0,1,0|1,0,1]=3 156 B10R1.58 O=C1N[C@@H](C[C@@H]1F)C(=O)O MCULE-5667846232 [0,0,0,0,1,0|1,0,1]=3 157 B10R1.58 O=C1N[C@@H](C[C@@H]1F)C(=O)O MCULE-8319847079 [0,0,0,0,1,0|1,0,1]=3 158 B10R1.59 CC(=C1NC(=O)NC1=O)C MCULE-7822860475 [0,0,0,0,1,0|2,0,1]=4 159 B10R1.59 CC(=O)C1=C(NC(=O)N1)C MCULE-7841084710 [0,0,0,0,1,0|2,0,1]=4 160 B10R1.59 CC(=O)N1CC(=O)NC1=S MCULE-5091396575 [0,0,0,0,1,0|2,1,0]=4 161 B10R1.59 CC(C)C1NC(=O)NC1=O MCULE-7712754409 [0,0,0,0,1,0|2,0,1]=4 162 B10R1.59 CC(O)C1NC(=O)NC1=O MCULE-4079419435 [0,0,0,0,1,0|1,0,1]=3 163 B10R1.59 CC1=C(NC(=O)N1)C(=O)O MCULE-4489172846 [0,0,0,0,1,0|1,0,1]=3 164 B10R1.59 CC1=C(NC(=O)O1)C(=O)O MCULE-3936623227 [0,0,0,0,1,0|2,0,1]=4 165 B10R1.59 CC1=C(SC(=O)N1)C(=O)O MCULE-8001416115 [0,0,0,0,1,0|2,0,1]=4 166 B10R1.59 CC1CC(=O)NC1C(=O)O MCULE-1142843058 [0,0,0,0,1,0|2,0,1]=4 167 B10R1.59 CC1CC(C(=O)O1)C(=O)O MCULE-5538965549 [0,0,0,0,1,0|2,0,1]=4 168 B10R1.59 CC1NC(=O)CC1C(=O)O MCULE-1109266882 [0,0,0,0,1,0|1,0,1]=3 169 B10R1.59 CC1OC(=O)NC1C(=O)O MCULE-7595794618 [0,0,0,0,1,0|2,0,1]=4 170 B10R1.59 CN1NC(=O)CC1C(=O)O MCULE-1720509184 [0,0,0,0,1,0|2,0,0]=3 171 B10R1.59 CN1NC(=O)CC1C(=O)O MCULE-3806344360 [0,0,0,0,1,0|2,0,0]=3 172 B10R1.59 C[C@@H]1CC(=O)N[C@@H]1C(=O)O MCULE-5687745727 [0,0,0,0,1,0|2,0,1]=4 173 B10R1.59 C[C@@H]1CC(=O)N[C@H]1C(=O)O MCULE-3978079245 [0,0,0,0,1,0|2,0,1]=4 174 B10R1.59 C[C@H]1CC(=O)N[C@@H]1C(=O)O MCULE-1352855018 [0,0,0,0,1,0|2,0,1]=4 175 B10R1.59 C[C@H]1CC(=O)N[C@H]1C(=O)O MCULE-6205979547 [0,0,0,0,1,0|2,0,1]=4 176 B10R1.59 N=C1NC(=O)C(S1)C(=O)O MCULE-7409007435 [0,0,0,0,1,0|2,0,0]=3 177 B10R1.59 O=C1CC(C(=O)N1)C(=O)O MCULE-7458355147 [0,0,0,0,1,0|0,0,0]=1 178 B12R1.101 CC(=O)NC1CC(=O)CC(=O)C1 MCULE-9719084203 [0,0,0,0,0,1|3,0,0]=4 179 B12R1.101 CC1CC(NC(=O)N1)NC(=O)N MCULE-7630681056 [0,0,0,0,0,1|2,0,1]=4 180 B12R1.101 C[C@@H]1C[C@H](NC(=S)N1)CC(=O)O MCULE-2996785246 [0,0,0,0,0,1|1,1,1]=4 181 B12R1.101 C[C@@H]1C[C@H](NC(=S)N1)CC(=O)O MCULE-3899093043 [0,0,0,0,0,1|1,1,1]=4 182 B12R1.101 C[C@@H]1C[C@H](NC(=S)N1)CC(=O)O MCULE-9536902752 [0,0,0,0,0,1|1,1,1]=4 183 B12R1.101 NC(=O)CN1CC(=O)NC(=O)C1 MCULE-1096711529 [0,0,0,0,0,1|3,0,0]=4 184 B12R1.101 O=C(Cl)CC1CC(=O)NC(=O)C1 MCULE-5090456153 [0,0,0,0,0,1|2,0,0]=3 185 B12R1.101 O=C(O)CC1=CC(=O)NC(=O)N1 MCULE-1559244599 [0,0,0,0,0,1|0,0,2]=3 186 B12R1.101 O=C(O)CC1CC(=O)NC(=O)C1 MCULE-1687956782 [0,0,0,0,0,1|1,0,0]=2 187 B12R1.101 O=C(O)CC1CC(=O)NC(=O)N1 MCULE-6179754914 [0,0,0,0,0,1|0,0,0]=1 188 B12R1.101 O=C(O)CN1CC(=O)NC(=O)C1 MCULE-6478189605 [0,0,0,0,0,1|2,0,0]=3 189 B12R1.101 O=C(O)CN1CC(=O)OC(=O)C1 MCULE-6278404161 [0,0,0,0,0,1|3,0,0]=4 190 B12R1.101 [C@H]1(CC(NC(=O)N1)C)NC(=O)N MCULE-8535762246 [0,0,0,0,0,1|2,0,1]=4 191 B12R1.1218 O=C1CCC(NC(=O)N1)C(=O)O MCULE-1500901584 [0,0,0,0,0,1|0,0,0]=1 192 B9R0.15 CCCC(NC=O)C(=O)O MCULE-7516123408 [1,0,1,0,0,0|1,0,1]=4 193 B9R0.39 CC(=O)NC(CO)C(=O)O MCULE-1309560741 [1,0,1,0,0,0|1,0,1]=4 194 B9R0.39 CC(=O)NC(CS)C(=O)O MCULE-6378320219 [1,0,1,0,0,0|1,1,0]=4 195 B9R0.39 CC(=O)NC(CS)C(=O)O MCULE-8740981134 [1,0,1,0,0,0|1,1,0]=4 196 B9R0.39 CC(=O)N[C@@H](CO)C(=O)O MCULE-1874809708 [1,0,1,0,0,0|1,0,1]=4 197 B9R0.39 CC(=O)N[C@@H](CO)C(=O)O MCULE-6388016375 [1,0,1,0,0,0|1,0,1]=4 198 B9R0.39 CC(=O)N[C@@H](CS)C(=O)O MCULE-3293270590 [1,0,1,0,0,0|1,1,0]=4 199 B9R0.39 CC(=O)N[C@@H](CS)C(=O)O MCULE-8632971295 [1,0,1,0,0,0|1,1,0]=4 200 B9R0.39 CC(=O)N[C@H](CO)C(=O)O MCULE-3723348697 [1,0,1,0,0,0|1,0,1]=4 201 B9R0.39 CC(=O)N[C@H](CS)C(=O)O MCULE-2338539483 [1,0,1,0,0,0|1,1,0]=4 202 B9R0.39 CC(=O)N[C@H](CS)C(=O)O MCULE-7287452762 [1,0,1,0,0,0|1,1,0]=4 203 B9R0.39 CCC(NC(=O)C)C(=O)O MCULE-1309294109 [1,0,1,0,0,0|1,0,1]=4 204 B9R0.39 CCC(NC(=O)C)C(=O)O MCULE-9698129539 [1,0,1,0,0,0|1,0,1]=4 205 B9R0.39 CCC(NC(=O)N)C(=O)O MCULE-1973871135 [1,0,1,0,0,0|0,0,1]=3 206 B9R0.39 CC[C@@H](NC(=O)C)C(=O)O MCULE-4606830483 [1,0,1,0,0,0|1,0,1]=4 207 B9R0.39 CC[C@@H](NC(=O)C)C(=O)O MCULE-7396715663 [1,0,1,0,0,0|1,0,1]=4 208 B9R0.39 CNC(CC(=O)O)C(=O)O MCULE-5049531079 [1,0,1,0,0,0|1,0,1]=4 209 B9R0.39 CN[C@@H](CC(=O)N)C(=O)O MCULE-2449462396 [1,0,1,0,0,0|0,0,1]=3 210 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O MCULE-4725692041 [1,0,1,0,0,0|1,0,1]=4 211 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O MCULE-6356483886 [1,0,1,0,0,0|1,0,1]=4 212 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O MCULE-9428412153 [1,0,1,0,0,0|1,0,1]=4 213 B9R0.39 CN[C@H](CC(=O)N)C(=O)O MCULE-2092394249 [1,0,1,0,0,0|0,0,1]=3 214 B9R0.39 CN[C@H](CC(=O)O)C(=O)O MCULE-1405442072 [1,0,1,0,0,0|1,0,1]=4 215 B9R0.39 CN[C@H](CC(=O)O)C(=O)O MCULE-8611804669 [1,0,1,0,0,0|1,0,1]=4 216 B9R0.39 CN[C@H](CC(=O)O)C(=O)O MCULE-9080466863 [1,0,1,0,0,0|1,0,1]=4 217 B9R0.39 N=C(N)N[C@@H](CS)C(=O)O MCULE-8761842896 [1,0,1,0,0,0|1,1,0]=4 218 B9R0.39 NC(=O)NC(CO)C(=O)O MCULE-8322024012 [1,0,1,0,0,0|0,0,1]=3 219 B9R0.39 NC(=O)NC(CS)C(=O)O MCULE-3558033323 [1,0,1,0,0,0|0,1,0]=3 220 B9R0.39 NC(=O)N[C@@H](CS)C(=O)O MCULE-9735857877 [1,0,1,0,0,0|0,1,0]=3 221 B9R0.42 C(N)(CC(=O)OC)C(=O)O MCULE-8015036052 [1,0,1,0,0,0|1,0,1]=4 222 B9R0.42 C=CC(=O)NC(O)C(=O)O MCULE-6399920412 [1,0,1,0,0,0|2,0,0]=4 223 B9R0.42 CC(NC(=O)CCl)C(=O)O MCULE-6899086052 [1,0,1,0,0,0|1,0,1]=4 224 B9R0.42 CC(NC(=O)CN)C(=O)O MCULE-2027405418 [1,0,1,0,0,0|1,0,1]=4 225 B9R0.42 CCC(=O)CC(N)C(=O)O MCULE-7167843152 [1,0,1,0,0,0|1,0,1]=4 226 B9R0.42 CCC(=O)CC(N)C(=O)O MCULE-9225518491 [1,0,1,0,0,0|1,0,1]=4 227 B9R0.42 CCC(=O)NC(C)C(=O)O MCULE-5488194337 [1,0,1,0,0,0|1,0,1]=4 228 B9R0.42 CCC(=O)N[C@@H](C)C(=O)O MCULE-5552061501 [1,0,1,0,0,0|1,0,1]=4 229 B9R0.42 CNC(=O)CC(N)C(=O)O MCULE-1910017583 [1,0,1,0,0,0|0,0,1]=3 230 B9R0.42 CNC(=O)CC(N)C(=O)O MCULE-2273353640 [1,0,1,0,0,0|0,0,1]=3 231 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O MCULE-6316771422 [1,0,1,0,0,0|0,0,1]=3 232 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O MCULE-8833942582 [1,0,1,0,0,0|0,0,1]=3 233 B9R0.42 CNC(=O)C[C@H](N)C(=O)O MCULE-7953918935 [1,0,1,0,0,0|0,0,1]=3 234 B9R0.42 CNC(=O)C[C@H](N)C(=O)O MCULE-9595811834 [1,0,1,0,0,0|0,0,1]=3 235 B9R0.42 COC(=O)CC(N)C(=O)O MCULE-1915038693 [1,0,1,0,0,0|1,0,1]=4 236 B9R0.42 COC(=O)CC(N)C(=O)O MCULE-4452484594 [1,0,1,0,0,0|1,0,1]=4 237 B9R0.42 COC(=O)CC(N)C(=O)O MCULE-8573910427 [1,0,1,0,0,0|1,0,1]=4 238 B9R0.42 COC(=O)C[C@@H](N)C(=O)O MCULE-2364792775 [1,0,1,0,0,0|1,0,1]=4 239 B9R0.42 COC(=O)C[C@@H](N)C(=O)O MCULE-3240459376 [1,0,1,0,0,0|1,0,1]=4 240 B9R0.42 COC(=O)C[C@@H](N)C(=O)O MCULE-5997294610 [1,0,1,0,0,0|1,0,1]=4 241 B9R0.42 COC(=O)C[C@@H](N)C(=O)O MCULE-6955235147 [1,0,1,0,0,0|1,0,1]=4 242 B9R0.42 COC(=O)C[C@H](N)C(=O)O MCULE-3838383924 [1,0,1,0,0,0|1,0,1]=4 243 B9R0.42 COC(=O)C[C@H](N)C(=O)O MCULE-4621655906 [1,0,1,0,0,0|1,0,1]=4 244 B9R0.42 COC(=O)C[C@H](N)C(=O)O MCULE-5113413935 [1,0,1,0,0,0|1,0,1]=4 245 B9R0.42 COC(=O)C[C@H](N)C(=O)O MCULE-9857677224 [1,0,1,0,0,0|1,0,1]=4 246 B9R0.42 COC(=O)NC(C)C(=O)O MCULE-9255316794 [1,0,1,0,0,0|1,0,1]=4 247 B9R0.42 COC(=O)N[C@@H](C)C(=O)O MCULE-3970003504 [1,0,1,0,0,0|1,0,1]=4 248 B9R0.42 COC(=O)N[C@@H](C)C(=O)O MCULE-7941497211 [1,0,1,0,0,0|1,0,1]=4 249 B9R0.42 C[C@H](NC(=O)CBr)C(=O)O MCULE-2038149065 [1,0,1,0,0,0|1,0,1]=4 250 B9R0.42 C[C@H](NC(=O)CCl)C(=O)O MCULE-3478867157 [1,0,1,0,0,0|1,0,1]=4 251 B9R0.42 C[C@H](NC(=O)CCl)C(=O)O MCULE-8272505742 [1,0,1,0,0,0|1,0,1]=4 252 B9R0.42 C[C@H](NC(=O)CN)C(=O)O MCULE-2496637228 [1,0,1,0,0,0|1,0,1]=4 253 B9R0.42 NCC(=O)CC(N)C(=O)O MCULE-5617919538 [1,0,1,0,0,0|1,0,1]=4 254 B9R0.42 NCC(=O)CC(N)C(=O)O MCULE-5853178152 [1,0,1,0,0,0|1,0,1]=4 255 B9R0.42 N[C@@H](CC(=O)NO)C(=O)O MCULE-2694436901 [1,0,1,0,0,0|0,0,1]=3 256 B9R0.42 [C@@H](C)(NC(=O)CN)C(=O)O MCULE-7578084271 [1,0,1,0,0,0|1,0,1]=4 257 B9R0.48 CC=CC(=O)NCC(=O)O