0 B7R0.2 C#C[C@@H](C)NC(=O)C WXVL_AK00735SB0150 [0,0,0,0,0,0|2,0,2]=4 1 B7R0.2 C#C[C@@H](C)NC(=O)C WXVL_AK00735SB0150 [0,0,0,0,0,0|2,0,2]=4 2 B7R0.2 C=CC(C)NC(=O)C WXVL_AK00769SB0150 [0,0,0,0,0,0|2,0,2]=4 3 B7R0.2 C=CC(C)NC(=O)C WXVL_AK00769SB0150 [0,0,0,0,0,0|2,0,2]=4 4 B7R0.2 CC(=O)NC(C)C#N WXVL_AK00810SB0150 [0,0,0,0,0,0|3,0,1]=4 5 B7R0.2 CC(=O)NC(C)C#N WXVL_AK00810SB0150 [0,0,0,0,0,0|3,0,1]=4 6 B7R0.2 CC(=O)N[C@@H](C)CF WXVL_AK00558SB0150 [0,0,0,0,0,0|3,0,0]=3 7 B7R0.2 CC(=O)N[C@@H](C)CF WXVL_AK00558SB0150 [0,0,0,0,0,0|3,0,0]=3 8 B7R0.2 CC(=O)N[C@@H](C)CO WXVL_AK0109SB0150 [0,0,0,0,0,0|3,0,0]=3 9 B7R0.2 CC(=O)N[C@@H](C)CO WXVL_AK0109SB0150 [0,0,0,0,0,0|3,0,0]=3 10 B7R0.2 CCC(C)CC(=O)N WXVL_AK0084SB0353 [0,0,0,0,0,0|1,0,0]=1 11 B7R0.2 CCC(C)CC(=O)N WXVL_AK0084SB0353 [0,0,0,0,0,0|1,0,0]=1 12 B7R0.2 CCC(O)CC(=O)N WXVL_AK0084SB4092 [0,0,0,0,0,0|2,0,0]=2 13 B7R0.2 CCC(O)CC(=O)N WXVL_AK0084SB4092 [0,0,0,0,0,0|2,0,0]=2 14 B7R0.2 CC[C@@H](C)CC(=O)N WXVL_AK0084SB8650 [0,0,0,0,0,0|1,0,0]=1 15 B7R0.2 CC[C@@H](C)CC(=O)N WXVL_AK0084SB8650 [0,0,0,0,0,0|1,0,0]=1 16 B7R0.2 CC[C@H](C)NC(=O)C WXVL_AK00678SB0150 [0,0,0,0,0,0|2,0,0]=2 17 B7R0.2 CC[C@H](C)NC(=O)C WXVL_AK00678SB0150 [0,0,0,0,0,0|2,0,0]=2 18 B7R0.2 COC(=O)CC(=O)N WXVL_AK0084SB2790 [0,0,0,0,0,0|3,0,1]=4 19 B7R0.2 COC(=O)CC(=O)N WXVL_AK0084SB2790 [0,0,0,0,0,0|3,0,1]=4 20 B6R0.2 CC(=CC(=O)N)C WXVL_AK0084SB0342 [1,0,0,0,0,0|1,0,2]=4 21 B6R0.2 CC(=CC(=O)N)C WXVL_AK0084SB0342 [1,0,0,0,0,0|1,0,2]=4 22 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [1,0,0,0,0,0|2,0,0]=3 23 B6R0.2 CC(=O)NC(C)C WXVL_AK0030SB0150 [1,0,0,0,0,0|2,0,0]=3 24 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [1,0,0,0,0,0|1,0,0]=2 25 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [1,0,0,0,0,0|1,0,0]=2 26 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [1,0,0,0,0,0|2,0,0]=3 27 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [1,0,0,0,0,0|2,0,0]=3 28 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [1,0,0,0,0,0|2,0,0]=3 29 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [1,0,0,0,0,0|2,0,0]=3 30 B6R0.4 C#CCCC(=O)N WXVL_AK0084SB2189 [1,0,0,0,0,0|1,0,2]=4 31 B6R0.4 C#CCCC(=O)N WXVL_AK0084SB2189 [1,0,0,0,0,0|1,0,2]=4 32 B6R0.4 C=CCCC(=O)N WXVL_AK0084SB1035 [1,0,0,0,0,0|1,0,2]=4 