0 B18R0.220 CCCCCCCCCCCCCC(=O)NC(C)C WXVL_AK0030SB0562 [0,0,0,0,0,0|1,0,0]=1 1 B18R0.220 CCCCCCCCCCCCCC(=O)NC(C)C WXVL_AK0030SB0562 [0,0,0,0,0,0|1,0,0]=1 2 B18R0.220 CCCCCCCCCCCCNC(=O)C=C(C)C WXVL_AK1886SB0342 [0,0,0,0,0,0|2,0,1]=3 3 B18R0.220 CCCCCCCCCCCCNC(=O)C=C(C)C WXVL_AK1886SB0342 [0,0,0,0,0,0|2,0,1]=3 4 B18R0.220 CCCCCCCCCCCCNC(=O)CC(C)C WXVL_AK1886SB0063 [0,0,0,0,0,0|2,0,0]=2 5 B18R0.220 CCCCCCCCCCCCNC(=O)CC(C)C WXVL_AK1886SB0063 [0,0,0,0,0,0|2,0,0]=2 6 B18R0.220 CCCCCCCCCCCCNC(=O)CC(C)O WXVL_AK1886SB3643 [0,0,0,0,0,0|3,0,0]=3 7 B18R0.220 CCCCCCCCCCCCNC(=O)CC(C)O WXVL_AK1886SB3643 [0,0,0,0,0,0|3,0,0]=3 8 B18R0.220 CCCCCCCCCCCCNC(=O)CN(C)C WXVL_AK1886SB0085 [0,0,0,0,0,0|3,0,0]=3 9 B18R0.220 CCCCCCCCCCCCNC(=O)CN(C)C WXVL_AK1886SB0085 [0,0,0,0,0,0|3,0,0]=3 10 B18R0.220 CCCCCCCCCCCCNC(=O)NC(C)C WXVL_AK0030YV0205 [0,0,0,0,0,0|2,0,0]=2 11 B18R0.220 CCCCCCCCCCCCNC(=O)NC(C)C WXVL_AK0030YV0205 [0,0,0,0,0,0|2,0,0]=2 12 B17R0.116 CC(C)CC(=O)NCCCCCCCCCCO WXVL_AK3148SB0063 [1,0,0,0,0,0|3,0,0]=4 13 B17R0.116 CC(C)CC(=O)NCCCCCCCCCCO WXVL_AK3148SB0063 [1,0,0,0,0,0|3,0,0]=4 14 B17R0.116 CC(C)NC(=O)CCCCCCCCCCCBr WXVL_AK0030SB0603 [1,0,0,0,0,0|2,0,0]=3 15 B17R0.116 CC(C)NC(=O)CCCCCCCCCCCBr WXVL_AK0030SB0603 [1,0,0,0,0,0|2,0,0]=3 16 B17R0.116 CCCCCCCCCCCCC(=O)NC(C)C WXVL_AK0030SB0547 [1,0,0,0,0,0|1,0,0]=2 17 B17R0.116 CCCCCCCCCCCCC(=O)NC(C)C WXVL_AK0030SB0547 [1,0,0,0,0,0|1,0,0]=2 18 B17R0.250 C/C=C/C(=O)NCCCCCCCCCCCC WXVL_AK1886SB0340 [1,0,0,0,0,0|2,0,1]=4 19 B17R0.250 C/C=C/C(=O)NCCCCCCCCCCCC WXVL_AK1886SB0340 [1,0,0,0,0,0|2,0,1]=4 20 B17R0.250 CC#CC(=O)NCCCCCCCCCCCC WXVL_AK1886SB1240 [1,0,0,0,0,0|2,0,1]=4 21 B17R0.250 CC#CC(=O)NCCCCCCCCCCCC WXVL_AK1886SB1240 [1,0,0,0,0,0|2,0,1]=4 22 B17R0.250 CCCCCCCCCCCCCC(=O)NCC WXVL_AK00476SB0562 [1,0,0,0,0,0|1,0,0]=2 23 B17R0.250 CCCCCCCCCCCCCC(=O)NCC WXVL_AK00476SB0562 [1,0,0,0,0,0|1,0,0]=2 24 B17R0.250 CCCCCCCCCCCCNC(=O)CCC WXVL_AK1886SB0073 [1,0,0,0,0,0|2,0,0]=3 25 B17R0.250 CCCCCCCCCCCCNC(=O)CCC WXVL_AK1886SB0073 [1,0,0,0,0,0|2,0,0]=3 26 B17R0.250 CCCCCCCCCCCCNC(=O)COC WXVL_AK1886SB0090 [1,0,0,0,0,0|3,0,0]=4 27 B17R0.250 CCCCCCCCCCCCNC(=O)COC WXVL_AK1886SB0090 [1,0,0,0,0,0|3,0,0]=4 28 B17R0.250 CCCCCCCCCCCCNC(=O)CSC WXVL_AK1886SB1267 [1,0,0,0,0,0|3,0,0]=4 29 B17R0.250 CCCCCCCCCCCCNC(=O)CSC WXVL_AK1886SB1267 [1,0,0,0,0,0|3,0,0]=4 30 B17R0.250 CCCCCCCCCCCCNC(=O)NCC WXVL_AK00476YV0205 [1,0,0,0,0,0|2,0,0]=3 31 B17R0.250 CCCCCCCCCCCCNC(=O)NCC WXVL_AK00476YV0205 [1,0,0,0,0,0|2,0,0]=3 32 B19R0.35 CC(=CC(=O)NCCCCCCCCCCCCO)C WXVL_AK3055SB0342 [0,1,0,0,0,0|2,0,1]=4 33 B19R0.35 CC(=CC(=O)NCCCCCCCCCCCCO)C WXVL_AK3055SB0342 [0,1,0,0,0,0|2,0,1]=4 34 B19R0.35 CC(C)CC(=O)NCCCCCCCCCCCCO WXVL_AK3055SB0063 [0,1,0,0,0,0|2,0,0]=3 35 B19R0.35 CC(C)CC(=O)NCCCCCCCCCCCCO WXVL_AK3055SB0063 [0,1,0,0,0,0|2,0,0]=3 36 B19R0.35 CC(O)CC(=O)NCCCCCCCCCCCCO WXVL_AK3055SB3643 [0,1,0,0,0,0|3,0,0]=4 37 B19R0.35 CC(O)CC(=O)NCCCCCCCCCCCCO WXVL_AK3055SB3643 [0,1,0,0,0,0|3,0,0]=4 38 B19R0.35 CCCCCCCCCCCCCCC(=O)NC(C)C WXVL_AK0030SB0577 [0,1,0,0,0,0|1,0,0]=2 39 B19R0.35 CCCCCCCCCCCCCCC(=O)NC(C)C WXVL_AK0030SB0577 [0,1,0,0,0,0|1,0,0]=2 40 B19R0.35 CCCCCCCCCCCCCNC(=O)C=C(C)C WXVL_AK4135SB0342 [0,1,0,0,0,0|1,0,1]=3 41 B19R0.35 CCCCCCCCCCCCCNC(=O)C=C(C)C WXVL_AK4135SB0342 [0,1,0,0,0,0|1,0,1]=3 42 B19R0.35 CCCCCCCCCCCCCNC(=O)CC(C)C WXVL_AK4135SB0063 [0,1,0,0,0,0|1,0,0]=2 43 B19R0.35 CCCCCCCCCCCCCNC(=O)CC(C)C WXVL_AK4135SB0063 [0,1,0,0,0,0|1,0,0]=2 44 B19R0.35 CCCCCCCCCCCCCNC(=O)CC(C)O WXVL_AK4135SB3643 [0,1,0,0,0,0|2,0,0]=3 45 B19R0.35 CCCCCCCCCCCCCNC(=O)CC(C)O WXVL_AK4135SB3643 [0,1,0,0,0,0|2,0,0]=3 46 B19R0.35 CCCCCCCCCCCCCNC(=O)CN(C)C WXVL_AK4135SB0085 [0,1,0,0,0,0|2,0,0]=3 47 B19R0.35 CCCCCCCCCCCCCNC(=O)CN(C)C WXVL_AK4135SB0085 [0,1,0,0,0,0|2,0,0]=3 48 B19R0.35 CN(C)CC(=O)NCCCCCCCCCCCCO WXVL_AK3055SB0085 [0,1,0,0,0,0|3,0,0]=4 49 B19R0.35 CN(C)CC(=O)NCCCCCCCCCCCCO WXVL_AK3055SB0085 [0,1,0,0,0,0|3,0,0]=4 50 B19R0.3096 C#C[C@@H](C)NC(=O)CCCCCCCCCCCCC WXVL_AK00735SB0562 [0,1,0,0,0,0|1,0,1]=3 51 B19R0.3096 C#C[C@@H](C)NC(=O)CCCCCCCCCCCCC WXVL_AK00735SB0562 [0,1,0,0,0,0|1,0,1]=3 52 B19R0.3096 C#C[C@@H](C)NC(=O)NCCCCCCCCCCCC WXVL_AK00735YV0205 [0,1,0,0,0,0|2,0,1]=4 53 B19R0.3096 C#C[C@@H](C)NC(=O)NCCCCCCCCCCCC WXVL_AK00735YV0205 [0,1,0,0,0,0|2,0,1]=4 54 B19R0.3096 C=CC(C)NC(=O)CCCCCCCCCCCCC WXVL_AK00769SB0562 [0,1,0,0,0,0|1,0,1]=3 55 B19R0.3096 C=CC(C)NC(=O)CCCCCCCCCCCCC WXVL_AK00769SB0562 [0,1,0,0,0,0|1,0,1]=3 56 B19R0.3096 C=CC(C)NC(=O)NCCCCCCCCCCCC WXVL_AK00769YV0205 [0,1,0,0,0,0|2,0,1]=4 57 B19R0.3096 C=CC(C)NC(=O)NCCCCCCCCCCCC WXVL_AK00769YV0205 [0,1,0,0,0,0|2,0,1]=4 58 B19R0.3096 CCCCCCCCCCCCCC(=O)NC(C)C#N WXVL_AK00810SB0562 [0,1,0,0,0,0|1,0,1]=3 59 B19R0.3096 CCCCCCCCCCCCCC(=O)NC(C)C#N WXVL_AK00810SB0562 [0,1,0,0,0,0|1,0,1]=3 60 B19R0.3096 CCCCCCCCCCCCCC(=O)N[C@@H](C)CC WXVL_AK00678SB0562 [0,1,0,0,0,0|1,0,0]=2 61 B19R0.3096 CCCCCCCCCCCCCC(=O)N[C@@H](C)CC WXVL_AK00678SB0562 [0,1,0,0,0,0|1,0,0]=2 62 B19R0.3096 CCCCCCCCCCCCCC(=O)N[C@@H](C)CF WXVL_AK00558SB0562 [0,1,0,0,0,0|1,0,0]=2 63 B19R0.3096 CCCCCCCCCCCCCC(=O)N[C@@H](C)CF WXVL_AK00558SB0562 [0,1,0,0,0,0|1,0,0]=2 64 B19R0.3096 CCCCCCCCCCCCCC(=O)N[C@@H](C)CO WXVL_AK0109SB0562 [0,1,0,0,0,0|1,0,0]=2 65 B19R0.3096 CCCCCCCCCCCCCC(=O)N[C@@H](C)CO WXVL_AK0109SB0562 [0,1,0,0,0,0|1,0,0]=2 66 B19R0.3096 CCCCCCCCCCCCNC(=O)CC(C)CC WXVL_AK1886SB0353 [0,1,0,0,0,0|2,0,0]=3 67 B19R0.3096 CCCCCCCCCCCCNC(=O)CC(C)CC WXVL_AK1886SB0353 [0,1,0,0,0,0|2,0,0]=3 68 B19R0.3096 CCCCCCCCCCCCNC(=O)CC(O)CC WXVL_AK1886SB4092 [0,1,0,0,0,0|3,0,0]=4 69 B19R0.3096 CCCCCCCCCCCCNC(=O)CC(O)CC WXVL_AK1886SB4092 [0,1,0,0,0,0|3,0,0]=4 70 B19R0.3096 CCCCCCCCCCCCNC(=O)C[C@H](C)CC WXVL_AK1886SB8650 [0,1,0,0,0,0|2,0,0]=3 71 B19R0.3096 CCCCCCCCCCCCNC(=O)C[C@H](C)CC WXVL_AK1886SB8650 [0,1,0,0,0,0|2,0,0]=3 72 B19R0.3096 CCCCCCCCCCCCNC(=O)NC(C)C#N WXVL_AK00810YV0205 [0,1,0,0,0,0|2,0,1]=4 73 B19R0.3096 CCCCCCCCCCCCNC(=O)NC(C)C#N WXVL_AK00810YV0205 [0,1,0,0,0,0|2,0,1]=4 74 B19R0.3096 CCCCCCCCCCCCNC(=O)N[C@@H](C)CC WXVL_AK00678YV0205 [0,1,0,0,0,0|2,0,0]=3 75 B19R0.3096 CCCCCCCCCCCCNC(=O)N[C@@H](C)CC WXVL_AK00678YV0205 [0,1,0,0,0,0|2,0,0]=3 76 B19R0.3096 CCCCCCCCCCCCNC(=O)N[C@@H](C)CF WXVL_AK00558YV0205 [0,1,0,0,0,0|2,0,0]=3 77 B19R0.3096 CCCCCCCCCCCCNC(=O)N[C@@H](C)CF WXVL_AK00558YV0205 [0,1,0,0,0,0|2,0,0]=3 78 B19R0.3096 CCCCCCCCCCCCNC(=O)N[C@@H](C)CO WXVL_AK0109YV0205 [0,1,0,0,0,0|2,0,0]=3 79 B19R0.3096 CCCCCCCCCCCCNC(=O)N[C@@H](C)CO WXVL_AK0109YV0205 [0,1,0,0,0,0|2,0,0]=3 80 B19R0.3108 CCCCCCCCCCCCCC(=O)NC(C)(C)C WXVL_AK0024SB0562 [0,1,0,0,0,0|1,0,0]=2 81 B19R0.3108 CCCCCCCCCCCCCC(=O)NC(C)(C)C WXVL_AK0024SB0562 [0,1,0,0,0,0|1,0,0]=2 82 B19R0.3108 CCCCCCCCCCCCNC(=O)CC(C)(C)C WXVL_AK1886SB0062 [0,1,0,0,0,0|2,0,0]=3 83 B19R0.3108 CCCCCCCCCCCCNC(=O)CC(C)(C)C WXVL_AK1886SB0062 [0,1,0,0,0,0|2,0,0]=3 84 B19R0.3108 CCCCCCCCCCCCNC(=O)CC(C)(C)O WXVL_AK1886SB0163 [0,1,0,0,0,0|2,0,0]=3 85 B19R0.3108 CCCCCCCCCCCCNC(=O)CC(C)(C)O WXVL_AK1886SB0163 [0,1,0,0,0,0|2,0,0]=3 86 B19R0.3108 CCCCCCCCCCCCNC(=O)NC(C)(C)C WXVL_AK0024YV0205 [0,1,0,0,0,0|2,0,0]=3 87 B19R0.3108 CCCCCCCCCCCCNC(=O)NC(C)(C)C WXVL_AK0024YV0205 [0,1,0,0,0,0|2,0,0]=3 88 B19R0.18098 CCCCCCCCCCCCNS(=O)(=O)CC(C)C WXVL_AK1886HU0149 [0,1,0,0,0,0|3,0,0]=4 89 B19R0.18098 CCCCCCCCCCCCNS(=O)(=O)CC(C)C WXVL_AK1886HU0149 [0,1,0,0,0,0|3,0,0]=4 90 B19R0.25647 CCCCCCCCCCCCCC(=O)N(C)C(C)C WXVL_AN0073SB0562 [0,1,0,0,0,0|1,0,0]=2 91 B19R0.25647 CCCCCCCCCCCCCC(=O)N(C)C(C)C WXVL_AN0073SB0562 [0,1,0,0,0,0|1,0,0]=2 92 B19R0.25647 CCCCCCCCCCCCNC(=O)C(=O)C(C)C WXVL_AK1886SB2578 [0,1,0,0,0,0|2,0,0]=3 93 B19R0.25647 CCCCCCCCCCCCNC(=O)C(=O)C(C)C WXVL_AK1886SB2578 [0,1,0,0,0,0|2,0,0]=3 94 B19R0.25647 CCCCCCCCCCCCNC(=O)C(O)C(C)C WXVL_AK1886SB1147 [0,1,0,0,0,0|2,0,0]=3 95 B19R0.25647 CCCCCCCCCCCCNC(=O)C(O)C(C)C WXVL_AK1886SB1147 [0,1,0,0,0,0|2,0,0]=3 96 B19R0.25647 CCCCCCCCCCCCNC(=O)N(C)C(C)C WXVL_AN0073YV0205 [0,1,0,0,0,0|2,0,0]=3 97 B19R0.25647 CCCCCCCCCCCCNC(=O)N(C)C(C)C WXVL_AN0073YV0205 [0,1,0,0,0,0|2,0,0]=3 98 B19R1.68512 CCCCCCCCCCCCCC(=O)NC1CC1 WXVL_AK0001SB0562 [0,0,0,1,0,0|1,0,0]=2 99 B19R1.68512 CCCCCCCCCCCCCC(=O)NC1CC1 WXVL_AK0001SB0562 [0,0,0,1,0,0|1,0,0]=2 100 B19R1.68512 CCCCCCCCCCCCNC(=O)CC1CC1 WXVL_AK1886SB0155 [0,0,0,1,0,0|2,0,0]=3 101 B19R1.68512 CCCCCCCCCCCCNC(=O)CC1CC1 WXVL_AK1886SB0155 [0,0,0,1,0,0|2,0,0]=3 102 B19R1.68512 CCCCCCCCCCCCNC(=O)NC1CC1 WXVL_AK0001YV0205 [0,0,0,1,0,0|2,0,0]=3 103 B19R1.68512 CCCCCCCCCCCCNC(=O)NC1CC1 WXVL_AK0001YV0205 [0,0,0,1,0,0|2,0,0]=3 104 B19R1.878881 CCCCCCCCCCCCNC(=O)C1CC1C WXVL_AK1886SB0041 [0,0,0,1,0,0|2,0,0]=3 105 B19R1.878881 CCCCCCCCCCCCNC(=O)C1CC1C WXVL_AK1886SB0041 [0,0,0,1,0,0|2,0,0]=3 106 B19R1.878881 CCCCCCCCCCCCNC(=O)[C@@H]1C[C@@H]1F WXVL_AK1886SB1245 [0,0,0,1,0,0|3,0,0]=4 107 B19R1.878881 CCCCCCCCCCCCNC(=O)[C@@H]1C[C@@H]1F WXVL_AK1886SB1245 [0,0,0,1,0,0|3,0,0]=4 108 B19R1.878881 CCCCCCCCCCCCNC(=O)[C@H]1C[C@H]1F WXVL_AK1886SB00019 [0,0,0,1,0,0|3,0,0]=4 109 B19R1.878881 CCCCCCCCCCCCNC(=O)[C@H]1C[C@H]1F WXVL_AK1886SB00019 [0,0,0,1,0,0|3,0,0]=4 110 B17R0.14245 CCCCCCCCCCCCCC(=O)N(C)C WXVL_AN0032SB0562 [0,0,0,0,1,0|1,0,0]=2 111 B17R0.14245 CCCCCCCCCCCCCC(=O)N(C)C WXVL_AN0032SB0562 [0,0,0,0,1,0|1,0,0]=2 112 B17R0.14245 CCCCCCCCCCCCNC(=O)C(=O)C WXVL_AK1886SB0051 [0,0,0,0,1,0|2,0,1]=4 113 B17R0.14245 CCCCCCCCCCCCNC(=O)C(=O)C WXVL_AK1886SB0051 [0,0,0,0,1,0|2,0,1]=4 114 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)C WXVL_AK1886SB0052 [0,0,0,0,1,0|1,0,0]=2 115 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)C WXVL_AK1886SB0052 [0,0,0,0,1,0|1,0,0]=2 116 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)S WXVL_AK1886SB2708 [0,0,0,0,1,0|2,0,0]=3 117 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)S WXVL_AK1886SB2708 [0,0,0,0,1,0|2,0,0]=3 118 B17R0.14245 CCCCCCCCCCCCNC(=O)C(F)F WXVL_AK1886SB0079 [0,0,0,0,1,0|3,0,0]=4 119 B17R0.14245 CCCCCCCCCCCCNC(=O)C(F)F WXVL_AK1886SB0079 [0,0,0,0,1,0|3,0,0]=4 120 B17R0.14245 CCCCCCCCCCCCNC(=O)N(C)C WXVL_AN0032YV0205 [0,0,0,0,1,0|2,0,0]=3 121 B17R0.14245 CCCCCCCCCCCCNC(=O)N(C)C