MCULE-3127874630 [1,0,1,0,0,0|1,0,0]=3 258 B9R0.48 CCCC(=O)NCC(=O)O MCULE-1331310812 [1,0,1,0,0,0|1,0,1]=4 259 B9R0.48 CCNC(=O)CCC(=O)O MCULE-1979773964 [1,0,1,0,0,0|1,0,1]=4 260 B9R0.48 CCNC(=S)NCC(=O)O MCULE-3996581742 [1,0,1,0,0,0|0,1,1]=4 261 B9R0.48 CCOC(=O)NCC(=O)O MCULE-6050328577 [1,0,1,0,0,0|1,0,1]=4 262 B9R0.48 COCC(=O)NCC(=O)O MCULE-2679622476 [1,0,1,0,0,0|2,0,0]=4 263 B9R0.4 CC(=O)CC(=O)NCCO MCULE-5180986682 [1,0,1,0,0,0|1,0,1]=4 264 B9R0.4 NC(=O)NC(=O)CCCCl MCULE-9550011428 [1,0,1,0,0,0|1,0,1]=4 265 B9R0.55 CC(=O)NCCCC(=O)O MCULE-3194803041 [1,0,1,0,0,0|1,0,1]=4 266 B9R0.55 N=C(N)NCCCC(=O)O MCULE-6633038701 [1,0,1,0,0,0|1,0,1]=4 267 B9R0.55 NC(=O)CCCCC(=O)O MCULE-6793890356 [1,0,1,0,0,0|1,0,1]=4 268 B9R0.55 NC(=O)CSCCC(=O)O MCULE-5092203912 [1,0,1,0,0,0|2,0,0]=4 269 B9R0.55 NC(=O)NCCCC(=O)O MCULE-4986363363 [1,0,1,0,0,0|0,0,1]=3 270 B9R0.55 O=C(O)/C=C/CCC(=O)O MCULE-8825957011 [1,0,1,0,0,0|2,0,0]=4 271 B9R0.55 O=C(O)C=CCCC(=O)O MCULE-7591781771 [1,0,1,0,0,0|2,0,0]=4 272 B9R1.34 CC1CC(=O)CC(=O)N1 MCULE-4178844211 [2,0,0,0,0,0|1,0,1]=4 273 B9R1.34 CC1CC(=O)NC(=O)N1 MCULE-2066103800 [2,0,0,0,0,0|0,0,1]=3 274 B9R1.34 CC1CC(=O)NC(=S)N1 MCULE-3560554851 [2,0,0,0,0,0|0,1,1]=4 275 B9R1.34 C[C@H]1CC(=O)CC(=O)N1 MCULE-6238430821 [2,0,0,0,0,0|1,0,1]=4 276 B9R1.34 NC1CC(=O)NC(=O)C1 MCULE-6382091482 [2,0,0,0,0,0|2,0,0]=4 277 B9R1.34 NC1CC(=O)NC(=O)C1 MCULE-9933185634 [2,0,0,0,0,0|2,0,0]=4 278 B9R1.34 O=C1CC(=O)NC(=O)N1 MCULE-3947237773 [2,0,0,0,0,0|0,0,1]=3 279 B9R1.34 O=C1CC(=O)NC(=S)N1 MCULE-6314984434 [2,0,0,0,0,0|0,1,1]=4 280 B11R0.32 C=C(C)CC(NC(=O)C)C(=O)O MCULE-7639004071 [0,1,1,0,0,0|2,0,0]=4 281 B11R0.32 C=C(C)C[C@H](NC(=O)C)C(=O)O MCULE-8601164722 [0,1,1,0,0,0|2,0,0]=4 282 B11R0.32 C=C(C)C[C@H](NC(=O)C)C(=O)O MCULE-8880296601 [0,1,1,0,0,0|2,0,0]=4 283 B11R0.32 CC(=O)NC(CC(=O)N)C(=O)O MCULE-4878635005 [0,1,1,0,0,0|0,0,0]=2 284 B11R0.32 CC(=O)NC(CC(=O)O)C(=O)N MCULE-5157971327 [0,1,1,0,0,0|2,0,0]=4 285 B11R0.32 CC(=O)NC(CC(=O)O)C(=O)O MCULE-8912395007 [0,1,1,0,0,0|1,0,0]=3 286 B11R0.32 CC(=O)NC(CC(=O)[O-])C(=O)[O-] MCULE-4482924233 [0,1,1,0,0,0|1,0,1]=4 287 B11R0.32 CC(=O)N[C@@H](CC(=O)N)C(=O)O MCULE-4594531393 [0,1,1,0,0,0|0,0,0]=2 288 B11R0.32 CC(=O)N[C@@H](CC(=O)O)C(=O)N MCULE-2089104598 [0,1,1,0,0,0|2,0,0]=4 289 B11R0.32 CC(=O)N[C@@H](CC(=O)O)C(=O)N MCULE-2463301038 [0,1,1,0,0,0|2,0,0]=4 290 B11R0.32 CC(=O)N[C@@H](CC(=O)O)C(=O)O MCULE-2346017798 [0,1,1,0,0,0|1,0,0]=3 291 B11R0.32 CC(=O)N[C@@H](CC(=O)O)C(=O)O MCULE-5208660790 [0,1,1,0,0,0|1,0,0]=3 292 B11R0.32 CC(=O)N[C@H](CC(=O)N)C(=O)O MCULE-2258546008 [0,1,1,0,0,0|0,0,0]=2 293 B11R0.32 CC(=O)N[C@H](CC(=O)N)C(=O)O MCULE-5563097482 [0,1,1,0,0,0|0,0,0]=2 294 B11R0.32 CC(C)CC(NC(=O)N)C(=O)O MCULE-3278114292 [0,1,1,0,0,0|1,0,1]=4 295 B11R0.32 CC(C)C[C@H](NC(=O)N)C(=O)O MCULE-3333503554 [0,1,1,0,0,0|1,0,1]=4 296 B11R0.32 N=C(N)NC(CC(=O)O)C(=O)O MCULE-4241233413 [0,1,1,0,0,0|1,0,0]=3 297 B11R0.32 N=C(N)N[C@@H](CC(=O)O)C(=O)O MCULE-5013210070 [0,1,1,0,0,0|1,0,0]=3 298 B11R0.32 N=C(N)N[C@@H](CC(=O)O)C(=O)O MCULE-9253749740 [0,1,1,0,0,0|1,0,0]=3 299 B11R0.32 NC(=O)CC(CC(=O)N)C(=O)N MCULE-2785332198 [0,1,1,0,0,0|2,0,0]=4 300 B11R0.32 NC(=O)CC(NC(=O)N)C(=O)O MCULE-1904738893 [0,1,1,0,0,0|0,0,0]=2 301 B11R0.32 NC(=O)NC(CC(=O)O)C(=O)O MCULE-1014975815 [0,1,1,0,0,0|0,0,0]=2 302 B11R0.32 NC(=O)NC(NC(=O)N)C(=O)O MCULE-5327019203 [0,1,1,0,0,0|1,0,0]=3 303 B11R0.32 NC(=O)N[C@@H](CC(=O)O)C(=O)O MCULE-2523426634 [0,1,1,0,0,0|0,0,0]=2 304 B11R0.32 NC(=O)N[C@@H](CC(=O)O)C(=O)O MCULE-3753948535 [0,1,1,0,0,0|0,0,0]=2 305 B11R0.32 NC(=S)NC(CC(=O)O)C(=O)O MCULE-3942512238 [0,1,1,0,0,0|0,1,0]=3 306 B11R0.32 O=C(O)CC(CC(=O)O)C(=O)O MCULE-6198986604 [0,1,1,0,0,0|2,0,0]=4 307 B11R0.32 [C@@H](CC(=O)N)(NC(=O)C)C(=O)O MCULE-3763271453 [0,1,1,0,0,0|0,0,0]=2 308 B11R0.115 [C@@H](NC(=O)N)(C(=O)O)C(C)CC MCULE-3282905656 [0,1,1,0,0,0|1,0,1]=4 