33 B6R0.4 C=CCCC(=O)N WXVL_AK0084SB1035 [1,0,0,0,0,0|1,0,2]=4 34 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [1,0,0,0,0,0|3,0,0]=4 35 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [1,0,0,0,0,0|3,0,0]=4 36 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [1,0,0,0,0,0|2,0,0]=3 37 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [1,0,0,0,0,0|2,0,0]=3 38 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [1,0,0,0,0,0|2,0,0]=3 39 B6R0.4 CCOCC(=O)N WXVL_AK0084SB0091 [1,0,0,0,0,0|2,0,0]=3 40 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [1,0,0,0,0,0|2,0,0]=3 41 B6R0.4 CCSCC(=O)N WXVL_AK0084SB0002 [1,0,0,0,0,0|2,0,0]=3 42 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [1,0,0,0,0,0|2,0,0]=3 43 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [1,0,0,0,0,0|2,0,0]=3 44 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [1,0,0,0,0,0|2,0,0]=3 45 B6R0.4 CSCCC(=O)N WXVL_AK0084SB0361 [1,0,0,0,0,0|2,0,0]=3 46 B8R0.5 CC(=O)NC(C)CCO WXVL_AK1288SB0150 [0,1,0,0,0,0|2,0,0]=3 47 B8R0.5 CC(=O)NC(C)CCO WXVL_AK1288SB0150 [0,1,0,0,0,0|2,0,0]=3 48 B8R0.5 CC(=O)N[C@@H](C)CC#N WXVL_AK00595SB0150 [0,1,0,0,0,0|2,0,1]=4 49 B8R0.5 CC(=O)N[C@@H](C)CC#N WXVL_AK00595SB0150 [0,1,0,0,0,0|2,0,1]=4 50 B8R0.5 CCC[C@H](C)NC(=O)C WXVL_AK00682SB0150 [0,1,0,0,0,0|2,0,0]=3 51 B8R0.5 CCC[C@H](C)NC(=O)C WXVL_AK00682SB0150 [0,1,0,0,0,0|2,0,0]=3 52 B8R0.5 CCOC(=O)CC(=O)N WXVL_AK0084SB3094 [0,1,0,0,0,0|2,0,1]=4 53 B8R0.5 CCOC(=O)CC(=O)N WXVL_AK0084SB3094 [0,1,0,0,0,0|2,0,1]=4 54 B8R0.5 COC[C@@H](C)NC(=O)C WXVL_AK00613SB0150 [0,1,0,0,0,0|2,0,0]=3 55 B8R0.5 COC[C@@H](C)NC(=O)C WXVL_AK00613SB0150 [0,1,0,0,0,0|2,0,0]=3 56 B8R0.5 COC[C@H](C)NC(=O)C WXVL_AK0137SB0150 [0,1,0,0,0,0|2,0,0]=3 57 B8R0.5 COC[C@H](C)NC(=O)C WXVL_AK0137SB0150 [0,1,0,0,0,0|2,0,0]=3 58 B8R0.16 CC(=O)NC(CO)CO WXVL_AK0741SB0150 [0,1,0,0,0,0|3,0,0]=4 59 B8R0.16 CC(=O)NC(CO)CO WXVL_AK0741SB0150 [0,1,0,0,0,0|3,0,0]=4 60 B8R0.16 CC[C@H](CO)NC(=O)C WXVL_AK0111SB0150 [0,1,0,0,0,0|2,0,0]=3 61 B8R0.16 CC[C@H](CO)NC(=O)C WXVL_AK0111SB0150 [0,1,0,0,0,0|2,0,0]=3 62 B8R0.19 C#CC(=O)N[C@@H](C)CC WXVL_AK00678SB0338 [0,1,0,0,0,0|2,0,0]=3 63 B8R0.19 C#CC(=O)N[C@@H](C)CC WXVL_AK00678SB0338 [0,1,0,0,0,0|2,0,0]=3 64 B8R0.19 C#CC(=O)N[C@@H](C)CF WXVL_AK00558SB0338 [0,1,0,0,0,0|3,0,0]=4 65 B8R0.19 C#CC(=O)N[C@@H](C)CF WXVL_AK00558SB0338 [0,1,0,0,0,0|3,0,0]=4 66 B8R0.19 C#CC(=O)N[C@@H](C)CO WXVL_AK0109SB0338 [0,1,0,0,0,0|3,0,0]=4 67 B8R0.19 C#CC(=O)N[C@@H](C)CO WXVL_AK0109SB0338 [0,1,0,0,0,0|3,0,0]=4 68 B8R0.19 C#C[C@@H](C)NC(=O)CO WXVL_AK00735SB2706 [0,1,0,0,0,0|1,0,2]=4 69 B8R0.19 C#C[C@@H](C)NC(=O)CO WXVL_AK00735SB2706 [0,1,0,0,0,0|1,0,2]=4 70 B8R0.19 C=CC(C)NC(=O)CO WXVL_AK00769SB2706 [0,1,0,0,0,0|1,0,2]=4 71 B8R0.19 C=CC(C)NC(=O)CO WXVL_AK00769SB2706 [0,1,0,0,0,0|1,0,2]=4 72 B8R0.19 CC(C#N)NC(=O)CO WXVL_AK00810SB2706 [0,1,0,0,0,0|2,0,1]=4 73 B8R0.19 CC(C#N)NC(=O)CO WXVL_AK00810SB2706 [0,1,0,0,0,0|2,0,1]=4 74 B8R0.19 CCC(=O)N[C@@H](C)CC WXVL_AK00678SB0064 [0,1,0,0,0,0|2,0,0]=3 75 B8R0.19 CCC(=O)N[C@@H](C)CC WXVL_AK00678SB0064 [0,1,0,0,0,0|2,0,0]=3 76 B8R0.19 CCC(=O)N[C@@H](C)CF WXVL_AK00558SB0064 [0,1,0,0,0,0|3,0,0]=4 77 B8R0.19 CCC(=O)N[C@@H](C)CF WXVL_AK00558SB0064 [0,1,0,0,0,0|3,0,0]=4 78 B8R0.19 CCC(=O)N[C@@H](C)CO WXVL_AK0109SB0064 [0,1,0,0,0,0|3,0,0]=4 79 B8R0.19 CCC(=O)N[C@@H](C)CO WXVL_AK0109SB0064 [0,1,0,0,0,0|3,0,0]=4 80 B8R0.19 CCC(C)CC(=O)NC WXVL_AK00442SB0353 [0,1,0,0,0,0|1,0,0]=2 81 B8R0.19 CCC(C)CC(=O)NC WXVL_AK00442SB0353 [0,1,0,0,0,0|1,0,0]=2 82 B8R0.19 CCC(O)CC(=O)NC WXVL_AK00442SB4092 [0,1,0,0,0,0|2,0,0]=3 83 B8R0.19 CCC(O)CC(=O)NC WXVL_AK00442SB4092 [0,1,0,0,0,0|2,0,0]=3 84 B8R0.19 CC[C@@H](C)CC(=O)NC WXVL_AK00442SB8650 [0,1,0,0,0,0|1,0,0]=2 85 B8R0.19 CC[C@@H](C)CC(=O)NC WXVL_AK00442SB8650 [0,1,0,0,0,0|1,0,0]=2 86 B8R0.19 CC[C@H](C)NC(=O)CO WXVL_AK00678SB2706 [0,1,0,0,0,0|1,0,0]=2 87 B8R0.19 CC[C@H](C)NC(=O)CO WXVL_AK00678SB2706 [0,1,0,0,0,0|1,0,0]=2 88 B8R0.19 CNC(=O)CC(=O)OC WXVL_AK00442SB2790 [0,1,0,0,0,0|2,0,1]=4 89 B8R0.19 CNC(=O)CC(=O)OC WXVL_AK00442SB2790 [0,1,0,0,0,0|2,0,1]=4 90 B8R0.19 C[C@@H](CF)NC(=O)CO WXVL_AK00558SB2706 [0,1,0,0,0,0|2,0,0]=3 91 B8R0.19 C[C@@H](CF)NC(=O)CO WXVL_AK00558SB2706 [0,1,0,0,0,0|2,0,0]=3 92 B8R0.19 C[C@@H](CO)NC(=O)CO WXVL_AK0109SB2706 [0,1,0,0,0,0|2,0,0]=3 93 B8R0.19 C[C@@H](CO)NC(=O)CO WXVL_AK0109SB2706 [0,1,0,0,0,0|2,0,0]=3 94 B8R0.23 CC(C)N(C)CC(=O)N WXVL_AK0084SB0019 [0,1,0,0,0,0|2,0,0]=3 95 B8R0.23 CC(C)N(C)CC(=O)N WXVL_AK0084SB0019 [0,1,0,0,0,0|2,0,0]=3 96 B8R0.34 CC(=O)NC(C)(C)CO WXVL_AK0025SB0150 [0,1,0,0,0,0|3,0,0]=4 97 B8R0.34 CC(=O)NC(C)(C)CO WXVL_AK0025SB0150 [0,1,0,0,0,0|3,0,0]=4 98 B8R0.34 CCS(=O)(=O)CC(=O)N WXVL_AK0084SBD438 [0,1,0,0,0,0|3,0,0]=4 99 B8R0.34 CCS(=O)(=O)CC(=O)N WXVL_AK0084SBD438 [0,1,0,0,0,0|3,0,0]=4 100 B8R1.34 CC(=O)NC1CNC1 WXVL_AK1291SB0150 [0,0,0,1,0,0|3,0,0]=4 101 B8R1.34 CC(=O)NC1CNC1 WXVL_AK1291SB0150 [0,0,0,1,0,0|3,0,0]=4 102 B8R1.34 CC(=O)NC1CSC1 WXVL_AK2089SB0150 [0,0,0,1,0,0|3,0,0]=4 103 B8R1.34 CC(=O)NC1CSC1 WXVL_AK2089SB0150 [0,0,0,1,0,0|3,0,0]=4 104 B8R1.34 NC(=O)CC1CCC1 WXVL_AK0084SB2207 [0,0,0,1,0,0|1,0,0]=2 105 B8R1.34 NC(=O)CC1CCC1 WXVL_AK0084SB2207 [0,0,0,1,0,0|1,0,0]=2 106 B8R1.42 CC(=O)NC1(CC1)C WXVL_AK0263SB0150 [0,0,0,1,0,0|2,0,0]=3 107 B8R1.42 CC(=O)NC1(CC1)C WXVL_AK0263SB0150 [0,0,0,1,0,0|2,0,0]=3 108 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [0,0,0,0,1,0|1,0,2]=4 109 B6R0.3 C/C=C(\C)/C(=O)N WXVL_AK0084SB0343 [0,0,0,0,1,0|1,0,2]=4 110 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [0,0,0,0,1,0|2,0,1]=4 111 B6R0.3 CCC(=O)C(=O)N WXVL_AK0084SB0344 [0,0,0,0,1,0|2,0,1]=4 112 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [0,0,0,0,1,0|1,0,0]=2 113 B6R0.3 CCC(C)C(=O)N WXVL_AK0084SB0054 [0,0,0,0,1,0|1,0,0]=2 114 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [0,0,0,0,1,0|1,0,0]=2 115 B6R0.3 CC[C@@H](C)C(=O)N WXVL_AK0084SB00054 [0,0,0,0,1,0|1,0,0]=2 116 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [0,0,0,0,1,0|2,0,0]=3 117 B6R0.3 CC[C@H](O)C(=O)N WXVL_AK0084SB3573 [0,0,0,0,1,0|2,0,0]=3 118 B6R0.3 CO[C@H](C)C(=O)N WXVL_AK0084SB2926 [0,0,0,0,1,0|2,0,0]=3 119 B6R0.3 CO[C@H](C)C(=O)N WXVL_AK0084SB2926 [0,0,0,0,1,0|2,0,0]=3 120 B8R0.9 CC(=O)NC[C@@H](F)CO WXVL_AK00590SB0150 [0,0,0,0,0,1|3,0,0]=4 121 B8R0.9 CC(=O)NC[C@@H](F)CO WXVL_AK00590SB0150 [0,0,0,0,0,1|3,0,0]=4 122 B8R0.9 CC(=O)NC[C@H](O)CO WXVL_AK00483SB0150 [0,0,0,0,0,1|3,0,0]=4 123 B8R0.9 CC(=O)NC[C@H](O)CO WXVL_AK00483SB0150 [0,0,0,0,0,1|3,0,0]=4 124 B8R0.9 CCC(=O)NCC(=O)N WXVL_AK0147SB0064 [0,0,0,0,0,1|2,0,1]=4 125 B8R0.9 CCC(=O)NCC(=O)N WXVL_AK0147SB0064 [0,0,0,0,0,1|2,0,1]=4 126 B8R0.9 CO[C@H](C)CNC(=O)C WXVL_AK00704SB0150 [0,0,0,0,0,1|2,0,0]=3 127 B8R0.9 CO[C@H](C)CNC(=O)C WXVL_AK00704SB0150 [0,0,0,0,0,1|2,0,0]=3 128 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [2,0,0,0,0,0|1,0,0]=3 