WXVL_AN0032YV0205 [0,0,0,0,1,0|2,0,0]=3 122 B17R0.14245 CCCCCCCCCCCCNC(=O)[C@@H](C)O WXVL_AK1886SB1085 [0,0,0,0,1,0|2,0,0]=3 123 B17R0.14245 CCCCCCCCCCCCNC(=O)[C@@H](C)O WXVL_AK1886SB1085 [0,0,0,0,1,0|2,0,0]=3 124 B19R0.157 C=C(C)CNC(=O)CCCCCCCCCCCCC WXVL_AK0761SB0562 [0,0,0,0,0,1|1,0,2]=4 125 B19R0.157 C=C(C)CNC(=O)CCCCCCCCCCCCC WXVL_AK0761SB0562 [0,0,0,0,0,1|1,0,2]=4 126 B19R0.157 CCCCCCCCCCCCCC(=O)NCC(C)C WXVL_AK00544SB0562 [0,0,0,0,0,1|1,0,0]=2 127 B19R0.157 CCCCCCCCCCCCCC(=O)NCC(C)C WXVL_AK00544SB0562 [0,0,0,0,0,1|1,0,0]=2 128 B19R0.157 CCCCCCCCCCCCCC(=O)NCC(C)O WXVL_AK0052SB0562 [0,0,0,0,0,1|2,0,0]=3 129 B19R0.157 CCCCCCCCCCCCCC(=O)NCC(C)O WXVL_AK0052SB0562 [0,0,0,0,0,1|2,0,0]=3 130 B19R0.157 CCCCCCCCCCCCCC(=O)NCC(F)F WXVL_AK0136SB0562 [0,0,0,0,0,1|3,0,0]=4 131 B19R0.157 CCCCCCCCCCCCCC(=O)NCC(F)F WXVL_AK0136SB0562 [0,0,0,0,0,1|3,0,0]=4 132 B19R0.157 CCCCCCCCCCCCCC(=O)NC[C@H](C)O WXVL_AK0113SB0562 [0,0,0,0,0,1|2,0,0]=3 133 B19R0.157 CCCCCCCCCCCCCC(=O)NC[C@H](C)O WXVL_AK0113SB0562 [0,0,0,0,0,1|2,0,0]=3 134 B19R0.157 CCCCCCCCCCCCNC(=O)/C=C/C(C)C WXVL_AK1886SB0036 [0,0,0,0,0,1|2,0,0]=3 135 B19R0.157 CCCCCCCCCCCCNC(=O)/C=C/C(C)C WXVL_AK1886SB0036 [0,0,0,0,0,1|2,0,0]=3 136 B19R0.157 CCCCCCCCCCCCNC(=O)CCC(C)C WXVL_AK1886SB0354 [0,0,0,0,0,1|2,0,0]=3 137 B19R0.157 CCCCCCCCCCCCNC(=O)CCC(C)C WXVL_AK1886SB0354 [0,0,0,0,0,1|2,0,0]=3 138 B19R0.157 CCCCCCCCCCCCNC(=O)CCN(C)C WXVL_AK1886SB00052 [0,0,0,0,0,1|3,0,0]=4 139 B19R0.157 CCCCCCCCCCCCNC(=O)CCN(C)C WXVL_AK1886SB00052 [0,0,0,0,0,1|3,0,0]=4 140 B19R0.157 CCCCCCCCCCCCNC(=O)COC(=O)C WXVL_AK1886SB2824 [0,0,0,0,0,1|2,0,1]=4 141 B19R0.157 CCCCCCCCCCCCNC(=O)COC(=O)C WXVL_AK1886SB2824 [0,0,0,0,0,1|2,0,1]=4 142 B19R0.157 CCCCCCCCCCCCNC(=O)COC(C)C WXVL_AK1886SB0213 [0,0,0,0,0,1|1,0,0]=2 143 B19R0.157 CCCCCCCCCCCCNC(=O)COC(C)C WXVL_AK1886SB0213 [0,0,0,0,0,1|1,0,0]=2 144 B19R0.157 CCCCCCCCCCCCNC(=O)NCC(C)C WXVL_AK00544YV0205 [0,0,0,0,0,1|2,0,0]=3 145 B19R0.157 CCCCCCCCCCCCNC(=O)NCC(C)C WXVL_AK00544YV0205 [0,0,0,0,0,1|2,0,0]=3 146 B19R0.157 CCCCCCCCCCCCNC(=O)NCC(C)O WXVL_AK0052YV0205 [0,0,0,0,0,1|3,0,0]=4 147 B19R0.157 CCCCCCCCCCCCNC(=O)NCC(C)O WXVL_AK0052YV0205 [0,0,0,0,0,1|3,0,0]=4 148 B19R0.157 CCCCCCCCCCCCNC(=O)NC[C@H](C)O WXVL_AK0113YV0205 [0,0,0,0,0,1|3,0,0]=4 149 B19R0.157 CCCCCCCCCCCCNC(=O)NC[C@H](C)O WXVL_AK0113YV0205 [0,0,0,0,0,1|3,0,0]=4 150 B16R0.61 CCCCCCCCCCCCC(=O)NCC WXVL_AK00476SB0547 [2,0,0,0,0,0|1,0,0]=3 151 B16R0.61 CCCCCCCCCCCCC(=O)NCC WXVL_AK00476SB0547 [2,0,0,0,0,0|1,0,0]=3 152 B16R0.61 CCNC(=O)CCCCCCCCCCCBr WXVL_AK00476SB0603 [2,0,0,0,0,0|2,0,0]=4 153 B16R0.61 CCNC(=O)CCCCCCCCCCCBr WXVL_AK00476SB0603 [2,0,0,0,0,0|2,0,0]=4 154 B16R0.302 CCCCCCCCCCCC(=O)NC(C)C WXVL_AK0030SB2796 [2,0,0,0,0,0|1,0,0]=3 155 B16R0.302 CCCCCCCCCCCC(=O)NC(C)C WXVL_AK0030SB2796 [2,0,0,0,0,0|1,0,0]=3 156 B16R0.302 CCCCCCCCCCNC(=O)CC(C)C WXVL_AK1845SB0063 [2,0,0,0,0,0|2,0,0]=4 157 B16R0.302 CCCCCCCCCCNC(=O)CC(C)C WXVL_AK1845SB0063 [2,0,0,0,0,0|2,0,0]=4 158 B16R0.221 CCCCCCCCCCCCCC(=O)NC WXVL_AK00442SB0562 [2,0,0,0,0,0|1,0,0]=3 159 B16R0.221 CCCCCCCCCCCCCC(=O)NC WXVL_AK00442SB0562 [2,0,0,0,0,0|1,0,0]=3 160 B16R0.221 CCCCCCCCCCCCNC(=O)CC WXVL_AK1886SB0064 [2,0,0,0,0,0|1,0,0]=3 161 B16R0.221 CCCCCCCCCCCCNC(=O)CC WXVL_AK1886SB0064 [2,0,0,0,0,0|1,0,0]=3 162 B16R0.221 CCCCCCCCCCCCNC(=O)CO WXVL_AK1886SB2706 [2,0,0,0,0,0|2,0,0]=4 163 B16R0.221 CCCCCCCCCCCCNC(=O)CO WXVL_AK1886SB2706 [2,0,0,0,0,0|2,0,0]=4 164 B16R0.221 CCCCCCCCCCCCNC(=O)NC WXVL_AK00442YV0205 [2,0,0,0,0,0|2,0,0]=4 165 B16R0.221 CCCCCCCCCCCCNC(=O)NC WXVL_AK00442YV0205 [2,0,0,0,0,0|2,0,0]=4 166 B18R0.174 CCCCCCCCCCCCCNC(=O)C(C)C WXVL_AK4135SB0052 [1,1,0,0,0,0|2,0,0]=4 167 B18R0.174 CCCCCCCCCCCCCNC(=O)C(C)C WXVL_AK4135SB0052 [1,1,0,0,0,0|2,0,0]=4 168 B18R0.175 C#C[C@@H](C)NC(=O)CCCCCCCCCCCC WXVL_AK00735SB0547 [1,1,0,0,0,0|1,0,1]=4 169 B18R0.175 C#C[C@@H](C)NC(=O)CCCCCCCCCCCC WXVL_AK00735SB0547 [1,1,0,0,0,0|1,0,1]=4 170 B18R0.175 C=CC(C)NC(=O)CCCCCCCCCCCC WXVL_AK00769SB0547 [1,1,0,0,0,0|1,0,1]=4 171 B18R0.175 C=CC(C)NC(=O)CCCCCCCCCCCC WXVL_AK00769SB0547 [1,1,0,0,0,0|1,0,1]=4 172 B18R0.175 CCCCCCCCCCCCC(=O)NC(C)C#N WXVL_AK00810SB0547 [1,1,0,0,0,0|1,0,1]=4 173 B18R0.175 CCCCCCCCCCCCC(=O)NC(C)C#N WXVL_AK00810SB0547 [1,1,0,0,0,0|1,0,1]=4 174 B18R0.175 CCCCCCCCCCCCC(=O)N[C@@H](C)CC WXVL_AK00678SB0547 [1,1,0,0,0,0|1,0,0]=3 175 B18R0.175 CCCCCCCCCCCCC(=O)N[C@@H](C)CC WXVL_AK00678SB0547 [1,1,0,0,0,0|1,0,0]=3 176 B18R0.175 CCCCCCCCCCCCC(=O)N[C@@H](C)CF WXVL_AK00558SB0547 [1,1,0,0,0,0|1,0,0]=3 177 B18R0.175 CCCCCCCCCCCCC(=O)N[C@@H](C)CF WXVL_AK00558SB0547 [1,1,0,0,0,0|1,0,0]=3 178 B18R0.175 CCCCCCCCCCCCC(=O)N[C@@H](C)CO WXVL_AK0109SB0547 [1,1,0,0,0,0|1,0,0]=3 179 B18R0.175 CCCCCCCCCCCCC(=O)N[C@@H](C)CO WXVL_AK0109SB0547 [1,1,0,0,0,0|1,0,0]=3 180 B18R0.175 CC[C@H](C)NC(=O)CCCCCCCCCCCBr WXVL_AK00678SB0603 [1,1,0,0,0,0|2,0,0]=4 181 B18R0.175 CC[C@H](C)NC(=O)CCCCCCCCCCCBr WXVL_AK00678SB0603 [1,1,0,0,0,0|2,0,0]=4 182 B18R0.175 C[C@@H](CF)NC(=O)CCCCCCCCCCCBr WXVL_AK00558SB0603 [1,1,0,0,0,0|2,0,0]=4 183 B18R0.175 C[C@@H](CF)NC(=O)CCCCCCCCCCCBr WXVL_AK00558SB0603 [1,1,0,0,0,0|2,0,0]=4 184 B18R0.175 C[C@@H](CO)NC(=O)CCCCCCCCCCCBr WXVL_AK0109SB0603 [1,1,0,0,0,0|2,0,0]=4 185 B18R0.175 C[C@@H](CO)NC(=O)CCCCCCCCCCCBr WXVL_AK0109SB0603 [1,1,0,0,0,0|2,0,0]=4 186 B18R0.188 CC(C)(C)NC(=O)CCCCCCCCCCCBr WXVL_AK0024SB0603 [1,1,0,0,0,0|2,0,0]=4 187 B18R0.188 CC(C)(C)NC(=O)CCCCCCCCCCCBr WXVL_AK0024SB0603 [1,1,0,0,0,0|2,0,0]=4 188 B18R0.188 CCCCCCCCCCCCC(=O)NC(C)(C)C WXVL_AK0024SB0547 [1,1,0,0,0,0|1,0,0]=3 189 B18R0.188 CCCCCCCCCCCCC(=O)NC(C)(C)C WXVL_AK0024SB0547 [1,1,0,0,0,0|1,0,0]=3 190 B18R0.13761 CCCCCCCCCCCCS(=O)(=O)NC(C)C WXVL_AK0030HU0325 [1,1,0,0,0,0|2,0,0]=4 191 B18R0.13761 CCCCCCCCCCCCS(=O)(=O)NC(C)C WXVL_AK0030HU0325 [1,1,0,0,0,0|2,0,0]=4 192 B18R0.19787 CC(C)N(C)C(=O)CCCCCCCCCCCBr WXVL_AN0073SB0603 [1,1,0,0,0,0|2,0,0]=4 193 B18R0.19787 CC(C)N(C)C(=O)CCCCCCCCCCCBr WXVL_AN0073SB0603 [1,1,0,0,0,0|2,0,0]=4 194 B18R0.19787 CCCCCCCCCCCCC(=O)N(C)C(C)C WXVL_AN0073SB0547 [1,1,0,0,0,0|1,0,0]=3 195 B18R0.19787 CCCCCCCCCCCCC(=O)N(C)C(C)C WXVL_AN0073SB0547 [1,1,0,0,0,0|1,0,0]=3 196 B18R0.45 CCCCCCCCCCNC(=O)CC(=O)OCC WXVL_AK1845SB3094 [1,1,0,0,0,0|1,0,1]=4 197 B18R0.45 CCCCCCCCCCNC(=O)CC(=O)OCC WXVL_AK1845SB3094 [1,1,0,0,0,0|1,0,1]=4 198 B18R0.110 C/C=C/C(=O)NCCCCCCCCCCCCC WXVL_AK4135SB0340 [1,1,0,0,0,0|1,0,1]=4 199 B18R0.110 C/C=C/C(=O)NCCCCCCCCCCCCC WXVL_AK4135SB0340 [1,1,0,0,0,0|1,0,1]=4 200 B18R0.110 CC#CC(=O)NCCCCCCCCCCCCC WXVL_AK4135SB1240 [1,1,0,0,0,0|1,0,1]=4 201 B18R0.110 CC#CC(=O)NCCCCCCCCCCCCC WXVL_AK4135SB1240 [1,1,0,0,0,0|1,0,1]=4 202 B18R0.110 CCCC(=O)NCCCCCCCCCCCCO WXVL_AK3055SB0073 [1,1,0,0,0,0|2,0,0]=4 203 B18R0.110 CCCC(=O)NCCCCCCCCCCCCO WXVL_AK3055SB0073 [1,1,0,0,0,0|2,0,0]=4 204 B18R0.110 CCCCCCCCCCCCCCC(=O)NCC WXVL_AK00476SB0577 [1,1,0,0,0,0|1,0,0]=3 205 B18R0.110 CCCCCCCCCCCCCCC(=O)NCC WXVL_AK00476SB0577 [1,1,0,0,0,0|1,0,0]=3 206 B18R0.110 CCCCCCCCCCCCCNC(=O)CCC WXVL_AK4135SB0073 [1,1,0,0,0,0|1,0,0]=3 207 B18R0.110 CCCCCCCCCCCCCNC(=O)CCC WXVL_AK4135SB0073 [1,1,0,0,0,0|1,0,0]=3 208 B18R0.110 CCCCCCCCCCCCCNC(=O)COC WXVL_AK4135SB0090 [1,1,0,0,0,0|2,0,0]=4 209 B18R0.110 CCCCCCCCCCCCCNC(=O)COC WXVL_AK4135SB0090 [1,1,0,0,0,0|2,0,0]=4 210 B18R0.110 CCCCCCCCCCCCCNC(=O)CSC WXVL_AK4135SB1267 [1,1,0,0,0,0|2,0,0]=4 211 B18R0.110 CCCCCCCCCCCCCNC(=O)CSC WXVL_AK4135SB1267 [1,1,0,0,0,0|2,0,0]=4 212 B18R0.189 CCCCCCCCCCCCNC(=O)C(=O)CC WXVL_AK1886SB0344 [1,1,0,0,0,0|2,0,0]=4 213 B18R0.189 CCCCCCCCCCCCNC(=O)C(=O)CC WXVL_AK1886SB0344 [1,1,0,0,0,0|2,0,0]=4 214 B18R0.189 CCCCCCCCCCCCNC(=O)C(C)CC WXVL_AK1886SB0054 [1,1,0,0,0,0|2,0,0]=4 215 B18R0.189 CCCCCCCCCCCCNC(=O)C(C)CC WXVL_AK1886SB0054 [1,1,0,0,0,0|2,0,0]=4 216 B18R0.189 CCCCCCCCCCCCNC(=O)[C@@H](O)CC WXVL_AK1886SB3573 [1,1,0,0,0,0|2,0,0]=4 217 B18R0.189 CCCCCCCCCCCCNC(=O)[C@@H](O)CC WXVL_AK1886SB3573 [1,1,0,0,0,0|2,0,0]=4 218 B18R0.189 CCCCCCCCCCCCNC(=O)[C@H](C)CC WXVL_AK1886SB00054 [1,1,0,0,0,0|2,0,0]=4 219 B18R0.189 CCCCCCCCCCCCNC(=O)[C@H](C)CC WXVL_AK1886SB00054 [1,1,0,0,0,0|2,0,0]=4 220 B18R0.3155 C=CCNC(=O)CCCCCCCCCCCCC WXVL_AK00561SB0562 [1,1,0,0,0,0|1,0,1]=4 221 B18R0.3155 C=CCNC(=O)CCCCCCCCCCCCC WXVL_AK00561SB0562 [1,1,0,0,0,0|1,0,1]=4 222 B18R0.3155 CCCCCCCCCCCCCC(=O)NCC#N WXVL_AK0683SB0562 [1,1,0,0,0,0|1,0,1]=4 223 B18R0.3155 CCCCCCCCCCCCCC(=O)NCC#N WXVL_AK0683SB0562 [1,1,0,0,0,0|1,0,1]=4 224 B18R0.3155 CCCCCCCCCCCCCC(=O)NCCC WXVL_AK00504SB0562 [1,1,0,0,0,0|1,0,0]=3 225 B18R0.3155 CCCCCCCCCCCCCC(=O)NCCC WXVL_AK00504SB0562 [1,1,0,0,0,0|1,0,0]=3 226 B18R0.3155 CCCCCCCCCCCCCC(=O)NCCF WXVL_AK00466SB0562 [1,1,0,0,0,0|1,0,0]=3 227 B18R0.3155 CCCCCCCCCCCCCC(=O)NCCF WXVL_AK00466SB0562 [1,1,0,0,0,0|1,0,0]=3 228 B18R0.3155 CCCCCCCCCCCCNC(=O)CCOC WXVL_AK1886SB0156 [1,1,0,0,0,0|2,0,0]=4 229 B18R0.3155 CCCCCCCCCCCCNC(=O)CCOC WXVL_AK1886SB0156 [1,1,0,0,0,0|2,0,0]=4 230 B18R0.3155 CCCCCCCCCCCCNC(=O)CCSC WXVL_AK1886SB0361 [1,1,0,0,0,0|2,0,0]=4 231 B18R0.3155 CCCCCCCCCCCCNC(=O)CCSC WXVL_AK1886SB0361 [1,1,0,0,0,0|2,0,0]=4 232 B18R0.3155 CCCCCCCCCCCCNC(=O)COCC WXVL_AK1886SB0091 [1,1,0,0,0,0|1,0,0]=3 233 B18R0.3155 CCCCCCCCCCCCNC(=O)COCC WXVL_AK1886SB0091 [1,1,0,0,0,0|1,0,0]=3 234 B18R0.3155 CCCCCCCCCCCCNC(=O)CSCC WXVL_AK1886SB0002 [1,1,0,0,0,0|1,1,0]=4 235 B18R0.3155 CCCCCCCCCCCCNC(=O)CSCC WXVL_AK1886SB0002 [1,1,0,0,0,0|1,1,0]=4 236 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCC WXVL_AK00504YV0205 [1,1,0,0,0,0|2,0,0]=4 237 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCC WXVL_AK00504YV0205 [1,1,0,0,0,0|2,0,0]=4 238 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCCl WXVL_AK1886YV0092 [1,1,0,0,0,0|2,0,0]=4 239 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCCl WXVL_AK1886YV0092 [1,1,0,0,0,0|2,0,0]=4 240 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCF WXVL_AK00466YV0205 [1,1,0,0,0,0|2,0,0]=4 241 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCF WXVL_AK00466YV0205 [1,1,0,0,0,0|2,0,0]=4 242 B18R0.11638 CCCCCCCCCC(=O)NCCC(=O)OCC WXVL_AK0465SB0447 [1,1,0,0,0,0|1,0,1]=4 