0 B8R0.2 CCC(C)C(=O)C(=O)O HY-113063 [1,0,0,0,0,0|2,0,1]=4 1 B8R0.2 CCC(C)C(=O)C(=O)O HY-113063R [1,0,0,0,0,0|2,0,1]=4 2 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O HY-78912 [1,0,0,0,0,0|1,0,0]=2 3 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O HY-N0771 [1,0,0,0,0,0|1,0,0]=2 4 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O HY-W012706 [1,0,0,0,0,0|1,0,0]=2 5 B8R0.2 CC[C@H](C)[C@H]([15NH2])C(=O)O HY-N0771S2 [1,0,0,0,0,0|1,0,0]=2 6 B8R0.2 O=C(O)[C@H](O)[C@@H](O)CO HY-134240 [1,0,0,0,0,0|2,0,0]=3 7 B8R0.2 O=C(O)[C@H](O)[C@@H](O)CO HY-W009208 [1,0,0,0,0,0|2,0,0]=3 8 B8R0.2 [C@@H](N)(C(=O)O)[C@@H](C)OC HY-W008464 [1,0,0,0,0,0|2,0,0]=3 9 B8R0.5 CCCC(O)CC(=O)O HY-113836 [1,0,0,0,0,0|1,0,0]=2 10 B8R0.8 C#CCC[C@H](N)C(=O)O HY-140345 [1,0,0,0,0,0|1,0,1]=3 11 B8R0.8 CCCCC(C)C(=O)O HY-128371 [1,0,0,0,0,0|2,0,0]=3 12 B8R0.8 CCCCC(N)C(=O)O HY-W012709 [1,0,0,0,0,0|1,0,0]=2 13 B8R0.8 CCCCC(O)C(=O)O HY-75954 [1,0,0,0,0,0|2,0,0]=3 14 B8R0.8 CCCC[C@@H](N)C(=O)O HY-41912A [1,0,0,0,0,0|1,0,0]=2 15 B8R0.8 CCCC[C@H](N)C(=O)O HY-Y0017 [1,0,0,0,0,0|1,0,0]=2 16 B8R0.8 CSCCC(N)C(=O)O HY-N0325 [1,0,0,0,0,0|2,0,0]=3 17 B8R0.8 CSCCC(O)C(=O)O HY-116688 [1,0,0,0,0,0|3,0,0]=4 18 B8R0.8 CSCC[C@@H](N)C(=O)O HY-13694 [1,0,0,0,0,0|2,0,0]=3 19 B8R0.8 CSCC[C@H](N)C(=O)O HY-N0326 [1,0,0,0,0,0|2,0,0]=3 20 B8R0.8 CSCC[C@H](N)C(=O)O HY-N0326R [1,0,0,0,0,0|2,0,0]=3 21 B8R0.8 CSCC[C@H](N)C(N)=O HY-W016256 [1,0,0,0,0,0|3,0,0]=4 22 B8R0.8 CSCC[C@H](N)[13C](=O)O HY-N0326S4 [1,0,0,0,0,0|2,0,0]=3 23 B8R0.8 CSCC[C@H]([15NH2])C(=O)O HY-N0326S [1,0,0,0,0,0|2,0,0]=3 24 B8R0.8 C[Se]CCC(N)C(=O)O HY-B1000 [1,0,0,0,0,0|2,0,0]=3 25 B8R0.8 C[Se]CCC(N)C(=O)O HY-B1000R [1,0,0,0,0,0|2,0,0]=3 26 B8R0.8 C[Se]CC[C@H](N)C(=O)O HY-B1000A [1,0,0,0,0,0|2,0,0]=3 27 B8R0.8 NCCCC(N)C(=O)O HY-B1713A [1,0,0,0,0,0|0,0,0]=1 28 B8R0.8 NCCC[C@@H](N)C(=O)O HY-34516 [1,0,0,0,0,0|0,0,0]=1 29 B8R0.8 NCCC[C@H](N)C(=O)O HY-A0282 [1,0,0,0,0,0|0,0,0]=1 30 B8R0.8 NCCC[C@H](N)C(=O)O HY-B1352 [1,0,0,0,0,0|0,0,0]=1 31 B8R0.8 [C@H](N)(CCCN)C(=O)O HY-W017018 [1,0,0,0,0,0|0,0,0]=1 32 B8R0.8 [C@H](N)(CCCN)C(=O)O HY-W017018B [1,0,0,0,0,0|0,0,0]=1 33 B8R0.8 [C@H](N)(CCCN)C(=O)O HY-W017018R [1,0,0,0,0,0|0,0,0]=1 34 B8R0.8 [N-]=[N+]=NC[C@@H](N)C(=O)O HY-151642 [1,0,0,0,0,0|2,0,1]=4 35 B8R0.8 [N-]=[N+]=NC[C@@H](N)C(=O)O HY-151642A [1,0,0,0,0,0|2,0,1]=4 36 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O HY-W336328 [1,0,0,0,0,0|2,0,1]=4 37 B10R0.56 [2H]C(=O)[C@@H](O)[C@H](O)[C@H](O)CO HY-N2353S1 [0,1,0,0,0,0|3,0,0]=4 38 B10R1.23 NC(C(=O)O)C1CCCC1 HY-W040803 [0,0,0,1,0,0|2,0,0]=3 39 B10R1.61 O=C(O)C1CCCCN1O HY-N7378 [0,0,0,1,0,0|3,0,0]=4 40 B7R0.2 CCC(C)CC(=O)O HY-W010513 [2,0,0,0,0,0|1,0,0]=3 41 B7R0.2 CCC(C)CC(=O)O HY-W010513R [2,0,0,0,0,0|1,0,0]=3 42 B7R0.2 CCC(O)CC(=O)O HY-113004 [2,0,0,0,0,0|0,0,0]=2 43 B7R0.2 NCC(O)CC(=O)O HY-B1427 [2,0,0,0,0,0|0,0,0]=2 44 B7R0.2 N[C@@H](CO)CC(=O)O HY-W006063 [2,0,0,0,0,0|2,0,0]=4 45 B7R0.5 C#CCC(N)C(=O)O HY-W040124 [2,0,0,0,0,0|0,0,2]=4 46 B7R0.5 C=CC[C@H](N)C(=O)O HY-W015595 [2,0,0,0,0,0|0,0,2]=4 47 B7R0.5 CCCC(=O)C(=O)O HY-113098 [2,0,0,0,0,0|1,0,1]=4 48 B7R0.5 CCCC(C)C(=O)O HY-W010516 [2,0,0,0,0,0|1,0,0]=3 49 B7R0.5 CCCC(N)C(=O)O HY-W010510 [2,0,0,0,0,0|0,0,0]=2 50 B7R0.5 CCC[C@@H](N)C(=O)O HY-41309 [2,0,0,0,0,0|0,0,0]=2 51 B7R0.5 CCC[C@H](N)C(=O)O HY-Y0399 [2,0,0,0,0,0|0,0,0]=2 52 B7R0.5 CNC[C@H](N)C(=O)O HY-W015546 [2,0,0,0,0,0|1,0,0]=3 53 B7R0.5 CSC[C@H](N)C(=O)O HY-B2188 [2,0,0,0,0,0|1,0,0]=3 54 B7R0.5 C[Se]C[C@H](N)C(=O)O HY-114245 [2,0,0,0,0,0|1,0,0]=3 55 B7R0.5 N#CC[C@H](N)C(=O)O HY-125773 [2,0,0,0,0,0|0,0,2]=4 56 B7R0.5 NC(CCO)C(=O)O HY-W012870 [2,0,0,0,0,0|1,0,0]=3 57 B7R0.5 NC(CCS)C(=O)O HY-W040821 [2,0,0,0,0,0|1,0,0]=3 58 B7R0.5 NCC[C@H](N)C(=O)O HY-101414 [2,0,0,0,0,0|0,0,0]=2 59 B7R0.5 NCC[C@H](N)C(=O)O HY-101414A [2,0,0,0,0,0|0,0,0]=2 60 B7R0.5 N[C@@H](CCO)C(=O)O HY-W002292 [2,0,0,0,0,0|1,0,0]=3 61 B7R0.5 N[C@@H](CCO)C(=O)O HY-W002292R [2,0,0,0,0,0|1,0,0]=3 62 B7R0.5 N[C@@H](CCS)C(=O)O HY-W010347 [2,0,0,0,0,0|1,0,0]=3 63 B7R0.5 N[C@@H](CCS)C(=O)O HY-W010347R [2,0,0,0,0,0|1,0,0]=3 64 B7R0.5 N[C@H](CCO)C(=O)O HY-W010499 [2,0,0,0,0,0|1,0,0]=3 65 B7R0.5 [C@@H](N)(CC=C)C(=O)O HY-W012907 [2,0,0,0,0,0|0,0,2]=4 66 B7R0.5 [C@H](N)(CCN)C(=O)O HY-W010018 [2,0,0,0,0,0|0,0,0]=2 67 B7R0.10 O=C[C@H](O)[C@H](O)CO HY-116956 [2,0,0,0,0,0|2,0,0]=4 68 B7R0.10 [C@H](C)(CC)[C@H](N)CO HY-W015875 [2,0,0,0,0,0|1,0,1]=4 69 B7R0.16 CC(C)C(N)C(=O)O HY-W012889 [2,0,0,0,0,0|1,0,0]=3 70 B7R0.16 CC(C)C(O)C(=O)O HY-W008150 [2,0,0,0,0,0|2,0,0]=4 71 B7R0.16 CC(C)[C@@H](N)C(=O)O HY-N0717A [2,0,0,0,0,0|1,0,0]=3 72 B7R0.16 CC(C)[C@H](N)C(=O)O HY-N0717 [2,0,0,0,0,0|1,0,0]=3 73 B7R0.16 CC(C)[C@H](N)C(=O)O HY-N0717R [2,0,0,0,0,0|1,0,0]=3 74 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O HY-W001959 [2,0,0,0,0,0|0,0,0]=2 75 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O HY-N0658 [2,0,0,0,0,0|0,0,0]=2 76 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O HY-N0658A [2,0,0,0,0,0|0,0,0]=2 77 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O HY-N0658R [2,0,0,0,0,0|0,0,0]=2 78 B7R0.16 C[C@@H](O)[C@H]([15NH2])C(=O)O HY-N0658S [2,0,0,0,0,0|0,0,0]=2 79 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O HY-W012874 [2,0,0,0,0,0|0,0,0]=2 80 B7R0.16 NC(C(=O)O)C(=O)O HY-112052 [2,0,0,0,0,0|1,0,1]=4 81 B7R0.16 [C@@H](C)(O)[C@H](N)C(=O)O HY-W008315 [2,0,0,0,0,0|0,0,0]=2 82 B7R0.16 [C@@H](C)(O)[C@H](N)C(=O)O HY-W008315R [2,0,0,0,0,0|0,0,0]=2 83 B7R0.4 C#CCCCC(=O)O HY-Y0925 [2,0,0,0,0,0|1,0,1]=4 84 B7R0.4 NCCCCC(=O)O HY-W015878 [2,0,0,0,0,0|0,0,0]=2 85 B7R0.4 NCCOCC(=O)O HY-140643 [2,0,0,0,0,0|1,0,0]=3 86 B7R0.4 NCCOCC(=O)O HY-140644 [2,0,0,0,0,0|1,0,0]=3 87 B7R0.4 O=C(Cl)CCCCBr HY-43538 [2,0,0,0,0,0|2,0,0]=4 88 B7R0.4 O=C(O)CCCCBr HY-W016456 [2,0,0,0,0,0|1,0,0]=3 89 B7R0.4 O=C(O)COCCBr HY-130163 [2,0,0,0,0,0|2,0,0]=4 90 B7R0.4 O=C(O)COCCS HY-140730 [2,0,0,0,0,0|2,0,0]=4 91 B9R0.27 CC[C@H](C)[C@H](N)C(=O)OC HY-W016423 [1,1,0,0,0,0|1,0,0]=3 92 B9R0.79 CC(O)[C@H](C)[C@H](N)C(=O)O HY-N6858 [1,1,0,0,0,0|1,0,0]=3 93 B9R0.79 C[C@H](O)[C@H](C)[C@H](N)C(=O)O HY-W010271 [1,1,0,0,0,0|1,0,0]=3 94 B9R0.34 CCCC(O)CC(=O)OC HY-116632 [1,1,0,0,0,0|1,0,0]=3 95 B9R0.7 CS(=O)CCC(N)C(=O)O HY-W010104A [1,1,0,0,0,0|2,0,0]=4 96 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O HY-129770 [1,1,0,0,0,0|2,0,0]=4 97 B9R0.7 C[S+](C)CCC(N)C(=O)O HY-N6655 [1,1,0,0,0,0|2,0,0]=4 98 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O HY-N2551 [1,1,0,0,0,0|2,0,0]=4 99 B9R0.7 NC(=O)CCC(N)C(=O)O HY-B1346 [1,1,0,0,0,0|0,0,1]=3 