129 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [2,0,0,0,0,0|1,0,0]=3 130 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [2,0,0,0,0,0|2,0,0]=4 131 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [2,0,0,0,0,0|2,0,0]=4 132 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [2,0,0,0,0,0|2,0,0]=4 133 B5R0.1 COCC(=O)N WXVL_AK0084SB0090 [2,0,0,0,0,0|2,0,0]=4 134 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [2,0,0,0,0,0|2,0,0]=4 135 B5R0.1 CSCC(=O)N WXVL_AK0084SB1267 [2,0,0,0,0,0|2,0,0]=4 136 B7R0.9 CC(=O)NC(C)(C)C WXVL_AK0024SB0150 [1,1,0,0,0,0|2,0,0]=4 137 B7R0.9 CC(=O)NC(C)(C)C WXVL_AK0024SB0150 [1,1,0,0,0,0|2,0,0]=4 138 B7R0.9 CC(C)(C)CC(=O)N WXVL_AK0084SB0062 [1,1,0,0,0,0|1,0,0]=3 139 B7R0.9 CC(C)(C)CC(=O)N WXVL_AK0084SB0062 [1,1,0,0,0,0|1,0,0]=3 140 B7R0.9 CC(C)(O)CC(=O)N WXVL_AK0084SB0163 [1,1,0,0,0,0|1,0,0]=3 141 B7R0.9 CC(C)(O)CC(=O)N WXVL_AK0084SB0163 [1,1,0,0,0,0|1,0,0]=3 142 B7R0.9 CC(C)CS(=O)(=O)N WXVL_AK0084HU0149 [1,1,0,0,0,0|1,0,1]=4 143 B7R0.9 CC(C)CS(=O)(=O)N WXVL_AK0084HU0149 [1,1,0,0,0,0|1,0,1]=4 144 B7R0.16 CC(=O)N(C)C(C)C WXVL_AN0073SB0150 [1,1,0,0,0,0|2,0,0]=4 145 B7R0.16 CC(=O)N(C)C(C)C WXVL_AN0073SB0150 [1,1,0,0,0,0|2,0,0]=4 146 B7R0.16 CC(C)C(=O)C(=O)N WXVL_AK0084SB2578 [1,1,0,0,0,0|1,0,1]=4 147 B7R0.16 CC(C)C(=O)C(=O)N WXVL_AK0084SB2578 [1,1,0,0,0,0|1,0,1]=4 148 B7R0.16 CC(C)C(O)C(=O)N WXVL_AK0084SB1147 [1,1,0,0,0,0|1,0,0]=3 149 B7R0.16 CC(C)C(O)C(=O)N WXVL_AK0084SB1147 [1,1,0,0,0,0|1,0,0]=3 150 B7R0.4 C#CCCCC(=O)N WXVL_AK0084SB2709 [1,1,0,0,0,0|1,0,1]=4 151 B7R0.4 C#CCCCC(=O)N WXVL_AK0084SB2709 [1,1,0,0,0,0|1,0,1]=4 152 B7R0.4 C=CCCCC(=O)N WXVL_AK0084SB2920 [1,1,0,0,0,0|1,0,1]=4 153 B7R0.4 C=CCCCC(=O)N WXVL_AK0084SB2920 [1,1,0,0,0,0|1,0,1]=4 154 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [1,1,0,0,0,0|2,0,0]=4 155 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [1,1,0,0,0,0|2,0,0]=4 156 B7R0.4 CC/C=C/CC(=O)N WXVL_AK0084SB0349 [1,1,0,0,0,0|1,0,1]=4 157 B7R0.4 CC/C=C/CC(=O)N WXVL_AK0084SB0349 [1,1,0,0,0,0|1,0,1]=4 158 B7R0.4 CCCCNC(=O)C WXVL_AK00588SB0150 [1,1,0,0,0,0|1,0,0]=3 159 B7R0.4 CCCCNC(=O)C WXVL_AK00588SB0150 [1,1,0,0,0,0|1,0,0]=3 160 B7R0.4 CSCCNC(=O)C WXVL_AK00440SB0150 [1,1,0,0,0,0|2,0,0]=4 161 B7R0.4 CSCCNC(=O)C