0 B6R0.4 C#CCCC(=O)O HY-Y1230 [0,0,0,0,0,0|0,0,2]=2 1 B6R0.4 O=C(O)\C=C\CO HY-100982 [0,0,0,0,0,0|1,0,2]=3 2 B5R0.1 CNCC(=O)O HY-W012791 [1,0,0,0,0,0|1,0,0]=2 3 B5R0.1 C\C=C\C(C)=O HY-34748 [1,0,0,0,0,0|1,0,2]=4 4 B5R0.1 NOCC(=O)O HY-107994A [1,0,0,0,0,0|2,0,0]=3 5 B5R0.1 [15NH2]CCC(=O)O HY-N0230S1 [1,0,0,0,0,0|1,0,0]=2 6 B5R0.2 C=CCCCO HY-W010639 [1,0,0,0,0,0|2,0,0]=3 7 B7R0.2 NC[C@@H](F)C[PH](=O)O HY-10061B [0,1,0,0,0,0|2,0,0]=3 8 B7R0.2 NC[C@H](O)CC(=O)O HY-W005749 [0,1,0,0,0,0|1,0,0]=2 9 B7R0.2 N[C@H](CO)CC(=O)O HY-W040432 [0,1,0,0,0,0|1,0,0]=2 10 B7R0.2 O=C([O-])C[C@H](O)CO HY-113304A [0,1,0,0,0,0|1,0,1]=3 11 B7R0.3 C#CCCC(=O)O[Na] HY-15286 [0,1,0,0,0,0|0,0,2]=3 12 B7R0.3 C=CC(=O)NCCO HY-W095198 [0,1,0,0,0,0|3,0,0]=4 13 B7R0.3 CCC(=O)OCOC HY-41616 [0,1,0,0,0,0|3,0,0]=4 14 B7R0.3 CCCCC(=O)O[Na] HY-W007087 [0,1,0,0,0,0|0,0,0]=1 15 B7R0.4 NCCNCC(=O)O HY-W012883 [0,1,0,0,0,0|1,0,0]=2 16 B7R0.4 O=C(O)COCCO HY-W591338A [0,1,0,0,0,0|1,0,0]=2 17 B7R0.4 O=C(O)COCCO HY-W591338B [0,1,0,0,0,0|1,0,0]=2 18 B7R0.4 O=C(O)COCCS HY-140728 [0,1,0,0,0,0|1,0,0]=2 19 B7R0.5 C=CC[C@H](N)C(=O)O HY-W012906 [0,1,0,0,0,0|0,0,2]=3 20 B7R0.5 COCC(N)C(=O)O HY-W012871 [0,1,0,0,0,0|1,0,0]=2 21 B7R0.5 N[C@H](CCS)C(=O)O HY-77801 [0,1,0,0,0,0|1,0,0]=2 22 B7R0.6 C[S+](C)CCC(=O)O HY-W105506 [0,1,0,0,0,0|1,0,0]=2 23 B7R0.6 O=[13C](O)[13CH2][13CH2][13C](=O)O HY-N0420S2 [0,1,0,0,0,0|1,0,1]=3 24 B7R1.2 O=C1CCC(=O)[15NH]1 HY-41877S [0,0,0,1,0,0|2,0,1]=4 25 B7R1.3 CC1=CCCCC1 HY-W004338 [0,0,0,1,0,0|2,0,0]=3 26 B7R1.14 O=S1(=O)CCCO1 HY-W010479 [0,0,0,1,0,0|2,0,1]=4 27 B4R0.1 C=CC(=O)O HY-W243303B [2,0,0,0,0,0|0,0,2]=4 28 B4R0.1 C=CC(=O)O HY-W243303M [2,0,0,0,0,0|0,0,2]=4 29 B4R0.1 CC(=O)CN HY-W004850 [2,0,0,0,0,0|2,0,0]=4 30 B4R0.1 CCB(O)O HY-W000933 [2,0,0,0,0,0|1,0,1]=4 31 B4R0.1 [13CH3][13CH2][13C](=O)O HY-B1773AS3 [2,0,0,0,0,0|0,0,0]=2 32 B4R0.1 [15NH2]C[13C](=O)O HY-Y0966S5 [2,0,0,0,0,0|1,0,0]=3 33 B4R0.1 [15NH2][13CH2]C(=O)O HY-Y0966S7 [2,0,0,0,0,0|1,0,0]=3 34 B4R0.1 [15NH2][13CH2][13C](=O)O HY-Y0966S6 [2,0,0,0,0,0|1,0,0]=3 35 B4R0.2 CCCNC HY-W250110E [2,0,0,0,0,0|1,0,1]=4 36 B4R0.2 CCCNC HY-W250110I [2,0,0,0,0,0|1,0,1]=4 37 B6R0.1 C[13CH2][13CH2][13C](=O)O[Na] HY-W750796 [1,1,0,0,0,0|0,0,0]=2 38 B6R0.2 CC(=O)CC(=O)O HY-112540 [1,1,0,0,0,0|0,0,1]=3 39 B6R0.2 CC(C)=CC(=O)O HY-W010611 [1,1,0,0,0,0|0,0,2]=4 40 B6R0.2 CC(C)CC(=O)O HY-W012980R [1,1,0,0,0,0|0,0,0]=2 41 B6R0.3 C(C)=C(/C)C(=O)O HY-N6929 [1,1,0,0,0,0|0,0,2]=4 42 B6R0.3 CCC(=O)C(C)=O HY-W012998R [1,1,0,0,0,0|1,0,1]=4 43 B6R0.3 CCC(Br)C(=O)O HY-W015333 [1,1,0,0,0,0|0,0,0]=2 44 B6R0.3 CC[C@@H](O)C(=O)O HY-113381A [1,1,0,0,0,0|0,0,0]=2 45 B6R0.3 CNC(C)C(=O)O HY-W010591 [1,1,0,0,0,0|1,0,0]=3 46 B6R0.3 N[C@@H]([13CH2]O)C(=O)O HY-N0650S1 [1,1,0,0,0,0|1,0,0]=3 47 B6R0.3 O=C(O)C(=O)CO HY-113013 [1,1,0,0,0,0|1,0,1]=4 48 B6R0.3 [15NH2][C@@H](CO)C(=O)O HY-N0650S10 [1,1,0,0,0,0|1,0,0]=3 49 B6R0.3 [15NH2][C@@H](CO)[13C](=O)O HY-N0650S6 [1,1,0,0,0,0|1,0,0]=3 50 B6R0.3 [15NH2][C@@H](CS)C(=O)O HY-Y0337S1 [1,1,0,0,0,0|1,0,0]=3 51 B6R0.5 NCCS(=O)(=O)O HY-B0351 [1,1,0,0,0,0|2,0,0]=4 52 B6R0.5 N[13CH2][13CH2]S(=O)(=O)O HY-B0351S1 [1,1,0,0,0,0|2,0,0]=4 53 B6R0.5 [15NH2][13CH2][13CH2]S(=O)(=O)O HY-B0351S2 [1,1,0,0,0,0|2,0,0]=4 54 B6R0.6 OCCOCCO HY-B1952R [1,1,0,0,0,0|1,0,1]=4 55 B8R0.2 CCC(C)C(N)C(=O)O HY-W1005647 [0,2,0,0,0,0|0,0,0]=2 56 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O HY-I1070 [0,2,0,0,0,0|0,0,0]=2 57 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O HY-I1060 [0,2,0,0,0,0|0,0,0]=2 58 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O HY-N0771R [0,2,0,0,0,0|0,0,0]=2 59 B8R0.23 CC(=O)N[C@H](C)C(=O)O HY-W012713 [0,2,0,0,0,0|1,0,1]=4 60 B8R0.23 CC(C)C(N)CC(=O)O HY-W012708 [0,2,0,0,0,0|0,0,0]=2 61 B8R0.23 CC(C)C[C@@H](N)C(N)=O HY-W111211 [0,2,0,0,0,0|1,0,0]=3 62 B8R0.23 CC(C)C[C@@H](O)C(=O)O HY-30216 [0,2,0,0,0,0|0,0,0]=2 63 B8R0.23 CC(C)C[C@H]([15NH2])C(=O)O HY-N0486S3 [0,2,0,0,0,0|0,0,0]=2 64 B8R0.23 NC(=O)C[C@@H](N)C(=O)O HY-W010378R [0,2,0,0,0,0|1,0,1]=4 65 B8R0.23 NC(=O)C[C@@H](N)C(=O)O HY-W017444 [0,2,0,0,0,0|1,0,1]=4 66 B8R0.23 NC(=O)C[C@H](N)C(=O)O HY-N0667 [0,2,0,0,0,0|1,0,1]=4 67 B8R0.23 N[C@@H](CC(=O)O)C(=O)O HY-N0666 [0,2,0,0,0,0|1,0,1]=4 68 B8R0.23 N[C@@H](CC([15NH2])=O)C(=O)O HY-W017443S1 [0,2,0,0,0,0|1,0,1]=4 69 B8R0.23 N[C@@H](C[13C](=O)O)[13C](=O)O HY-N0666S6 [0,2,0,0,0,0|1,0,1]=4 70 B8R0.23 N[C@H](CC(=O)O)C(=O)O HY-42068 [0,2,0,0,0,0|1,0,1]=4 71 B8R0.23 O=C(O)C[C@H](O)C(=O)O HY-Y1069R [0,2,0,0,0,0|1,0,1]=4 72 B8R0.23 O=[13C](O)[13CH2][13C@H](O)[13C](=O)O HY-Y1069S3 [0,2,0,0,0,0|1,0,1]=4 73 B8R0.23 [13CH2]([13C](=O)O)[13C@H](N)[13C](=O)O HY-N0666S4 [0,2,0,0,0,0|1,0,1]=4 74 B8R0.23 [13CH3][13CH]([13CH3])[13CH2][13C@H](N)[13C](=O)O HY-N0486S2 [0,2,0,0,0,0|0,0,0]=2 75 B8R0.23 [15NH2][C@@H](CC(=O)O)C(=O)O HY-N0666S3 [0,2,0,0,0,0|1,0,1]=4 76 B8R0.1 CCCOC(=O)OCCl HY-Z2475 [0,2,0,0,0,0|1,0,0]=3 77 B8R0.8 C#CCCC(N)C(=O)O HY-W259668 [0,2,0,0,0,0|0,0,1]=3 78 B8R0.8 C#CCC[C@H](N)C(=O)O HY-140345A [0,2,0,0,0,0|0,0,1]=3 79 B8R0.8 CCCC[C@H](N)C(=O)O HY-Y0017R [0,2,0,0,0,0|0,0,0]=2 80 B8R0.8 NOCC[C@H](N)C(=O)O HY-129476 [0,2,0,0,0,0|1,0,0]=3 81 B8R0.8 N[13CH2][13CH2][13CH2][13C@H](N)[13C](=O)O HY-W017018S2 [0,2,0,0,0,0|0,0,0]=2 82 B8R0.8 [13CH3]SCC[C@H](N)C(=O)O HY-N0326S3 [0,2,0,0,0,0|0,0,0]=2 83 B8R0.8 [13CH3]S[13CH2][13CH2][13C@H](N)[13C](=O)O HY-N0326S5 [0,2,0,0,0,0|0,0,0]=2 84 B8R0.9 C=CC(N)CCC(=O)O HY-15399 [0,2,0,0,0,0|0,0,1]=3 85 B8R0.9 NCC(=O)CCC(=O)O HY-W000450 [0,2,0,0,0,0|0,0,1]=3 86 B8R0.9 NCC(=O)NCC(=O)O HY-D0889 [0,2,0,0,0,0|1,0,1]=4 87 B8R0.7 C#CCCCCC(=O)O HY-34643 [0,2,0,0,0,0|0,0,0]=2 88 B8R0.7 CC(=O)NCCCCN HY-W342604R [0,2,0,0,0,0|1,0,0]=3 89 B8R0.7 CCCC\C=C\C(=O)O HY-W107869 [0,2,0,0,0,0|0,0,0]=2 90 B8R0.7 NCCCCCC(=O)O HY-B0236 [0,2,0,0,0,0|0,0,0]=2 91 B8R0.7 NCCCNCC(=O)O HY-W077223 [0,2,0,0,0,0|0,0,0]=2 92 B8R0.7 O=C(O)CCCCCO HY-W105750 [0,2,0,0,0,0|0,0,0]=2 93 B8R0.7 O=C(O)CCOCCBr HY-130425 [0,2,0,0,0,0|0,0,0]=2 94 B8R0.21 NCCCCP(=O)(O)O HY-W018502 [0,2,0,0,0,0|1,0,0]=3 95 B8R0.21 [2H]C([2H])(O)CCCCC HY-W032022S2 [0,2,0,0,0,0|1,0,1]=4 96 B8R0.12 [2H]C([2H])(CCN)C(=O)O HY-N0067S1 [0,2,0,0,0,0|1,0,0]=3 97 B8R0.29 [2H]C([2H])([2H])NCC(=O)O HY-W012791S [0,2,0,0,0,0|2,0,0]=4 98 B6R1.2 S=C1NCCO1 HY-W038985 [1,0,0,1,0,0|1,1,0]=4 99 B6R1.6 OC[C@H]1CCN1 HY-W061628 [1,0,0,1,0,0|1,0,1]=4 100 B8R1.4 CC1CCN=C(N)S1 HY-101251 [0,1,0,1,0,0|1,1,0]=4 101 B8R1.7 O=C(O)[C@@H]1CCC[15NH]1 HY-Y0252S2 [0,1,0,1,0,0|0,0,0]=2 102 B8R1.7 O=[13C](O)[13C@@H]1[13CH2][13CH2][13CH2]N1 HY-Y0252S [0,1,0,1,0,0|0,0,0]=2 103 B8R1.54 N[C@H](C(=O)O)C1CC1 HY-W005759 [0,1,0,1,0,0|0,0,0]=2