309 B11R0.160 C=CCNC(CC(=O)O)C(=O)O MCULE-9012180055 [0,1,1,0,0,0|2,0,0]=4 310 B11R0.160 CC(=O)N[C@@H](CSN=O)C(=O)O MCULE-4397408409 [0,1,1,0,0,0|2,0,0]=4 311 B11R0.160 CCCCC(NC(=O)N)C(=O)O MCULE-2177545582 [0,1,1,0,0,0|1,0,1]=4 312 B11R0.160 CSCCC(NC(=O)N)C(=O)O MCULE-8995512478 [0,1,1,0,0,0|0,1,1]=4 313 B11R0.160 CSCC[C@H](NC(=O)N)C(=O)O MCULE-5006828039 [0,1,1,0,0,0|0,1,1]=4 314 B11R0.236 C=CCC(NC(=O)OC)C(=O)O MCULE-2603702971 [0,1,1,0,0,0|2,0,0]=4 315 B11R0.236 C=CC[C@H](NC(=O)OC)C(=O)O MCULE-2015140127 [0,1,1,0,0,0|2,0,0]=4 316 B11R0.236 C=CC[C@H](NC(=O)OC)C(=O)O MCULE-3332528356 [0,1,1,0,0,0|2,0,0]=4 317 B11R0.236 CCCC(NC(=O)CN)C(=O)O MCULE-3680152818 [0,1,1,0,0,0|1,0,1]=4 318 B11R0.10 CCNC(=O)NC(C)(C)C(=O)O MCULE-7476059103 [0,1,1,0,0,0|1,0,1]=4 319 B11R0.33 CC(=O)C=C(C)NC(C)C(=O)O MCULE-3998746391 [0,1,1,0,0,0|2,0,0]=4 320 B11R0.33 CC(=O)CC(=O)NC(C)C(=O)O MCULE-3379485569 [0,1,1,0,0,0|1,0,0]=3 321 B11R0.163 C=CCOC(=O)NC(C)C(=O)O MCULE-5846580252 [0,1,1,0,0,0|2,0,0]=4 322 B11R0.163 C=CCOC(=O)N[C@@H](C)C(=O)O MCULE-3290562811 [0,1,1,0,0,0|2,0,0]=4 323 B11R0.163 C=CCOC(=O)N[C@@H](C)C(=O)O MCULE-5879040312 [0,1,1,0,0,0|2,0,0]=4 324 B11R0.187 CCNC(=O)NC(C)C(=O)OC MCULE-9835509085 [0,1,1,0,0,0|1,0,1]=4 325 B11R0.93 COC(=O)NC(=O)/C=C/C(=O)O MCULE-8539850141 [0,1,1,0,0,0|1,0,1]=4 326 B11R0.93 COC(=O)NC(=O)/C=C\C(=O)O MCULE-4931263543 [0,1,1,0,0,0|1,0,1]=4 327 B11R0.93 COC(=O)NC(=O)C=CC(=O)O MCULE-8544069239 [0,1,1,0,0,0|1,0,1]=4 328 B11R0.107 C(=CC(=O)OC)C(=O)NC(=O)N MCULE-2416830576 [0,1,1,0,0,0|0,0,2]=4 329 B11R0.107 COC(=O)CCC(=O)CC(=O)C MCULE-3104868399 [0,1,1,0,0,0|2,0,0]=4 330 B11R0.107 COC(=O)CNC(=O)NC(C)C MCULE-5545124935 [0,1,1,0,0,0|1,0,1]=4 331 B11R0.149 C=C(CC(=O)O)C(=O)NC(=S)N MCULE-8073246543 [0,1,1,0,0,0|0,1,1]=4 332 B11R1.21 CC1SCC(NC1=O)C(=O)O MCULE-5715274470 [1,1,0,0,0,0|2,0,0]=4 333 B11R1.21 CN1CCC(CC1=O)C(=O)O MCULE-7427834297 [1,1,0,0,0,0|1,0,1]=4 334 B11R1.21 CN1CC[C@@H](CC1=O)C(=O)O MCULE-5366315291 [1,1,0,0,0,0|1,0,1]=4 335 B11R1.21 CN1CC[C@@H](CC1=O)C(=O)O MCULE-9736243500 [1,1,0,0,0,0|1,0,1]=4 336 B11R1.23 COC(=O)C1CC(=O)CCN1 MCULE-2957789839 [1,1,0,0,0,0|1,0,1]=4 337 B11R1.23 COC(=O)C1CC(=O)CCN1 MCULE-7628754673 [1,1,0,0,0,0|1,0,1]=4 338 B11R1.23 COC(=O)C1CC=CC(=O)C1 MCULE-9419627516 [1,1,0,0,0,0|2,0,0]=4 339 B11R1.23 COC(=O)C1CCCC(=O)N1 MCULE-8690572370 [1,1,0,0,0,0|1,0,1]=4 340 B11R1.23 COC(=O)C1CCNC(=O)C1 MCULE-4250140902 [1,1,0,0,0,0|1,0,1]=4 341 B11R1.23 COC(=O)C1CNCC(=O)N1 MCULE-4044240233 [1,1,0,0,0,0|2,0,0]=4 342 B11R1.23 COC(=O)C1CNNC(=O)C1 MCULE-8947267618 [1,1,0,0,0,0|2,0,0]=4 343 B11R1.23 COC(=O)[C@@H]1CC(=O)CCN1 MCULE-2526553506 [1,1,0,0,0,0|1,0,1]=4 344 B11R1.23 COC(=O)[C@@H]1CC(=O)CCN1 MCULE-6095368090 [1,1,0,0,0,0|1,0,1]=4 345 B11R1.23 COC(=O)[C@@H]1CNCC(=O)N1 MCULE-2739256690 [1,1,0,0,0,0|2,0,0]=4 346 B11R1.23 COC(=O)[C@@H]1CNCC(=O)N1 MCULE-5386964384 [1,1,0,0,0,0|2,0,0]=4 347 B11R1.23 COC(=O)[C@H]1CCCC(=O)N1 MCULE-8974857056 [1,1,0,0,0,0|1,0,1]=4 348 B11R1.23 COC(=O)[C@H]1CCNC(=O)C1 MCULE-9706628315 [1,1,0,0,0,0|1,0,1]=4 349 B11R1.23 COC(=O)[C@H]1CNCC(=O)N1 MCULE-7434283814 [1,1,0,0,0,0|2,0,0]=4 350 B11R1.23 COC(=O)[C@H]1CNCC(=O)N1 MCULE-9904980974 [1,1,0,0,0,0|2,0,0]=4 351 B11R1.159 CN1C(=O)CCCC1C(=O)O MCULE-2434427513 [1,1,0,0,0,0|1,0,1]=4 352 B11R1.159 CN1C(=O)NCCC1C(=O)O MCULE-7085809876 [1,1,0,0,0,0|0,0,1]=3 353 B11R1.667 CC1(CCNC(=O)C1)C(=O)O MCULE-9095450827 [1,1,0,0,0,0|1,0,1]=4 354 B11R1.226 COC(=O)[C@@H]1C[C@@H](C(=O)N1)O MCULE-1924620912 [0,1,0,0,1,0|0,0,2]=4 355 B11R1.226 COC(=O)[C@@H]1C[C@H](C(=O)N1)O MCULE-6174114389 [0,1,0,0,1,0|0,0,2]=4 356 B11R1.226 COC(=O)[C@@H]1C[C@H](C(=O)N1)O MCULE-7981334019 [0,1,0,0,1,0|0,0,2]=4 357 B11R1.644 CC1(C[C@H](NC1=O)C(=O)O)C MCULE-2222423646 [0,1,0,0,1,0|1,0,1]=4 358 B11R1.672 CN1C(=O)CC(N1C)C(=O)O MCULE-5253315738 [0,1,0,0,1,0|2,0,0]=4 359 B11R1.672 