WXVL_AK00440SB0150 [1,1,0,0,0,0|2,0,0]=4 162 B7R0.4 NC(=O)CCCCBr WXVL_AK0084SB3153 [1,1,0,0,0,0|1,0,0]=3 163 B7R0.4 NC(=O)CCCCBr WXVL_AK0084SB3153 [1,1,0,0,0,0|1,0,0]=3 164 B7R0.4 NC(=O)CCCCCl WXVL_AK0084SB0379 [1,1,0,0,0,0|1,0,0]=3 165 B7R0.4 NC(=O)CCCCCl WXVL_AK0084SB0379 [1,1,0,0,0,0|1,0,0]=3 166 B7R0.6 CC(=O)CCC(=O)N WXVL_AK0084SB0072 [1,1,0,0,0,0|1,0,1]=4 167 B7R0.6 CC(=O)CCC(=O)N WXVL_AK0084SB0072 [1,1,0,0,0,0|1,0,1]=4 168 B7R0.6 CC(=O)NCC(C)C WXVL_AK00544SB0150 [1,1,0,0,0,0|2,0,0]=4 169 B7R0.6 CC(=O)NCC(C)C WXVL_AK00544SB0150 [1,1,0,0,0,0|2,0,0]=4 170 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [1,1,0,0,0,0|2,0,0]=4 171 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [1,1,0,0,0,0|2,0,0]=4 172 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [1,1,0,0,0,0|2,0,0]=4 173 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [1,1,0,0,0,0|2,0,0]=4 174 B7R0.6 CC(C)CCC(=O)N WXVL_AK0084SB0354 [1,1,0,0,0,0|1,0,0]=3 175 B7R0.6 CC(C)CCC(=O)N WXVL_AK0084SB0354 [1,1,0,0,0,0|1,0,0]=3 176 B7R0.6 CC(C)OCC(=O)N WXVL_AK0084SB0213 [1,1,0,0,0,0|2,0,0]=4 177 B7R0.6 CC(C)OCC(=O)N WXVL_AK0084SB0213 [1,1,0,0,0,0|2,0,0]=4 178 B7R0.6 CN(C)CCC(=O)N WXVL_AK0084SB00052 [1,1,0,0,0,0|2,0,0]=4 179 B7R0.6 CN(C)CCC(=O)N WXVL_AK0084SB00052 [1,1,0,0,0,0|2,0,0]=4 180 B7R0.8 CCCCS(=O)(=O)N WXVL_AK0084HU0031 [1,1,0,0,0,0|1,0,1]=4 181 B7R0.8 CCCCS(=O)(=O)N WXVL_AK0084HU0031 [1,1,0,0,0,0|1,0,1]=4 182 B7R0.13 CC(C)(CCl)C(=O)N WXVL_AK0084SB3392 [0,1,0,0,1,0|2,0,0]=4 183 B7R0.13 CC(C)(CCl)C(=O)N WXVL_AK0084SB3392 [0,1,0,0,1,0|2,0,0]=4 184 B7R0.13 CCC(C)(C)C(=O)N WXVL_AK0084SB0355 [0,1,0,0,1,0|1,0,0]=3 185 B7R0.13 CCC(C)(C)C(=O)N WXVL_AK0084SB0355 [0,1,0,0,1,0|1,0,0]=3 186 B7R0.13 CCC(C)(O)C(=O)N WXVL_AK0084SB3009 [0,1,0,0,1,0|1,0,0]=3 187 B7R0.13 CCC(C)(O)C(=O)N WXVL_AK0084SB3009 [0,1,0,0,1,0|1,0,0]=3 188 B7R0.13 COC(C)(C)C(=O)N WXVL_AK0084SB0207 [0,1,0,0,1,0|2,0,0]=4 189 B7R0.13 COC(C)(C)C(=O)N WXVL_AK0084SB0207 [0,1,0,0,1,0|2,0,0]=4 190 B7R0.15 CCC(CC)C(=O)N WXVL_AK0084SB0055 [0,1,0,0,1,0|1,0,0]=3 191 B7R0.15 CCC(CC)C(=O)N WXVL_AK0084SB0055 [0,1,0,0,1,0|1,0,0]=3 192 B7R0.15 CCN(CC)C(=O)C WXVL_AN0042SB0150 [0,1,0,0,1,0|2,0,0]=4 193 B7R0.15 CCN(CC)C(=O)C WXVL_AN0042SB0150 [0,1,0,0,1,0|2,0,0]=4 194 B7R0.15 COC(OC)C(=O)N WXVL_AK0084SB8546 [0,1,0,0,1,0|2,0,0]=4 195 B7R0.15 COC(OC)C(=O)N WXVL_AK0084SB8546 [0,1,0,0,1,0|2,0,0]=4 196 B9R0.24 C#CC(=O)NC[C@@H](C)OC WXVL_AK00704SB0338 [0,1,0,0,0,1|2,0,0]=4 197 B9R0.24 C#CC(=O)NC[C@@H](C)OC WXVL_AK00704SB0338 [0,1,0,0,0,1|2,0,0]=4 198 B9R0.24 CCC(=O)NC[C@@H](C)OC WXVL_AK00704SB0064 [0,1,0,0,0,1|2,0,0]=4 199 B9R0.24 CCC(=O)NC[C@@H](C)OC WXVL_AK00704SB0064 [0,1,0,0,0,1|2,0,0]=4 200 B9R0.24 CO[C@H](C)CNC(=O)CO WXVL_AK00704SB2706 [0,1,0,0,0,1|1,0,0]=3 201 B9R0.24 CO[C@H](C)CNC(=O)CO WXVL_AK00704SB2706 [0,1,0,0,0,1|1,0,0]=3 202 B9R0.24 O=C(CO)NC[C@@H](F)CO WXVL_AK00590SB2706 [0,1,0,0,0,1|2,0,0]=4 203 B9R0.24 O=C(CO)NC[C@@H](F)CO WXVL_AK00590SB2706 [0,1,0,0,0,1|2,0,0]=4 204 B9R0.24 O=C(CO)NC[C@H](O)CO WXVL_AK00483SB2706 [0,1,0,0,0,1|2,0,0]=4 205 B9R0.24 O=C(CO)NC[C@H](O)CO WXVL_AK00483SB2706 [0,1,0,0,0,1|2,0,0]=4 206 B9R0.42 CC[C@H](C)NC(=O)C(=O)C WXVL_AK00678SB0051 [0,1,0,0,0,1|1,0,1]=4 207 B9R0.42 CC[C@H](C)NC(=O)C(=O)C WXVL_AK00678SB0051 [0,1,0,0,0,1|1,0,1]=4 208 B9R0.42 CC[C@H](C)NC(=O)C(=O)N WXVL_AK00678SB0128 [0,1,0,0,0,1|1,0,1]=4 209 B9R0.42 CC[C@H](C)NC(=O)C(=O)N WXVL_AK00678SB0128 [0,1,0,0,0,1|1,0,1]=4 210 B9R0.64 CC(=O)NCC(C)(C)CO WXVL_AK0104SB0150 [0,1,0,0,0,1|2,0,0]=4 211 B9R0.64 CC(=O)NCC(C)(C)CO WXVL_AK0104SB0150 [0,1,0,0,0,1|2,0,0]=4 212 B9R0.14 CCC[C@@H](CO)NC(=O)C WXVL_AK2551SB0150 [0,2,0,0,0,0|2,0,0]=4 213 B9R0.14 CCC[C@@H](CO)NC(=O)C WXVL_AK2551SB0150 [0,2,0,0,0,0|2,0,0]=4 214 B9R0.34 C#CC(=O)NC(C)CCO WXVL_AK1288SB0338 [0,2,0,0,0,0|2,0,0]=4 215 B9R0.34 C#CC(=O)NC(C)CCO WXVL_AK1288SB0338 [0,2,0,0,0,0|2,0,0]=4 216 B9R0.34 C#CC(=O)N[C@@H](C)CCC WXVL_AK00682SB0338 [0,2,0,0,0,0|2,0,0]=4 217 B9R0.34 C#CC(=O)N[C@@H](C)CCC WXVL_AK00682SB0338 [0,2,0,0,0,0|2,0,0]=4 218 B9R0.34 C#CC(=O)N[C@@H](C)COC WXVL_AK0137SB0338 [0,2,0,0,0,0|2,0,0]=4 219 B9R0.34 C#CC(=O)N[C@@H](C)COC WXVL_AK0137SB0338 [0,2,0,0,0,0|2,0,0]=4 220 B9R0.34 C#CC(=O)N[C@H](C)COC WXVL_AK00613SB0338 [0,2,0,0,0,0|2,0,0]=4 221 B9R0.34 C#CC(=O)N[C@H](C)COC WXVL_AK00613SB0338 [0,2,0,0,0,0|2,0,0]=4 222 B9R0.34 C#CCC(=O)N[C@@H](C)CC WXVL_AK00678SB3070 [0,2,0,0,0,0|2,0,0]=4 223 B9R0.34 C#CCC(=O)N[C@@H](C)CC WXVL_AK00678SB3070 [0,2,0,0,0,0|2,0,0]=4 224 B9R0.34 C/C=C/C(=O)N[C@@H](C)CC WXVL_AK00678SB0340 [0,2,0,0,0,0|2,0,0]=4 225 B9R0.34 