243 B18R0.11638 CCCCCCCCCC(=O)NCCC(=O)OCC WXVL_AK0465SB0447 [1,1,0,0,0,0|1,0,1]=4 244 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)Br WXVL_AK1886SB0432 [0,1,0,0,1,0|1,0,0]=3 245 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)Br WXVL_AK1886SB0432 [0,1,0,0,1,0|1,0,0]=3 246 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)C WXVL_AK1886SB0078 [0,1,0,0,1,0|1,0,0]=3 247 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)C WXVL_AK1886SB0078 [0,1,0,0,1,0|1,0,0]=3 248 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)F WXVL_AK1886SB0199 [0,1,0,0,1,0|1,0,0]=3 249 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)F WXVL_AK1886SB0199 [0,1,0,0,1,0|1,0,0]=3 250 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)O WXVL_AK1886SB0125 [0,1,0,0,1,0|1,0,0]=3 251 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)O WXVL_AK1886SB0125 [0,1,0,0,1,0|1,0,0]=3 252 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(F)F WXVL_AK1886SB0197 [0,1,0,0,1,0|2,0,0]=4 253 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(F)F WXVL_AK1886SB0197 [0,1,0,0,1,0|2,0,0]=4 254 B18R0.19914 CCCCCCCCCCCCNS(=O)(=O)C(C)C WXVL_AK1886HU0023 [0,1,0,0,1,0|2,0,0]=4 255 B18R0.19914 CCCCCCCCCCCCNS(=O)(=O)C(C)C WXVL_AK1886HU0023 [0,1,0,0,1,0|2,0,0]=4 256 B20R0.3041 CC(C)/C=C/C(=O)NCCCCCCCCCCCCO WXVL_AK3055SB0036 [0,1,0,0,0,1|2,0,0]=4 257 B20R0.3041 CC(C)/C=C/C(=O)NCCCCCCCCCCCCO WXVL_AK3055SB0036 [0,1,0,0,0,1|2,0,0]=4 258 B20R0.3041 CC(C)CCC(=O)NCCCCCCCCCCCCO WXVL_AK3055SB0354 [0,1,0,0,0,1|2,0,0]=4 259 B20R0.3041 CC(C)CCC(=O)NCCCCCCCCCCCCO WXVL_AK3055SB0354 [0,1,0,0,0,1|2,0,0]=4 260 B20R0.3041 CC(C)OCC(=O)NCCCCCCCCCCCCO WXVL_AK3055SB0213 [0,1,0,0,0,1|1,0,0]=3 261 B20R0.3041 CC(C)OCC(=O)NCCCCCCCCCCCCO WXVL_AK3055SB0213 [0,1,0,0,0,1|1,0,0]=3 262 B20R0.3041 CCCCCCCCCCCCCCC(=O)NCC(C)C WXVL_AK00544SB0577 [0,1,0,0,0,1|1,0,0]=3 263 B20R0.3041 CCCCCCCCCCCCCCC(=O)NCC(C)C WXVL_AK00544SB0577 [0,1,0,0,0,1|1,0,0]=3 264 B20R0.3041 CCCCCCCCCCCCCCC(=O)NCC(C)O WXVL_AK0052SB0577 [0,1,0,0,0,1|2,0,0]=4 265 B20R0.3041 CCCCCCCCCCCCCCC(=O)NCC(C)O WXVL_AK0052SB0577 [0,1,0,0,0,1|2,0,0]=4 266 B20R0.3041 CCCCCCCCCCCCCCC(=O)NC[C@H](C)O WXVL_AK0113SB0577 [0,1,0,0,0,1|2,0,0]=4 267 B20R0.3041 CCCCCCCCCCCCCCC(=O)NC[C@H](C)O WXVL_AK0113SB0577 [0,1,0,0,0,1|2,0,0]=4 268 B20R0.3041 CCCCCCCCCCCCCNC(=O)/C=C/C(C)C WXVL_AK4135SB0036 [0,1,0,0,0,1|1,0,0]=3 269 B20R0.3041 CCCCCCCCCCCCCNC(=O)/C=C/C(C)C WXVL_AK4135SB0036 [0,1,0,0,0,1|1,0,0]=3 270 B20R0.3041 CCCCCCCCCCCCCNC(=O)CCC(C)C WXVL_AK4135SB0354 [0,1,0,0,0,1|1,0,0]=3 271 B20R0.3041 CCCCCCCCCCCCCNC(=O)CCC(C)C WXVL_AK4135SB0354 [0,1,0,0,0,1|1,0,0]=3 272 B20R0.3041 CCCCCCCCCCCCCNC(=O)CCN(C)C WXVL_AK4135SB00052 [0,1,0,0,0,1|2,0,0]=4 273 B20R0.3041 CCCCCCCCCCCCCNC(=O)CCN(C)C WXVL_AK4135SB00052 [0,1,0,0,0,1|2,0,0]=4 274 B20R0.3041 CCCCCCCCCCCCCNC(=O)COC(=O)C WXVL_AK4135SB2824 [0,1,0,0,0,1|1,0,1]=4 275 B20R0.3041 CCCCCCCCCCCCCNC(=O)COC(=O)C WXVL_AK4135SB2824 [0,1,0,0,0,1|1,0,1]=4 276 B20R0.3041 CCCCCCCCCCCCCNC(=O)COC(C)C WXVL_AK4135SB0213 [0,1,0,0,0,1|0,0,0]=2 277 B20R0.3041 CCCCCCCCCCCCCNC(=O)COC(C)C WXVL_AK4135SB0213 [0,1,0,0,0,1|0,0,0]=2 278 B20R0.16580 CCCCCCCCCCCCNC(=O)C(O)CC(C)C WXVL_AK1886SB4281 [0,1,0,0,0,1|2,0,0]=4 279 B20R0.16580 CCCCCCCCCCCCNC(=O)C(O)CC(C)C WXVL_AK1886SB4281 [0,1,0,0,0,1|2,0,0]=4 280 B20R0.22320 CCCCCCCCCCCCCC(=O)NC[C@@H](C)OC WXVL_AK00704SB0562 [0,1,0,0,0,1|1,0,0]=3 281 B20R0.22320 CCCCCCCCCCCCCC(=O)NC[C@@H](C)OC WXVL_AK00704SB0562 [0,1,0,0,0,1|1,0,0]=3 282 B20R0.22320 CCCCCCCCCCCCCC(=O)NC[C@@H](F)CO WXVL_AK00590SB0562 [0,1,0,0,0,1|2,0,0]=4 283 B20R0.22320 CCCCCCCCCCCCCC(=O)NC[C@@H](F)CO WXVL_AK00590SB0562 [0,1,0,0,0,1|2,0,0]=4 284 B20R0.22320 CCCCCCCCCCCCCC(=O)NC[C@H](O)CO WXVL_AK00483SB0562 [0,1,0,0,0,1|2,0,0]=4 285 B20R0.22320 CCCCCCCCCCCCCC(=O)NC[C@H](O)CO WXVL_AK00483SB0562 [0,1,0,0,0,1|2,0,0]=4 286 B20R0.22320 CCCCCCCCCCCCNC(=O)NC[C@@H](C)OC WXVL_AK00704YV0205 [0,1,0,0,0,1|2,0,0]=4 287 B20R0.22320 CCCCCCCCCCCCNC(=O)NC[C@@H](C)OC WXVL_AK00704YV0205 [0,1,0,0,0,1|2,0,0]=4 288 B20R0.22322 CCCCCCCCCCCCCC(=O)NCC(C)(C)C WXVL_AK00655SB0562 [0,1,0,0,0,1|1,0,0]=3 289 B20R0.22322 CCCCCCCCCCCCCC(=O)NCC(C)(C)C WXVL_AK00655SB0562 [0,1,0,0,0,1|1,0,0]=3 290 B20R0.22322 CCCCCCCCCCCCCC(=O)NCC(C)(C)F WXVL_AK00660SB0562 [0,1,0,0,0,1|1,0,0]=3 291 B20R0.22322 CCCCCCCCCCCCCC(=O)NCC(C)(C)F WXVL_AK00660SB0562 [0,1,0,0,0,1|1,0,0]=3 292 B20R0.22322 CCCCCCCCCCCCCC(=O)NCC(C)(C)O WXVL_AK0490SB0562 [0,1,0,0,0,1|1,0,0]=3 293 B20R0.22322 CCCCCCCCCCCCCC(=O)NCC(C)(C)O WXVL_AK0490SB0562 [0,1,0,0,0,1|1,0,0]=3 294 B20R0.22322 CCCCCCCCCCCCCC(=O)NCC(C)(F)F WXVL_AK0308SB0562 [0,1,0,0,0,1|2,0,0]=4 295 B20R0.22322 CCCCCCCCCCCCCC(=O)NCC(C)(F)F WXVL_AK0308SB0562 [0,1,0,0,0,1|2,0,0]=4 296 B20R0.22322 CCCCCCCCCCCCNC(=O)COC(C)(C)C WXVL_AK1886SB1440 [0,1,0,0,0,1|1,0,0]=3 297 B20R0.22322 CCCCCCCCCCCCNC(=O)COC(C)(C)C WXVL_AK1886SB1440 [0,1,0,0,0,1|1,0,0]=3 298 B20R0.22322 CCCCCCCCCCCCNC(=O)NCC(C)(C)C WXVL_AK00655YV0205 [0,1,0,0,0,1|2,0,0]=4 299 B20R0.22322 CCCCCCCCCCCCNC(=O)NCC(C)(C)C