100 B9R0.7 NC(=O)CC[C@@H](N)C(=O)O HY-100587 [1,1,0,0,0,0|0,0,1]=3 101 B9R0.7 NC(=O)CC[C@H](N)C(=O)O HY-N0390 [1,1,0,0,0,0|0,0,1]=3 102 B9R0.7 NC(=O)CC[C@H](N)C(=O)O HY-N0390R [1,1,0,0,0,0|0,0,1]=3 103 B9R0.7 NC(=O)CC[C@H]([15NH2])C(=O)O HY-N0390S [1,1,0,0,0,0|0,0,1]=3 104 B9R0.7 NC(=O)NC[C@H](N)C(=O)O HY-121167 [1,1,0,0,0,0|1,0,1]=4 105 B9R0.7 NC(CCC(=O)O)C(=O)O HY-W010108 [1,1,0,0,0,0|1,0,1]=4 106 B9R0.7 NC(CCC(=O)O)C(=O)O HY-W041895 [1,1,0,0,0,0|1,0,1]=4 107 B9R0.7 N[13C@@H]([13CH2][13CH2][13C](=O)O)[13C](=O)O HY-14608S5 [1,1,0,0,0,0|1,0,1]=4 108 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O HY-112111 [1,1,0,0,0,0|1,0,1]=4 109 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O HY-14608 [1,1,0,0,0,0|1,0,1]=4 110 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O HY-14608R [1,1,0,0,0,0|1,0,1]=4 111 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O HY-W016319 [1,1,0,0,0,0|1,0,1]=4 112 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O HY-W419700 [1,1,0,0,0,0|1,0,1]=4 113 B9R0.7 N[C@@H](CCC(=O)O)[13C](=O)O HY-14608S1 [1,1,0,0,0,0|1,0,1]=4 114 B9R0.7 N[C@H](CCC(=O)O)C(=O)O HY-100805 [1,1,0,0,0,0|1,0,1]=4 115 B9R0.7 N[C@H](CCC(=O)O)C(=O)O HY-100805R [1,1,0,0,0,0|1,0,1]=4 116 B9R0.7 [15NH2][C@@H](CCC(=O)O)C(=O)O HY-14608S2 [1,1,0,0,0,0|1,0,1]=4 117 B9R0.47 C#CCSC[C@H](N)C(=O)O HY-W001538 [1,1,0,0,0,0|1,0,1]=4 118 B9R0.47 C=CCSC[C@@H](N)C(=O)O HY-W048286 [1,1,0,0,0,0|1,0,1]=4 119 B9R0.47 C=CCSC[C@H](N)C(=O)O HY-W013573 [1,1,0,0,0,0|1,0,1]=4 120 B9R0.47 CNCCC[C@H](N)C(C)=O HY-126436C [1,1,0,0,0,0|1,0,0]=3 121 B9R0.47 NCCCCC(N)C(=O)O HY-B2236 [1,1,0,0,0,0|0,0,0]=2 122 B9R0.47 NCCCCC(N)C(=O)O HY-W027251 [1,1,0,0,0,0|0,0,0]=2 123 B9R0.47 NCCCC[C@@H](N)C(=O)O HY-Y1091 [1,1,0,0,0,0|0,0,0]=2 124 B9R0.47 NCCCC[C@H](N)C(=O)O HY-N0469 [1,1,0,0,0,0|0,0,0]=2 125 B9R0.47 NCCCC[C@H](N)C(=O)O HY-N0470 [1,1,0,0,0,0|0,0,0]=2 126 B9R0.47 NCCCC[C@H](N)C(=O)O HY-W009762 [1,1,0,0,0,0|0,0,0]=2 127 B9R0.47 NCCCC[C@H](N)C(=O)O HY-W015370 [1,1,0,0,0,0|0,0,0]=2 128 B9R0.47 NCCSC[C@H](N)C(=O)O HY-122526 [1,1,0,0,0,0|0,0,0]=2 129 B9R0.47 N[13CH2][13CH2][13CH2][13CH2][13C@H](N)[13C](=O)O HY-N0469S1 [1,1,0,0,0,0|0,0,0]=2 130 B9R0.47 [N-]=[N+]=NCC[C@H](N)C(=O)O HY-140346A [1,1,0,0,0,0|1,0,1]=4 131 B11R0.66 O=C(CO)[C@@H](O)[13C@H](O)[C@H](O)CO HY-N7092S5 [0,2,0,0,0,0|2,0,0]=4 132 B11R0.66 O=C(CO)[C@@H](O)[C@@H](O)[C@H](O)CO HY-42680 [0,2,0,0,0,0|2,0,0]=4 133 B11R0.66 O=C(CO)[C@@H](O)[C@H](O)[C@@H](O)CO HY-W040240 [0,2,0,0,0,0|2,0,0]=4 134 B11R0.66 O=C(CO)[C@@H](O)[C@H](O)[C@H](O)CO HY-N7092 [0,2,0,0,0,0|2,0,0]=4 135 B11R0.66 O=C(CO)[C@@H](O)[C@H](O)[C@H](O)CO HY-N7092R [0,2,0,0,0,0|2,0,0]=4 136 B11R0.66 O=C(CO)[C@H](O)[C@@H](O)[C@H](O)CO HY-W145497 [0,2,0,0,0,0|2,0,0]=4 137 B11R0.66 O=C(CO)[C@H](O)[C@H](O)[C@H](O)CO HY-N9914 [0,2,0,0,0,0|2,0,0]=4 138 B11R0.66 O=C(CO)[C@H](O)[C@H](O)[C@H](O)CO HY-N9914R [0,2,0,0,0,0|2,0,0]=4 139 B11R0.66 O=[13C](CO)[C@@H](O)[C@H](O)[C@H](O)CO HY-N7092S2 [0,2,0,0,0,0|2,0,0]=4 140 B9R1.110 NC(C(=O)O)C1CCC1 HY-20834 [1,0,0,1,0,0|1,0,0]=3 141 B9R1.6 O=C(O)C1CCCCC1 HY-Y1373 [1,0,0,1,0,0|2,0,0]=4 142 B9R1.6 O=C(O)C1CCCCN1 HY-Y0669R [1,0,0,1,0,0|1,0,0]=3 143 B9R1.6 O=C(O)C1CCCNC1 HY-69359 [1,0,0,1,0,0|1,0,0]=3 144 B9R1.6 O=C(O)[C@H]1CCCCN1 HY-Y0181 [1,0,0,1,0,0|1,0,0]=3 145 B9R1.6 [C@@H]1(C(=O)O)CCCCN1 HY-W012734 [1,0,0,1,0,0|1,0,0]=3 146 B9R1.6 [C@H]1(C(=O)O)CCCNC1 HY-W012735 [1,0,0,1,0,0|1,0,0]=3 147 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 HY-W061761 [1,0,0,1,0,0|1,0,0]=3 148 B9R1.35 O=C1CCC(C(=O)O)N1 HY-W012738 [1,0,0,1,0,0|1,0,1]=4 149 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 HY-76082 [1,0,0,1,0,0|1,0,1]=4 150 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 HY-76082R [1,0,0,1,0,0|1,0,1]=4 151 B9R1.35 O=C1CC[C@H](C(=O)O)N1 HY-W002304 [1,0,0,1,0,0|1,0,1]=4 152 B9R1.112 [C@H](N)(CC1CC1)C(=O)O HY-W008028 [1,0,0,1,0,0|1,0,0]=3 153 B9R1.163 NC1(C(=O)O)CCCC1 HY-30008 [1,0,0,1,0,0|1,0,0]=3 154 B9R1.163 [2H]C1(C(=O)O)CCCN1 HY-W012908S1 [1,0,0,1,0,0|1,0,0]=3 155 B11R1.36 NC(C(=O)O)C1CCCCC1 HY-41267 [0,1,0,1,0,0|2,0,0]=4 156 B11R1.36 N[C@@H](C(=O)O)C1CCCCC1 HY-42354 [0,1,0,1,0,0|2,0,0]=4 157 B11R1.36 N[C@@H](C(=O)O)C1CCCCC1 HY-W050785 [0,1,0,1,0,0|2,0,0]=4 158 B11R1.36 N[C@H](C(=O)O)C1CCOCC1 HY-20838B [0,1,0,1,0,0|2,0,0]=4 159 B11R1.167 CC1=NC[C@H](O)[C@@H](C(=O)O)N1 HY-108032 [0,1,0,1,0,0|1,0,1]=4