CN1CC(N(C1=O)C)C(=O)O MCULE-3409101701 [0,1,0,0,1,0|2,0,0]=4 360 B11R1.672 CN1C[C@H](N(C1=O)C)C(=O)O MCULE-6289054025 [0,1,0,0,1,0|2,0,0]=4 361 B11R1.672 CN1C[C@H](N(C1=O)C)C(=O)O MCULE-8053584866 [0,1,0,0,1,0|2,0,0]=4 362 B11R1.225 COC(=O)C1=C(NC(=O)C1)C MCULE-7253712012 [0,1,0,0,1,0|1,0,1]=4 363 B11R1.225 COC(=O)C1CC(=O)NN1C MCULE-3617950457 [0,1,0,0,1,0|2,0,0]=4 364 B11R1.225 COC(=O)C1CC(=O)NN1C MCULE-6310118509 [0,1,0,0,1,0|2,0,0]=4 365 B11R1.489 CC1(NC(=O)CC1C(=O)O)C MCULE-1222232931 [0,1,0,0,1,0|1,0,1]=4 366 B13R1.298 C/N=C\1/SC(CC(=O)N1C)C(=O)O MCULE-9733069789 [0,2,0,0,0,0|2,0,0]=4 367 B13R1.298 CN=C1SC(CC(=O)N1C)C(=O)O MCULE-5962049262 [0,2,0,0,0,0|2,0,0]=4 368 B13R1.4789 COC(=O)C1=C(C(=O)NC(=O)N1)Br MCULE-1045979019 [0,2,0,0,0,0|0,0,2]=4 369 B13R1.4789 COC(=O)C1=C(C(=O)NC(=O)N1)C MCULE-8950475704 [0,2,0,0,0,0|0,0,2]=4 370 B13R1.4789 COC(=O)C1=C(C(=O)NC(=O)N1)F MCULE-3835434077 [0,2,0,0,0,0|0,0,2]=4 371 B13R1.4789 COC(=O)C1=C(C(=O)NC(=O)N1)I MCULE-4622643561 [0,2,0,0,0,0|0,0,2]=4 372 B13R1.2811 CN1C(=O)C=C(N(C1=O)C)C(=O)O MCULE-8452202001 [0,2,0,0,0,0|0,0,2]=4 373 B13R1.3255 O=C1NC(=O)C(=C(N1)C(=O)O)CO MCULE-9071491615 [0,2,0,0,0,0|0,0,2]=4 374 B11R1.178 NC(=O)N1CCCC1C(=O)O MCULE-2099814008 [0,0,1,1,0,0|1,0,1]=4 375 B11R1.178 NC(=O)N1CCC[C@H]1C(=O)O MCULE-1581234645 [0,0,1,1,0,0|1,0,1]=4 376 B11R1.178 NC(=O)N1CCC[C@H]1C(=O)O MCULE-2695707693 [0,0,1,1,0,0|1,0,1]=4 377 B11R1.645 CC(=O)NC1CC(=O)OC1=O MCULE-4921755901 [0,0,1,1,0,0|1,0,0]=3 378 B11R1.645 CC(=O)OC1CC(=O)OC1=O MCULE-3977106754 [0,0,1,1,0,0|2,0,0]=4 379 B11R1.645 CC(=O)OC1CC(=O)OC1=O MCULE-6469987872 [0,0,1,1,0,0|2,0,0]=4 380 B11R1.645 CC(=O)O[C@@H]1CC(=O)OC1=O MCULE-3381101532 [0,0,1,1,0,0|2,0,0]=4 381 B11R1.645 CC(=O)O[C@@H]1CC(=O)OC1=O MCULE-5641729076 [0,0,1,1,0,0|2,0,0]=4 382 B11R1.645 CC(=O)O[C@H]1CC(=O)OC1=O MCULE-3939996054 [0,0,1,1,0,0|2,0,0]=4 383 B11R1.645 CC(=O)O[C@H]1CC(=O)OC1=O MCULE-6712017856 [0,0,1,1,0,0|2,0,0]=4 384 B11R1.645 CC(=O)SC1CC(=O)OC1=O MCULE-5304574969 [0,0,1,1,0,0|2,0,0]=4 385 B11R1.645 CC(=O)S[C@H]1CC(=O)OC1=O MCULE-9041670777 [0,0,1,1,0,0|2,0,0]=4 386 B11R1.645 NC(=O)CC1NC(=O)NC1=O MCULE-1318774728 [0,0,1,1,0,0|1,0,0]=3 387 B11R1.645 NC(=O)NC1NC(=O)NC1=O MCULE-1008326286 [0,0,1,1,0,0|2,0,0]=4 388 B11R1.645 NC(=O)N[C@@H]1NC(=O)NC1=O MCULE-5991865685 [0,0,1,1,0,0|2,0,0]=4 389 B11R1.645 O=C(Cl)CC1NC(=O)NC1=O MCULE-7494393064 [0,0,1,1,0,0|2,0,0]=4 390 B11R1.645 O=C(O)CC1CC(=O)OC1=O MCULE-5201948185 [0,0,1,1,0,0|2,0,0]=4 391 B11R1.645 O=C(O)CC1NC(=O)NC1=O MCULE-4472768936 [0,0,1,1,0,0|2,0,0]=4 392 B11R1.645 O=C(O)C[C@@H]1NC(=O)NC1=O MCULE-3659340200 [0,0,1,1,0,0|2,0,0]=4 393 B11R1.645 O=C(O)C[C@@H]1NC(=O)NC1=O MCULE-7657913540 [0,0,1,1,0,0|2,0,0]=4 394 B11R1.35 NC(CC1=CC=CN1)C(=O)O MCULE-2621735129 [0,0,1,1,0,0|2,0,0]=4 395 B11R1.35 NC(CC1=CN=CN1)C(=O)O MCULE-2221977105 [0,0,1,1,0,0|2,0,0]=4 396 B11R1.35 NC(CC1=CN=CN1)C(=O)O MCULE-4252889481 [0,0,1,1,0,0|2,0,0]=4 397 B11R1.35 NC(CC1=NN=CN1)C(=O)O MCULE-9972656521 [0,0,1,1,0,0|2,0,0]=4 398 B11R1.35 N[C@@H](CC1=CN=CN1)C(=O)O MCULE-2087791673 [0,0,1,1,0,0|2,0,0]=4 399 B11R1.35 N[C@H](CC1=CC=CN1)C(=O)O MCULE-8757725265 [0,0,1,1,0,0|2,0,0]=4 400 B11R1.75 O=C(O)CCC1=CC(=O)NO1 MCULE-1230469268 [0,0,1,1,0,0|1,0,1]=4 401 B11R1.75 O=C(O)CCC1=CNC(=O)N1 MCULE-2706002292 [0,0,1,1,0,0|1,0,0]=3 402 B11R1.75 O=C(O)CCC1=CNC(=S)N1 MCULE-3837669031 [0,0,1,1,0,0|1,1,0]=4 403 B11R1.75 O=C(O)CCC1=NNC(=S)N1 MCULE-7271934363 [0,0,1,1,0,0|1,1,0]=4 404 B11R1.348 O=C(O)CNC(=O)NC1CC1 MCULE-8299323551 [0,0,1,1,0,0|1,0,1]=4 405 B11R2.610 C12CCC1C(=O)NC(=O)N2 MCULE-1127606803 [1,0,0,1,0,0|1,0,1]=4 406 B11R2.610 [C@H]12CC[C@H]1NC(=O)NC2=O MCULE-5612691363 [1,0,0,1,0,0|1,0,1]=4 407 B11R2.610 [C@H]12CC[C@H]1NC(=O)NC2=O MCULE-9441655580 [1,0,0,1,0,0|1,0,1]=4 408 B11R2.1378 [C@@H]12C(=O)NC(=O)[C@@H]1[C@H]2CO MCULE-2845953323 [1,0,0,1,0,0|1,0,1]=4 409 