WXVL_AK00655YV0205 [0,1,0,0,0,1|2,0,0]=4 300 B20R0.22322 CCCCCCCCCCCCNC(=O)NCC(C)(C)F WXVL_AK00660YV0205 [0,1,0,0,0,1|2,0,0]=4 301 B20R0.22322 CCCCCCCCCCCCNC(=O)NCC(C)(C)F WXVL_AK00660YV0205 [0,1,0,0,0,1|2,0,0]=4 302 B20R0.22322 CCCCCCCCCCCCNC(=O)NCC(C)(C)O WXVL_AK0490YV0205 [0,1,0,0,0,1|2,0,0]=4 303 B20R0.22322 CCCCCCCCCCCCNC(=O)NCC(C)(C)O WXVL_AK0490YV0205 [0,1,0,0,0,1|2,0,0]=4 304 B20R0.32513 CCCCCCCCCCCCNC(=O)CN(C)C(C)C WXVL_AK1886SB0019 [0,1,0,0,0,1|2,0,0]=4 305 B20R0.32513 CCCCCCCCCCCCNC(=O)CN(C)C(C)C WXVL_AK1886SB0019 [0,1,0,0,0,1|2,0,0]=4 306 B20R0.109 CC(C)C(=O)C(=O)NCCCCCCCCCCCCO WXVL_AK3055SB2578 [0,2,0,0,0,0|2,0,0]=4 307 B20R0.109 CC(C)C(=O)C(=O)NCCCCCCCCCCCCO WXVL_AK3055SB2578 [0,2,0,0,0,0|2,0,0]=4 308 B20R0.109 CC(C)C(O)C(=O)NCCCCCCCCCCCCO WXVL_AK3055SB1147 [0,2,0,0,0,0|2,0,0]=4 309 B20R0.109 CC(C)C(O)C(=O)NCCCCCCCCCCCCO WXVL_AK3055SB1147 [0,2,0,0,0,0|2,0,0]=4 310 B20R0.109 CCCCCCCCCCCCCCC(=O)N(C)C(C)C WXVL_AN0073SB0577 [0,2,0,0,0,0|1,0,0]=3 311 B20R0.109 CCCCCCCCCCCCCCC(=O)N(C)C(C)C WXVL_AN0073SB0577 [0,2,0,0,0,0|1,0,0]=3 312 B20R0.109 CCCCCCCCCCCCCNC(=O)C(=O)C(C)C WXVL_AK4135SB2578 [0,2,0,0,0,0|1,0,0]=3 313 B20R0.109 CCCCCCCCCCCCCNC(=O)C(=O)C(C)C WXVL_AK4135SB2578 [0,2,0,0,0,0|1,0,0]=3 314 B20R0.109 CCCCCCCCCCCCCNC(=O)C(O)C(C)C WXVL_AK4135SB1147 [0,2,0,0,0,0|1,0,0]=3 315 B20R0.109 CCCCCCCCCCCCCNC(=O)C(O)C(C)C WXVL_AK4135SB1147 [0,2,0,0,0,0|1,0,0]=3 316 B20R0.2931 CCCCCCCCCCCCCCCC(=O)NC(C)C WXVL_AK0030SB2751 [0,2,0,0,0,0|1,0,0]=3 317 B20R0.2931 CCCCCCCCCCCCCCCC(=O)NC(C)C WXVL_AK0030SB2751 [0,2,0,0,0,0|1,0,0]=3 318 B20R0.2931 CCCCCCCCCCCCCCNC(=O)C=C(C)C WXVL_AK2576SB0342 [0,2,0,0,0,0|1,0,1]=4 319 B20R0.2931 CCCCCCCCCCCCCCNC(=O)C=C(C)C WXVL_AK2576SB0342 [0,2,0,0,0,0|1,0,1]=4 320 B20R0.2931 CCCCCCCCCCCCCCNC(=O)CC(C)C WXVL_AK2576SB0063 [0,2,0,0,0,0|1,0,0]=3 321 B20R0.2931 CCCCCCCCCCCCCCNC(=O)CC(C)C WXVL_AK2576SB0063 [0,2,0,0,0,0|1,0,0]=3 322 B20R0.2931 CCCCCCCCCCCCCCNC(=O)CC(C)O WXVL_AK2576SB3643 [0,2,0,0,0,0|2,0,0]=4 323 B20R0.2931 CCCCCCCCCCCCCCNC(=O)CC(C)O WXVL_AK2576SB3643 [0,2,0,0,0,0|2,0,0]=4 324 B20R0.2931 CCCCCCCCCCCCCCNC(=O)CN(C)C WXVL_AK2576SB0085 [0,2,0,0,0,0|2,0,0]=4 325 B20R0.2931 CCCCCCCCCCCCCCNC(=O)CN(C)C WXVL_AK2576SB0085 [0,2,0,0,0,0|2,0,0]=4 326 B20R0.32503 C#C[C@@H](C)NC(=O)CCCCCCCCCCCCCC WXVL_AK00735SB0577 [0,2,0,0,0,0|1,0,1]=4 327 B20R0.32503 C#C[C@@H](C)NC(=O)CCCCCCCCCCCCCC WXVL_AK00735SB0577 [0,2,0,0,0,0|1,0,1]=4 328 B20R0.32503 C=CC(C)NC(=O)CCCCCCCCCCCCCC WXVL_AK00769SB0577 [0,2,0,0,0,0|1,0,1]=4 329 B20R0.32503 C=CC(C)NC(=O)CCCCCCCCCCCCCC WXVL_AK00769SB0577 [0,2,0,0,0,0|1,0,1]=4 330 B20R0.32503 CCC(C)CC(=O)NCCCCCCCCCCCCO WXVL_AK3055SB0353 [0,2,0,0,0,0|2,0,0]=4 331 B20R0.32503 CCC(C)CC(=O)NCCCCCCCCCCCCO WXVL_AK3055SB0353 [0,2,0,0,0,0|2,0,0]=4 332 B20R0.32503 CCCCCCCCCCCCCCC(=O)NC(C)C#N WXVL_AK00810SB0577 [0,2,0,0,0,0|1,0,1]=4 333 B20R0.32503 CCCCCCCCCCCCCCC(=O)NC(C)C#N WXVL_AK00810SB0577 [0,2,0,0,0,0|1,0,1]=4 334 B20R0.32503 CCCCCCCCCCCCCCC(=O)N[C@@H](C)CC WXVL_AK00678SB0577 [0,2,0,0,0,0|1,0,0]=3 335 B20R0.32503 CCCCCCCCCCCCCCC(=O)N[C@@H](C)CC WXVL_AK00678SB0577 [0,2,0,0,0,0|1,0,0]=3 336 B20R0.32503 CCCCCCCCCCCCCCC(=O)N[C@@H](C)CF WXVL_AK00558SB0577 [0,2,0,0,0,0|1,0,0]=3 337 B20R0.32503 CCCCCCCCCCCCCCC(=O)N[C@@H](C)CF WXVL_AK00558SB0577 [0,2,0,0,0,0|1,0,0]=3 338 B20R0.32503 CCCCCCCCCCCCCCC(=O)N[C@@H](C)CO WXVL_AK0109SB0577 [0,2,0,0,0,0|1,0,0]=3 339 B20R0.32503 CCCCCCCCCCCCCCC(=O)N[C@@H](C)CO WXVL_AK0109SB0577 [0,2,0,0,0,0|1,0,0]=3 340 B20R0.32503 CCCCCCCCCCCCCNC(=O)CC(C)CC WXVL_AK4135SB0353 [0,2,0,0,0,0|1,0,0]=3 341 B20R0.32503 CCCCCCCCCCCCCNC(=O)CC(C)CC WXVL_AK4135SB0353 [0,2,0,0,0,0|1,0,0]=3 342 B20R0.32503 CCCCCCCCCCCCCNC(=O)CC(O)CC WXVL_AK4135SB4092 [0,2,0,0,0,0|2,0,0]=4 343 B20R0.32503 CCCCCCCCCCCCCNC(=O)CC(O)CC WXVL_AK4135SB4092 [0,2,0,0,0,0|2,0,0]=4 344 B20R0.32503 CCCCCCCCCCCCCNC(=O)C[C@H](C)CC WXVL_AK4135SB8650 [0,2,0,0,0,0|1,0,0]=3 345 B20R0.32503 CCCCCCCCCCCCCNC(=O)C[C@H](C)CC WXVL_AK4135SB8650 [0,2,0,0,0,0|1,0,0]=3 346 B20R0.32503 CC[C@@H](C)CC(=O)NCCCCCCCCCCCCO WXVL_AK3055SB8650 [0,2,0,0,0,0|2,0,0]=4 347 B20R0.32503 CC[C@@H](C)CC(=O)NCCCCCCCCCCCCO WXVL_AK3055SB8650 [0,2,0,0,0,0|2,0,0]=4 348 B20R0.32515 CC(C)(C)CC(=O)NCCCCCCCCCCCCO WXVL_AK3055SB0062 [0,2,0,0,0,0|2,0,0]=4 349 B20R0.32515 CC(C)(C)CC(=O)NCCCCCCCCCCCCO WXVL_AK3055SB0062 [0,2,0,0,0,0|2,0,0]=4 350 B20R0.32515 CC(C)(O)CC(=O)NCCCCCCCCCCCCO WXVL_AK3055SB0163 [0,2,0,0,0,0|2,0,0]=4 351 B20R0.32515 CC(C)(O)CC(=O)NCCCCCCCCCCCCO WXVL_AK3055SB0163 [0,2,0,0,0,0|2,0,0]=4 352 B20R0.32515 CCCCCCCCCCCCCCC(=O)NC(C)(C)C WXVL_AK0024SB0577 [0,2,0,0,0,0|1,0,0]=3 353 B20R0.32515 CCCCCCCCCCCCCCC(=O)NC(C)(C)C WXVL_AK0024SB0577 [0,2,0,0,0,0|1,0,0]=3 354 B20R0.32515 CCCCCCCCCCCCCNC(=O)CC(C)(C)C WXVL_AK4135SB0062 [0,2,0,0,0,0|1,0,0]=3 355 B20R0.32515 CCCCCCCCCCCCCNC(=O)CC(C)(C)C WXVL_AK4135SB0062 [0,2,0,0,0,0|1,0,0]=3 356 B20R0.32515 CCCCCCCCCCCCCNC(=O)CC(C)(C)O WXVL_AK4135SB0163 [0,2,0,0,0,0|1,0,0]=3 357 B20R0.32515 CCCCCCCCCCCCCNC(=O)CC(C)(C)O WXVL_AK4135SB0163 [0,2,0,0,0,0|1,0,0]=3 358 B20R0.243007 CCCCCCCCCCCCCNS(=O)(=O)CC(C)C WXVL_AK4135HU0149 [0,2,0,0,0,0|2,0,0]=4 359 B20R0.243007 CCCCCCCCCCCCCNS(=O)(=O)CC(C)C WXVL_AK4135HU0149 [0,2,0,0,0,0|2,0,0]=4 360 B20R0.32896 CCCCCCCC(=O)NCCCCC(=O)OC(C)(C)C WXVL_AKB747SB0393 [0,2,0,0,0,0|1,0,1]=4 361 B20R0.32896 CCCCCCCC(=O)NCCCCC(=O)OC(C)(C)C WXVL_AKB747SB0393 [0,2,0,0,0,0|1,0,1]=4 362 B20R0.10075 CCCCCCCCC(=O)NCCCC(=O)OC(C)(C)C WXVL_AK2850SB0409 [0,2,0,0,0,0|1,0,1]=4 363 B20R0.10075 CCCCCCCCC(=O)NCCCC(=O)OC(C)(C)C WXVL_AK2850SB0409 [0,2,0,0,0,0|1,0,1]=4 364 B20R0.2971 CCCCCCCCCC(=O)NCCC(=O)OC(C)(C)C WXVL_AK00439SB0447 [0,2,0,0,0,0|1,0,1]=4 365 B20R0.2971 CCCCCCCCCC(=O)NCCC(=O)OC(C)(C)C WXVL_AK00439SB0447 [0,2,0,0,0,0|1,0,1]=4 366 B20R0.16581 C=C[C@@H](CO)NC(=O)CCCCCCCCCCCCC WXVL_AK00581SB0562 [0,2,0,0,0,0|1,0,1]=4 367 B20R0.16581 C=C[C@@H](CO)NC(=O)CCCCCCCCCCCCC WXVL_AK00581SB0562 [0,2,0,0,0,0|1,0,1]=4 368 B20R0.16581 CCCCCCCCCCCCCC(=O)NC(CO)CO WXVL_AK0741SB0562 [0,2,0,0,0,0|1,0,0]=3 369 B20R0.16581 CCCCCCCCCCCCCC(=O)NC(CO)CO WXVL_AK0741SB0562 [0,2,0,0,0,0|1,0,0]=3 370 B20R0.16581 CCCCCCCCCCCCCC(=O)N[C@H](CC)CO WXVL_AK0111SB0562 [0,2,0,0,0,0|1,0,0]=3 371 B20R0.16581 CCCCCCCCCCCCCC(=O)N[C@H](CC)CO WXVL_AK0111SB0562 [0,2,0,0,0,0|1,0,0]=3 372 B20R0.16581 CCCCCCCCCCCCNC(=O)NC(CO)CO WXVL_AK0741YV0205 [0,2,0,0,0,0|2,0,0]=4 373 B20R0.16581 CCCCCCCCCCCCNC(=O)NC(CO)CO WXVL_AK0741YV0205 [0,2,0,0,0,0|2,0,0]=4 374 B20R0.16581 CCCCCCCCCCCCNC(=O)N[C@H](CC)CO WXVL_AK0111YV0205 [0,2,0,0,0,0|2,0,0]=4 375 B20R0.16581 CCCCCCCCCCCCNC(=O)N[C@H](CC)CO WXVL_AK0111YV0205 [0,2,0,0,0,0|2,0,0]=4 376 B20R0.22212 CCCCCCCCCCCCCC(=O)NC(C)(C)CO WXVL_AK0025SB0562 [0,2,0,0,0,0|1,0,0]=3 377 B20R0.22212 CCCCCCCCCCCCCC(=O)NC(C)(C)CO WXVL_AK0025SB0562 [0,2,0,0,0,0|1,0,0]=3 378 B20R0.22212 CCCCCCCCCCCCNC(=O)NC(C)(C)CO WXVL_AK0025YV0205 [0,2,0,0,0,0|2,0,0]=4 379 B20R0.22212 CCCCCCCCCCCCNC(=O)NC(C)(C)CO WXVL_AK0025YV0205 [0,2,0,0,0,0|2,0,0]=4 380 B20R0.32384 CCCCCCCCCCCCCC(=O)NC(C)CCO WXVL_AK1288SB0562 [0,2,0,0,0,0|1,0,0]=3 381 B20R0.32384 CCCCCCCCCCCCCC(=O)NC(C)CCO WXVL_AK1288SB0562 [0,2,0,0,0,0|1,0,0]=3 382 B20R0.32384 CCCCCCCCCCCCCC(=O)N[C@@H](C)CC#N WXVL_AK00595SB0562 [0,2,0,0,0,0|1,0,0]=3 383 B20R0.32384 CCCCCCCCCCCCCC(=O)N[C@@H](C)CC#N WXVL_AK00595SB0562 [0,2,0,0,0,0|1,0,0]=3 384 B20R0.32384 CCCCCCCCCCCCCC(=O)N[C@@H](C)CCC WXVL_AK00682SB0562 [0,2,0,0,0,0|1,0,0]=3 385 B20R0.32384 CCCCCCCCCCCCCC(=O)N[C@@H](C)CCC WXVL_AK00682SB0562 [0,2,0,0,0,0|1,0,0]=3 386 B20R0.32384 CCCCCCCCCCCCCC(=O)N[C@@H](C)COC WXVL_AK0137SB0562 [0,2,0,0,0,0|1,0,0]=3 387 B20R0.32384 CCCCCCCCCCCCCC(=O)N[C@@H](C)COC WXVL_AK0137SB0562 [0,2,0,0,0,0|1,0,0]=3 388 B20R0.32384 CCCCCCCCCCCCCC(=O)N[C@H](C)COC WXVL_AK00613SB0562 [0,2,0,0,0,0|1,0,0]=3 389 B20R0.32384 CCCCCCCCCCCCCC(=O)N[C@H](C)COC WXVL_AK00613SB0562 [0,2,0,0,0,0|1,0,0]=3 390 B20R0.32384 CCCCCCCCCCCCNC(=O)NC(C)CCO WXVL_AK1288YV0205 [0,2,0,0,0,0|2,0,0]=4 391 B20R0.32384 CCCCCCCCCCCCNC(=O)NC(C)CCO WXVL_AK1288YV0205 [0,2,0,0,0,0|2,0,0]=4 392 B20R0.32384 CCCCCCCCCCCCNC(=O)N[C@@H](C)CC#N WXVL_AK00595YV0205 [0,2,0,0,0,0|2,0,0]=4 393 B20R0.32384 CCCCCCCCCCCCNC(=O)N[C@@H](C)CC#N WXVL_AK00595YV0205 [0,2,0,0,0,0|2,0,0]=4 394 B20R0.32384 CCCCCCCCCCCCNC(=O)N[C@@H](C)CCC WXVL_AK00682YV0205 [0,2,0,0,0,0|2,0,0]=4 395 B20R0.32384 CCCCCCCCCCCCNC(=O)N[C@@H](C)CCC WXVL_AK00682YV0205 [0,2,0,0,0,0|2,0,0]=4 396 B20R0.32384 CCCCCCCCCCCCNC(=O)N[C@@H](C)COC WXVL_AK0137YV0205 [0,2,0,0,0,0|2,0,0]=4 397 B20R0.32384 CCCCCCCCCCCCNC(=O)N[C@@H](C)COC WXVL_AK0137YV0205 [0,2,0,0,0,0|2,0,0]=4 398 B20R0.32384 CCCCCCCCCCCCNC(=O)N[C@H](C)COC WXVL_AK00613YV0205 [0,2,0,0,0,0|2,0,0]=4 399 B20R0.32384 CCCCCCCCCCCCNC(=O)N[C@H](C)COC WXVL_AK00613YV0205 [0,2,0,0,0,0|2,0,0]=4 400 B20R0.16798 CCCCCCCCCCC(=O)NCC(=O)OC(C)(C)C WXVL_AK0744SB0490 [0,2,0,0,0,0|1,0,1]=4 401 B20R0.16798 CCCCCCCCCCC(=O)NCC(=O)OC(C)(C)C WXVL_AK0744SB0490 [0,2,0,0,0,0|1,0,1]=4 402 B20R0.16798 CCCCCCCCCNC(=O)CCC(=O)OC(C)(C)C WXVL_AK1826SB3197 [0,2,0,0,0,0|1,0,1]=4 403 B20R0.16798 CCCCCCCCCNC(=O)CCC(=O)OC(C)(C)C WXVL_AK1826SB3197 [0,2,0,0,0,0|1,0,1]=4 404 B20R0.22312 CCCCCCCCCCCCNC(=O)[C@@H](O)C(C)(C)C WXVL_AK1886SB3694 [0,2,0,0,0,0|2,0,0]=4 405 B20R0.22312 CCCCCCCCCCCCNC(=O)[C@@H](O)C(C)(C)C WXVL_AK1886SB3694 [0,2,0,0,0,0|2,0,0]=4 406 B20R0.31941 CCCCCCCCCCC(=O)N[C@@H](C)C(=O)OC(C)C WXVL_AK0771SB0490 [0,2,0,0,0,0|1,0,1]=4 407 B20R0.31941 CCCCCCCCCCC(=O)N[C@@H](C)C(=O)OC(C)C WXVL_AK0771SB0490 [0,2,0,0,0,0|1,0,1]=4 408 B18R1.13741 CCCCCCCCCCCCC(=O)NC1CC1 WXVL_AK0001SB0547 [1,0,0,1,0,0|1,0,0]=3 409 B18R1.13741 CCCCCCCCCCCCC(=O)NC1CC1 WXVL_AK0001SB0547 [1,0,0,1,0,0|1,0,0]=3 410 B18R1.13741 O=C(CCCCCCCCCCCBr)NC1CC1 WXVL_AK0001SB0603 [1,0,0,1,0,0|2,0,0]=4 411 B18R1.13741 O=C(CCCCCCCCCCCBr)NC1CC1 WXVL_AK0001SB0603 [1,0,0,1,0,0|2,0,0]=4 412 B18R1.49730 CCCCCCCCCCCCNC(=O)C1CC1 WXVL_AK1886SB0038 [1,0,0,1,0,0|2,0,0]=4 413 B18R1.49730 CCCCCCCCCCCCNC(=O)C1CC1 WXVL_AK1886SB0038 [1,0,0,1,0,0|2,0,0]=4 414 B20R1.89451 CCCCCCCCCCCCNC(=O)C=CC1CC1 WXVL_AK1886SB4216 [0,0,0,1,0,1|2,0,0]=4 415 B20R1.89451 CCCCCCCCCCCCNC(=O)C=CC1CC1 WXVL_AK1886SB4216 [0,0,0,1,0,1|2,0,0]=4 416 B20R1.89451 CCCCCCCCCCCCNC(=O)CCC1CC1 WXVL_AK1886SB5360 [0,0,0,1,0,1|2,0,0]=4 417 B20R1.89451 CCCCCCCCCCCCNC(=O)CCC1CC1 WXVL_AK1886SB5360 [0,0,0,1,0,1|2,0,0]=4 418 B20R1.89453 CCCCCCCCCCCCCC(=O)N1CC(C1)C WXVL_AN0291SB0562 [0,0,0,1,0,1|1,0,0]=3 419 B20R1.89453 CCCCCCCCCCCCCC(=O)N1CC(C1)C WXVL_AN0291SB0562 [0,0,0,1,0,1|1,0,0]=3 420 B20R1.89453 CCCCCCCCCCCCCC(=O)N1CC(C1)O WXVL_AN0284SB0562 [0,0,0,1,0,1|2,0,0]=4 421 B20R1.89453 CCCCCCCCCCCCCC(=O)N1CC(C1)O WXVL_AN0284SB0562 [0,0,0,1,0,1|2,0,0]=4 422 B20R1.89453 CCCCCCCCCCCCNC(=O)N1CC(C1)C WXVL_AN0291YV0205 [0,0,0,1,0,1|2,0,0]=4 423 B20R1.89453 CCCCCCCCCCCCNC(=O)N1CC(C1)C WXVL_AN0291YV0205 [0,0,0,1,0,1|2,0,0]=4 424 B20R1.2817020 CCCCCCCCCCCCNC(=O)C1CC1(C)C WXVL_AK1886SB0012 [0,0,0,1,0,1|2,0,0]=4 425 B20R1.2817020 CCCCCCCCCCCCNC(=O)C1CC1(C)C WXVL_AK1886SB0012 [0,0,0,1,0,1|2,0,0]=4 426 B20R1.202097 CCCCCCCCCCCCCCC(=O)NC1CC1 WXVL_AK0001SB0577 [0,1,0,1,0,0|1,0,0]=3 427 B20R1.202097 CCCCCCCCCCCCCCC(=O)NC1CC1 WXVL_AK0001SB0577 [0,1,0,1,0,0|1,0,0]=3 428 B20R1.202097 CCCCCCCCCCCCCNC(=O)CC1CC1 WXVL_AK4135SB0155 [0,1,0,1,0,0|1,0,0]=3 429 B20R1.202097 CCCCCCCCCCCCCNC(=O)CC1CC1 WXVL_AK4135SB0155 [0,1,0,1,0,0|1,0,0]=3 430 B20R1.202097 O=C(CC1CC1)NCCCCCCCCCCCCO WXVL_AK3055SB0155 [0,1,0,1,0,0|2,0,0]=4 431 B20R1.202097 O=C(CC1CC1)NCCCCCCCCCCCCO WXVL_AK3055SB0155 [0,1,0,1,0,0|2,0,0]=4 432 B20R1.2989991 CC1CC1C(=O)NCCCCCCCCCCCCO WXVL_AK3055SB0041 [0,1,0,1,0,0|2,0,0]=4 433 B20R1.2989991 CC1CC1C(=O)NCCCCCCCCCCCCO WXVL_AK3055SB0041 [0,1,0,1,0,0|2,0,0]=4 434 B20R1.2989991 CCCCCCCCCCCCCNC(=O)C1CC1C WXVL_AK4135SB0041 [0,1,0,1,0,0|1,0,0]=3 435 B20R1.2989991 CCCCCCCCCCCCCNC(=O)C1CC1C WXVL_AK4135SB0041 [0,1,0,1,0,0|1,0,0]=3 436 B20R1.2989991 CCCCCCCCCCCCCNC(=O)[C@@H]1C[C@@H]1F WXVL_AK4135SB1245 [0,1,0,1,0,0|2,0,0]=4 437 B20R1.2989991 CCCCCCCCCCCCCNC(=O)[C@@H]1C[C@@H]1F WXVL_AK4135SB1245 [0,1,0,1,0,0|2,0,0]=4 438 B20R1.2989991 CCCCCCCCCCCCCNC(=O)[C@H]1C[C@H]1F WXVL_AK4135SB00019 [0,1,0,1,0,0|2,0,0]=4 439 B20R1.2989991 CCCCCCCCCCCCCNC(=O)[C@H]1C[C@H]1F WXVL_AK4135SB00019 [0,1,0,1,0,0|2,0,0]=4 440 B20R1.89450 CCCCCCCCCCCCCC(=O)NC1CNC1 WXVL_AK1291SB0562 [0,1,0,1,0,0|1,0,0]=3 441 B20R1.89450 CCCCCCCCCCCCCC(=O)NC1CNC1 WXVL_AK1291SB0562 [0,1,0,1,0,0|1,0,0]=3 442 B20R1.89450 CCCCCCCCCCCCCC(=O)NC1CSC1 WXVL_AK2089SB0562 [0,1,0,1,0,0|1,0,0]=3 443 B20R1.89450 CCCCCCCCCCCCCC(=O)NC1CSC1 WXVL_AK2089SB0562 [0,1,0,1,0,0|1,0,0]=3 444 B20R1.89450 CCCCCCCCCCCCNC(=O)CC1CCC1 WXVL_AK1886SB2207 [0,1,0,1,0,0|2,0,0]=4 445 B20R1.89450 CCCCCCCCCCCCNC(=O)CC1CCC1 WXVL_AK1886SB2207 [0,1,0,1,0,0|2,0,0]=4 446 B20R1.89450 CCCCCCCCCCCCNC(=O)NC1CNC1 WXVL_AK1291YV0205 [0,1,0,1,0,0|2,0,0]=4 447 B20R1.89450 CCCCCCCCCCCCNC(=O)NC1CNC1 WXVL_AK1291YV0205 [0,1,0,1,0,0|2,0,0]=4 448 B20R1.89450 CCCCCCCCCCCCNC(=O)NC1CSC1 WXVL_AK2089YV0205 [0,1,0,1,0,0|2,0,0]=4 449 B20R1.89450 CCCCCCCCCCCCNC(=O)NC1CSC1 WXVL_AK2089YV0205 [0,1,0,1,0,0|2,0,0]=4 450 B20R1.121906 CCCCCCCCCCCCCC(=O)NC1(CC1)C WXVL_AK0263SB0562 [0,1,0,1,0,0|1,0,0]=3 451 B20R1.121906 CCCCCCCCCCCCCC(=O)NC1(CC1)C WXVL_AK0263SB0562 [0,1,0,1,0,0|1,0,0]=3 452 B20R1.121906 CCCCCCCCCCCCNC(=O)NC1(CC1)C WXVL_AK0263YV0205 [0,1,0,1,0,0|2,0,0]=4 453 B20R1.121906 CCCCCCCCCCCCNC(=O)NC1(CC1)C WXVL_AK0263YV0205 [0,1,0,1,0,0|2,0,0]=4 454 B20R1.440082 CCCCCCCCCCCCCC(=O)N(C)C1CC1 WXVL_AN0276SB0562 [0,1,0,1,0,0|1,0,0]=3 455 B20R1.440082 CCCCCCCCCCCCCC(=O)N(C)C1CC1 WXVL_AN0276SB0562 [0,1,0,1,0,0|1,0,0]=3 456 B20R1.440082 CCCCCCCCCCCCNC(=O)C(=O)C1CC1 WXVL_AK1886SB3659 [0,1,0,1,0,0|2,0,0]=4 457 B20R1.440082 CCCCCCCCCCCCNC(=O)C(=O)C1CC1 WXVL_AK1886SB3659 [0,1,0,1,0,0|2,0,0]=4 458 B20R1.440082 CCCCCCCCCCCCNC(=O)N(C)C1CC1 WXVL_AN0276YV0205 [0,1,0,1,0,0|2,0,0]=4 459 B20R1.440082 CCCCCCCCCCCCNC(=O)N(C)C1CC1 WXVL_AN0276YV0205 [0,1,0,1,0,0|2,0,0]=4 460 B16R0.224 CC(C)C(=O)NCCCCCCCCCCO WXVL_AK3148SB0052 [1,0,0,0,1,0|2,0,0]=4 461 B16R0.224 CC(C)C(=O)NCCCCCCCCCCO WXVL_AK3148SB0052 [1,0,0,0,1,0|2,0,0]=4 462 B16R0.224 CCCCCCCCCCCCC(=O)N(C)C WXVL_AN0032SB0547 [1,0,0,0,1,0|1,0,0]=3 463 B16R0.224 CCCCCCCCCCCCC(=O)N(C)C WXVL_AN0032SB0547 [1,0,0,0,1,0|1,0,0]=3 464 B16R0.224 CN(C)C(=O)CCCCCCCCCCCBr WXVL_AN0032SB0603 [1,0,0,0,1,0|2,0,0]=4 465 B16R0.224 CN(C)C(=O)CCCCCCCCCCCBr WXVL_AN0032SB0603 [1,0,0,0,1,0|2,0,0]=4 466 B20R0.138 CCCCCCCCCCCCCC(=O)NCCC(C)C WXVL_AK0068SB0562 [0,0,0,0,0,2|1,0,0]=3 467 B20R0.138 CCCCCCCCCCCCCC(=O)NCCC(C)C WXVL_AK0068SB0562 [0,0,0,0,0,2|1,0,0]=3 468 B20R0.138 CCCCCCCCCCCCCC(=O)NCCN(C)C WXVL_AK0058SB0562 [0,0,0,0,0,2|2,0,0]=4 469 B20R0.138 CCCCCCCCCCCCCC(=O)NCCN(C)C WXVL_AK0058SB0562 [0,0,0,0,0,2|2,0,0]=4 470 B20R0.138 CCCCCCCCCCCCNC(=O)CCCC(C)C WXVL_AK1886SB1301 [0,0,0,0,0,2|2,0,0]=4 471 B20R0.138 CCCCCCCCCCCCNC(=O)CCCC(C)C WXVL_AK1886SB1301 [0,0,0,0,0,2|2,0,0]=4 472 B20R0.138 CCCCCCCCCCCCNC(=O)NCCC(C)C WXVL_AK0068YV0205 [0,0,0,0,0,2|2,0,0]=4 473 B20R0.138 CCCCCCCCCCCCNC(=O)NCCC(C)C WXVL_AK0068YV0205 [0,0,0,0,0,2|2,0,0]=4