B13R2.3742 O=C1NC(=O)C2=C(N1)C(=O)OC2 MCULE-6860464111 [0,1,0,1,0,0|0,0,2]=4 410 B9R0.33 C=CCC(C(=O)O)C(=O)O MCULE-3298515693 [0,0,1,0,1,0|2,0,0]=4 411 B9R0.33 N=C(N)C(NC=O)C(=O)N MCULE-6849626247 [0,0,1,0,1,0|2,0,0]=4 412 B9R0.33 NC(=O)C(NC=O)C(=O)N MCULE-7238062024 [0,0,1,0,1,0|1,0,0]=3 413 B9R0.7 C=C(C)C(=O)NCC(=O)O MCULE-9965285150 [0,0,1,0,1,0|1,0,0]=3 414 B9R0.7 C=C(CCC(=O)O)C(=O)O MCULE-3502029665 [0,0,1,0,1,0|2,0,0]=4 415 B9R0.7 CC(C)C(=O)NCC(=O)O MCULE-8263786936 [0,0,1,0,1,0|1,0,1]=4 416 B9R0.7 CC(Cl)C(=O)NCC(=O)O MCULE-9908034208 [0,0,1,0,1,0|1,0,1]=4 417 B9R0.7 CC(N)C(=O)NCC(=O)O MCULE-5334499783 [0,0,1,0,1,0|1,0,1]=4 418 B9R0.7 CC(S)C(=O)NCC(=O)O MCULE-8593628629 [0,0,1,0,1,0|0,1,1]=4 419 B9R0.7 CN(C)C(=O)NCC(=O)O MCULE-9308369846 [0,0,1,0,1,0|2,0,0]=4 420 B9R0.7 C[C@@H](N)C(=O)NCC(=O)O MCULE-1572586456 [0,0,1,0,1,0|1,0,1]=4 421 B9R0.7 C[C@@H](N)C(=O)NCC(=O)O MCULE-2334963197 [0,0,1,0,1,0|1,0,1]=4 422 B9R0.7 C[C@@H](N)C(=O)NCC(=O)O MCULE-3041567092 [0,0,1,0,1,0|1,0,1]=4 423 B9R0.7 C[C@@H](N)C(=O)NCC(=O)O MCULE-5810433569 [0,0,1,0,1,0|1,0,1]=4 424 B9R0.7 C[C@H](N)C(=O)NCC(=O)O MCULE-1231323853 [0,0,1,0,1,0|1,0,1]=4 425 B9R0.7 C[C@H](N)C(=O)NCC(=O)O MCULE-6793382418 [0,0,1,0,1,0|1,0,1]=4 426 B9R0.7 C[C@H](S)C(=O)NCC(=O)O MCULE-3909668002 [0,0,1,0,1,0|0,1,1]=4 427 B9R0.7 NC(=O)C(N)CCC(=O)O MCULE-7109792615 [0,0,1,0,1,0|1,0,1]=4 428 B9R0.7 NC(=O)C(N)CCC(=O)O MCULE-8741984156 [0,0,1,0,1,0|1,0,1]=4 429 B9R0.7 NC(=O)[C@@H](N)CCC(=O)O MCULE-7404893649 [0,0,1,0,1,0|1,0,1]=4 430 B9R0.7 NC(=O)[C@@H](N)CCC(=O)O MCULE-7580681383 [0,0,1,0,1,0|1,0,1]=4 431 B9R0.7 NC(=O)[C@H](N)CCC(=O)O MCULE-3142698040 [0,0,1,0,1,0|1,0,1]=4 432 B9R0.7 NC(=O)[C@H](N)CCC(=O)O MCULE-3865619229 [0,0,1,0,1,0|1,0,1]=4 433 B9R0.7 NC(=O)[C@H](N)CCC(=O)O MCULE-8184010011 [0,0,1,0,1,0|1,0,1]=4 434 B9R0.7 NC(=O)[C@H](N)CCC(=O)O MCULE-8981731652 [0,0,1,0,1,0|1,0,1]=4 435 B9R0.7 O=C(O)CCC(=O)C(=O)O MCULE-5148157449 [0,0,1,0,1,0|1,0,0]=3 436 B9R0.7 O=C(O)CCC(=O)C(=O)[O-] MCULE-3585102694 [0,0,1,0,1,0|1,0,0]=3 437 B9R0.7 O=C(O)CNC(=O)C(=O)O MCULE-6181171802 [0,0,1,0,1,0|1,0,0]=3 438 B9R0.7 O=C([O-])CCC(=O)C(=O)O MCULE-3931336643 [0,0,1,0,1,0|1,0,1]=4 439 B9R0.7 O=C([O-])CCC(=O)C(=O)[O-] MCULE-2857630880 [0,0,1,0,1,0|1,0,1]=4 440 B9R0.7 O=C([O-])CCC(=O)C(=O)[O-] MCULE-7607570800 [0,0,1,0,1,0|1,0,1]=4 441 B9R0.7 [C@H](N)(CCC(=O)O)C(=O)N MCULE-1881473683 [0,0,1,0,1,0|1,0,1]=4 442 B9R0.53 CC(=O)CC(=O)NC(=O)C MCULE-5043942110 [0,0,1,0,1,0|1,0,0]=3 443 B9R0.53 CC(=O)NC(=O)NC(=O)C MCULE-1033848283 [0,0,1,0,1,0|1,0,0]=3 444 B9R0.53 CC(=O)NC(C)CC(=O)O MCULE-8603148812 [0,0,1,0,1,0|1,0,1]=4 445 B9R0.53 CC(C)NC(=O)CC(=O)O MCULE-6733291485 [0,0,1,0,1,0|1,0,1]=4 446 B9R0.53 CC(CC(=O)O)NC(=O)N MCULE-2917505998 [0,0,1,0,1,0|1,0,1]=4 447 B9R0.53 NC(=O)NC(=O)NC(=O)N MCULE-9269358670 [0,0,1,0,1,0|2,0,0]=4 448 B9R0.53 O=C(O)CC(=O)CC(=O)O MCULE-7760127170 [0,0,1,0,1,0|2,0,0]=4 449 B9R1.22 CCC1NC(=O)NC1=O MCULE-7573161756 [1,0,0,0,1,0|1,0,1]=4 450 B9R1.22 NCC1CC(=O)NC1=O MCULE-4273797051 [1,0,0,0,1,0|1,0,1]=4 451 B9R1.22 NCC1CC(=O)NC1=O MCULE-5127529700 [1,0,0,0,1,0|1,0,1]=4 452 B9R1.22 NCC1NC(=O)NC1=O MCULE-3949033042 [1,0,0,0,1,0|1,0,1]=4 453 B9R1.22 O=C1NC(=O)/C(=C\Br)/N1 MCULE-7888734075 [1,0,0,0,1,0|1,0,1]=4 454 B9R1.22 O=C1NC(=O)C(=CBr)N1 MCULE-4118151888 [1,0,0,0,1,0|1,0,1]=4 455 B9R1.22 O=C1NC(=O)C(N1)CO MCULE-3745105690 [1,0,0,0,1,0|0,0,1]=3 456 B9R1.22 O=C1NC(=O)[C@@H](N1)CO MCULE-4356522352 [1,0,0,0,1,0|0,0,1]=3 457 B9R1.35 C1(CCC(=O)C1)C(=O)O MCULE-7485965564 [1,0,0,0,1,0|1,0,1]=4 458 B9R1.35 C1(CCC(=O)O1)C(=O)O MCULE-6663255579 [1,0,0,0,1,0|1,0,1]=4 459 B9R1.35 NC(=O)C1CCC(=O)N1 MCULE-1717146839 [1,0,0,0,1,0|1,0,1]=4 460 B9R1.35 NC(=O)C1CNC(=O)C1 MCULE-2954653092 [1,0,0,0,1,0|1,0,1]=4 461 B9R1.35 NC(=O)[C@@H]1CCC(=O)N1 MCULE-5928054942 [1,0,0,0,1,0|1,0,1]=4 462 B9R1.35 NC(=O)[C@@H]1CCC(=O)N1 MCULE-8978218986 [1,0,0,0,1,0|1,0,1]=4 463 B9R1.35 O=C(O)C1CSC(=S)N1 MCULE-1769481962 [1,0,0,0,1,0|1,1,0]=4 464 B9R1.35 O=C(O)[C@@H]1CSC(=S)N1 MCULE-3331947152 [1,0,0,0,1,0|1,1,0]=4 465 B9R1.35 O=C(O)[C@@H]1CSC(=S)N1 MCULE-7575485678 [1,0,0,0,1,0|1,1,0]=4 466 B9R1.35 O=C1C=C(NN1)C(=O)O MCULE-2820101826 [1,0,0,0,1,0|0,0,2]=4 467 B9R1.35 O=C1CC(=NN1)C(=O)O MCULE-2135539733 [1,0,0,0,1,0|0,0,2]=4 468 B9R1.35 O=C1CC(CN1)C(=O)O MCULE-2190630193 [1,0,0,0,1,0|0,0,1]=3 469 B9R1.35 O=C1CC(CO1)C(=O)O MCULE-4876585769 [1,0,0,0,1,0|1,0,1]=4 470 B9R1.35 O=C1CC(CS1)C(=O)O MCULE-5763665475 [1,0,0,0,1,0|1,0,1]=4 471 B9R1.35 O=C1CC(NN1)C(=O)O MCULE-3197471189 [1,0,0,0,1,0|0,0,0]=2 472 B9R1.35 O=C1CCC(C1)C(=O)O MCULE-8715651663 [1,0,0,0,1,0|1,0,1]=4 473 B9R1.35 O=C1CCC(N1)C(=O)Cl MCULE-7943877958 [1,0,0,0,1,0|1,0,1]=4 474 B9R1.35 O=C1CCC(N1)C(=O)O MCULE-4175874303 [1,0,0,0,1,0|0,0,1]=3 475 B9R1.35 O=C1CCC(N1)C(=O)O MCULE-9028773140 [1,0,0,0,1,0|0,0,1]=3 476 B9R1.35 O=C1CCC(N1)C(=O)[O-] MCULE-1554748470 [1,0,0,0,1,0|0,0,2]=4 477 B9R1.35 O=C1CCC(O1)C(=O)O MCULE-1992756541 [1,0,0,0,1,0|1,0,1]=4 478 B9R1.35 O=C1CCC(S1)C(=O)O MCULE-8929436839 [1,0,0,0,1,0|1,0,1]=4 479 B9R1.35 O=C1CC[C@@H](C1)C(=O)O MCULE-1554776363 [1,0,0,0,1,0|1,0,1]=4 480 B9R1.35 O=C1CC[C@@H](C1)C(=O)O MCULE-4649943680 [1,0,0,0,1,0|1,0,1]=4 481 B9R1.35 O=C1CC[C@@H](N1)C(=O)O MCULE-5900221010 [1,0,0,0,1,0|0,0,1]=3 482 B9R1.35 O=C1CC[C@@H](N1)C(=O)O MCULE-8170238114 [1,0,0,0,1,0|0,0,1]=3 483 B9R1.35 O=C1CC[C@@H](O1)C(=O)O MCULE-1446049605 [1,0,0,0,1,0|1,0,1]=4 484 B9R1.35 O=C1CC[C@@H](O1)C(=O)O MCULE-6745317325 [1,0,0,0,1,0|1,0,1]=4 485 B9R1.35 O=C1CC[C@H](C1)C(=O)O MCULE-6597072682 [1,0,0,0,1,0|1,0,1]=4 486 B9R1.35 O=C1CC[C@H](C1)C(=O)O MCULE-7880064966 [1,0,0,0,1,0|1,0,1]=4 487 B9R1.35 O=C1CC[C@H](N1)C(=O)O MCULE-4204877494 [1,0,0,0,1,0|0,0,1]=3 488 B9R1.35 O=C1CC[C@H](N1)C(=O)O MCULE-4908547112 [1,0,0,0,1,0|0,0,1]=3 489 B9R1.35 O=C1CC[C@H](N1)C(=O)O MCULE-6422141688 [1,0,0,0,1,0|0,0,1]=3 490 B9R1.35 O=C1CC[C@H](N1)C(=O)[O-] MCULE-2892153827 [1,0,0,0,1,0|0,0,2]=4 491 B9R1.35 O=C1CC[C@H](N1)C(=O)[O-] MCULE-8083669516 [1,0,0,0,1,0|0,0,2]=4 492 B9R1.35 O=C1CC[C@H](O1)C(=O)O MCULE-5669975621 [1,0,0,0,1,0|1,0,1]=4 493 B9R1.35 O=C1CC[C@H](O1)C(=O)O MCULE-7113736527 [1,0,0,0,1,0|1,0,1]=4 494 B9R1.35 O=C1CC[C@H](S1)C(=O)O MCULE-4843749267 [1,0,0,0,1,0|1,0,1]=4 495 B9R1.35 O=C1CNC(C1)C(=O)O MCULE-7418065190 [1,0,0,0,1,0|0,0,1]=3 496 B9R1.35 O=C1CNC(C1)C(=O)O MCULE-7697956784 [1,0,0,0,1,0|0,0,1]=3 497 B9R1.35 O=C1CNC(C1)C(=O)O MCULE-9520720032 [1,0,0,0,1,0|0,0,1]=3 498 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-2573903934 [1,0,0,0,1,0|0,0,1]=3 499 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-3585746586 [1,0,0,0,1,0|0,0,1]=3 500 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-4771747932 [1,0,0,0,1,0|0,0,1]=3 501 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-4795592072 [1,0,0,0,1,0|0,0,1]=3 502 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-6928857625 [1,0,0,0,1,0|0,0,1]=3 503 B9R1.35 O=C1COC(C1)C(=O)O MCULE-4720798204 [1,0,0,0,1,0|1,0,1]=4 504 B9R1.35 O=C1CSC(C1)C(=O)O MCULE-3309649635 [1,0,0,0,1,0|1,0,1]=4 505 B9R1.35 O=C1C[C@@H](CN1)C(=O)O MCULE-5673992530 [1,0,0,0,1,0|0,0,1]=3 506 B9R1.35 O=C1C[C@@H](CN1)C(=O)O MCULE-8443757903 [1,0,0,0,1,0|0,0,1]=3 507 B9R1.35 O=C1C[C@H](CN1)C(=O)O MCULE-1024601569 [1,0,0,0,1,0|0,0,1]=3 508 B9R1.35 O=C1C[C@H](CN1)C(=O)O MCULE-4280238532 [1,0,0,0,1,0|0,0,1]=3 509 B9R1.35 O=C1NC(=CO1)C(=O)O MCULE-2610586771 [1,0,0,0,1,0|1,0,1]=4 510 B9R1.35 O=C1NC(=CS1)C(=O)O MCULE-6848220699 [1,0,0,0,1,0|1,0,1]=4 511 B9R1.35 O=C1NC(CO1)C(=O)O MCULE-5946769187 [1,0,0,0,1,0|1,0,0]=3 512 B9R1.35 O=C1NC(CS1)C(=O)O MCULE-4574359237 [1,0,0,0,1,0|1,0,0]=3 513 B9R1.35 O=C1NC=C(N1)C(=O)O MCULE-2879870126 [1,0,0,0,1,0|0,0,1]=3 514 B9R1.35 O=C1NC=C(O1)C(=O)O MCULE-1855563319 [1,0,0,0,1,0|1,0,1]=4 515 B9R1.35 O=C1NCC(N1)C(=O)O MCULE-5872947769 [1,0,0,0,1,0|0,0,0]=2 516 B9R1.35 O=C1NCC(O1)C(=O)O MCULE-2773613806 [1,0,0,0,1,0|1,0,0]=3 517 B9R1.35 O=C1NC[C@@H](N1)C(=O)O MCULE-3499982275 [1,0,0,0,1,0|0,0,0]=2 518 B9R1.35 O=C1NC[C@@H](N1)C(=O)O MCULE-9995046216 [1,0,0,0,1,0|0,0,0]=2 519 B9R1.35 O=C1NC[C@H](N1)C(=O)O MCULE-2524102915 [1,0,0,0,1,0|0,0,0]=2 520 B9R1.35 O=C1NC[C@H](N1)C(=O)O MCULE-5992511798 [1,0,0,0,1,0|0,0,0]=2 521 B9R1.35 O=C1NC[C@H](O1)C(=O)O MCULE-5972751457 [1,0,0,0,1,0|1,0,0]=3 522 B9R1.35 O=C1NC[C@H](O1)C(=O)O MCULE-6879191654 [1,0,0,0,1,0|1,0,0]=3 523 B9R1.35 O=C1N[C@@H](CO1)C(=O)O MCULE-2786614278 [1,0,0,0,1,0|1,0,0]=3 524 B9R1.35 O=C1N[C@@H](CO1)C(=O)O MCULE-8589745511 [1,0,0,0,1,0|1,0,0]=3 525 B9R1.35 O=C1N[C@@H](CS1)C(=O)O MCULE-8232416107 [1,0,0,0,1,0|1,0,0]=3 526 B9R1.35 O=C1N[C@@H](CS1)C(=O)O MCULE-9439896780 [1,0,0,0,1,0|1,0,0]=3 527 B9R1.35 O=C1N[C@H](CO1)C(=O)O MCULE-3716829138 [1,0,0,0,1,0|1,0,0]=3 528 B9R1.35 O=C1N[C@H](CO1)C(=O)O MCULE-9300998688 [1,0,0,0,1,0|1,0,0]=3 529 B9R1.35 O=C1N[C@H](CS1)C(=O)O MCULE-3120744944 [1,0,0,0,1,0|1,0,0]=3 530 B9R1.35 O=C1OCC(O1)C(=O)O MCULE-2772637927 [1,0,0,0,1,0|2,0,0]=4 531 B9R1.41 O=C(O)C1CCCC1=O MCULE-9500236289 [1,0,0,0,1,0|1,0,1]=4 532 B9R1.41 O=C(O)C1CCNC1=O MCULE-3110303122 [1,0,0,0,1,0|0,0,1]=3 533 B9R1.41 O=C(O)C1CCOC1=O MCULE-1545162383 [1,0,0,0,1,0|1,0,1]=4 534 B9R1.41 O=C(O)C1CSCC1=O MCULE-2401489071 [1,0,0,0,1,0|2,0,0]=4 535 B9R1.41 O=C(O)N1CCNC1=O MCULE-2423498210 [1,0,0,0,1,0|1,0,1]=4 536 B9R1.41 O=C(O)[C@@H]1CCNC1=O MCULE-2092808645 [1,0,0,0,1,0|0,0,1]=3 537 B9R1.55 CN1CC(C1=O)C(=O)O MCULE-5592777830 [0,0,0,0,2,0|2,0,0]=4 538 B11R0.146 NC(=O)CCC(NC=O)C(=O)O MCULE-5875375171 [0,0,1,0,0,1|0,0,0]=2 539 B11R0.146 [C@@H](CCC(=O)N)(NCC)C(=O)O MCULE-6210892228 [0,0,1,0,0,1|1,0,1]=4 540 B11R0.141 CCNC(=O)CCC(N)C(=O)O MCULE-6282658853 [0,0,1,0,0,1|1,0,1]=4 541 B11R0.141 CCNC(=O)CC[C@@H](N)C(=O)O MCULE-8097322594 [0,0,1,0,0,1|1,0,1]=4 542 B11R0.141 CCNC(=O)CC[C@H](N)C(=O)O MCULE-6143390139 [0,0,1,0,0,1|1,0,1]=4 543 B11R0.141 CCNC(=O)CC[C@H](N)C(=O)O MCULE-9231004806 [0,0,1,0,0,1|1,0,1]=4 544 B11R0.141 [C@@H](N)(CSC(=O)NCC)C(=O)O MCULE-7164915455 [0,0,1,0,0,1|1,0,1]=4 545 B11R0.6 CC(C)NC(=O)NOCC(=O)O MCULE-9122305549 [0,0,1,0,0,1|1,0,1]=4 546 B11R0.85 CC(=NNC(=O)N)CCC(=O)O MCULE-6610092193 [0,0,1,0,0,1|1,0,0]=3 547 B11R0.85 CC(=O)CCC(=O)CCC(=O)O MCULE-5526835762 [0,0,1,0,0,1|2,0,0]=4 548 B11R0.85 CC(=O)CNC(=O)C=CC(=O)O MCULE-1544224383 [0,0,1,0,0,1|1,0,1]=4 549 B11R0.85 CC(=O)NCC(=O)NCC(=O)N MCULE-8528768403 [0,0,1,0,0,1|1,0,0]=3 550 B11R0.85 CC(=O)NCC(=O)NCC(=O)O MCULE-6060663104 [0,0,1,0,0,1|0,0,0]=2 551 B11R0.85 CC(=O)NNC(=O)CCC(=O)O MCULE-6110144216 [0,0,1,0,0,1|1,0,0]=3 552 B11R0.85 CC(C)CNC(=O)NCC(=O)O MCULE-3206648590 [0,0,1,0,0,1|1,0,1]=4 553 B11R0.85 NC(=O)CNC(=O)CCC(=O)O MCULE-2519011568 [0,0,1,0,0,1|0,0,0]=2 554 B11R0.85 NC(=O)NCC(=O)NCC(=O)O MCULE-8988908057 [0,0,1,0,0,1|1,0,0]=3 555 B11R0.85 O=C(O)/C=C\C(=O)NCC(=O)O MCULE-3953932840 [0,0,1,0,0,1|2,0,0]=4 556 B11R0.85 O=C(O)C=CC(=O)NCC(=O)O MCULE-5371397078 [0,0,1,0,0,1|2,0,0]=4 557 B11R0.85 O=C(O)CCC(=O)CCC(=O)O MCULE-2914369907 [0,0,1,0,0,1|2,0,0]=4 558 B11R0.85 O=C(O)CCC(=O)NCC(=O)O MCULE-7360241516 [0,0,1,0,0,1|1,0,0]=3 559 B11R1.157 O=C(O)CC1CCCC(=O)N1 MCULE-7470301343 [1,0,0,0,0,1|1,0,1]=4 560 B11R1.157 O=C(O)CC1CCNC(=O)C1 MCULE-3498688720 [1,0,0,0,0,1|1,0,1]=4 561 B11R1.157 O=C(O)CC1CCNC(=O)C1 MCULE-8598228573 [1,0,0,0,0,1|1,0,1]=4 562 B11R1.565 O=C1CCC(CCN1)C(=O)O MCULE-3530109531 [1,0,0,0,0,1|1,0,1]=4 563 B11R1.166 CC(=O)C1=CNC(=O)NC1=O MCULE-1649935554 [0,0,0,0,1,1|1,0,1]=4 564 B11R1.166 CC1=C(CCC(=O)N1)C(=O)O MCULE-5062338511 [0,0,0,0,1,1|1,0,1]=4 565 B11R1.166 O=C(O)C1=CNC(=S)NC1=O MCULE-9382232313 [0,0,0,0,1,1|0,1,1]=4 566 B11R1.166 O=C(O)C1=NNC(=S)NC1=O MCULE-9506486920 [0,0,0,0,1,1|0,1,1]=4