C/C=C/C(=O)N[C@@H](C)CC WXVL_AK00678SB0340 [0,2,0,0,0,0|2,0,0]=4 226 B9R0.34 C=CCC(=O)N[C@@H](C)CC WXVL_AK00678SB2732 [0,2,0,0,0,0|2,0,0]=4 227 B9R0.34 C=CCC(=O)N[C@@H](C)CC WXVL_AK00678SB2732 [0,2,0,0,0,0|2,0,0]=4 228 B9R0.34 CC#CC(=O)N[C@@H](C)CC WXVL_AK00678SB1240 [0,2,0,0,0,0|2,0,0]=4 229 B9R0.34 CC#CC(=O)N[C@@H](C)CC WXVL_AK00678SB1240 [0,2,0,0,0,0|2,0,0]=4 230 B9R0.34 CC(CCO)NC(=O)CO WXVL_AK1288SB2706 [0,2,0,0,0,0|1,0,0]=3 231 B9R0.34 CC(CCO)NC(=O)CO WXVL_AK1288SB2706 [0,2,0,0,0,0|1,0,0]=3 232 B9R0.34 CCC(=O)NC(C)CCO WXVL_AK1288SB0064 [0,2,0,0,0,0|2,0,0]=4 233 B9R0.34 CCC(=O)NC(C)CCO WXVL_AK1288SB0064 [0,2,0,0,0,0|2,0,0]=4 234 B9R0.34 CCC(=O)N[C@@H](C)COC WXVL_AK0137SB0064 [0,2,0,0,0,0|2,0,0]=4 235 B9R0.34 CCC(=O)N[C@@H](C)COC WXVL_AK0137SB0064 [0,2,0,0,0,0|2,0,0]=4 236 B9R0.34 CCC(=O)N[C@H](C)COC WXVL_AK00613SB0064 [0,2,0,0,0,0|2,0,0]=4 237 B9R0.34 CCC(=O)N[C@H](C)COC WXVL_AK00613SB0064 [0,2,0,0,0,0|2,0,0]=4 238 B9R0.34 CCCC(=O)N[C@@H](C)CC WXVL_AK00678SB0073 [0,2,0,0,0,0|2,0,0]=4 239 B9R0.34 CCCC(=O)N[C@@H](C)CC WXVL_AK00678SB0073 [0,2,0,0,0,0|2,0,0]=4 240 B9R0.34 CCC[C@H](C)NC(=O)CC WXVL_AK00682SB0064 [0,2,0,0,0,0|2,0,0]=4 241 B9R0.34 CCC[C@H](C)NC(=O)CC WXVL_AK00682SB0064 [0,2,0,0,0,0|2,0,0]=4 242 B9R0.34 CCC[C@H](C)NC(=O)CO WXVL_AK00682SB2706 [0,2,0,0,0,0|1,0,0]=3 243 B9R0.34 CCC[C@H](C)NC(=O)CO WXVL_AK00682SB2706 [0,2,0,0,0,0|1,0,0]=3 244 B9R0.34 CCNC(=O)CC(=O)OC WXVL_AK00476SB2790 [0,2,0,0,0,0|1,0,1]=4 245 B9R0.34 CCNC(=O)CC(=O)OC WXVL_AK00476SB2790 [0,2,0,0,0,0|1,0,1]=4 246 B9R0.34 CCNC(=O)CC(C)CC WXVL_AK00476SB0353 [0,2,0,0,0,0|1,0,0]=3 247 B9R0.34 CCNC(=O)CC(C)CC WXVL_AK00476SB0353 [0,2,0,0,0,0|1,0,0]=3 248 B9R0.34 CCNC(=O)CC(O)CC WXVL_AK00476SB4092 [0,2,0,0,0,0|2,0,0]=4 249 B9R0.34 CCNC(=O)CC(O)CC WXVL_AK00476SB4092 [0,2,0,0,0,0|2,0,0]=4 250 B9R0.34 CCNC(=O)C[C@H](C)CC WXVL_AK00476SB8650 [0,2,0,0,0,0|1,0,0]=3 251 B9R0.34 CCNC(=O)C[C@H](C)CC WXVL_AK00476SB8650 [0,2,0,0,0,0|1,0,0]=3 252 B9R0.34 CC[C@H](C)NC(=O)CC#N WXVL_AK00678SB0057 [0,2,0,0,0,0|2,0,0]=4 253 B9R0.34 CC[C@H](C)NC(=O)CC#N WXVL_AK00678SB0057 [0,2,0,0,0,0|2,0,0]=4 254 B9R0.34 CC[C@H](C)NC(=O)COC WXVL_AK00678SB0090 [0,2,0,0,0,0|1,0,0]=3 255 B9R0.34 CC[C@H](C)NC(=O)COC WXVL_AK00678SB0090 [0,2,0,0,0,0|1,0,0]=3 256 B9R0.34 CC[C@H](C)NC(=O)CSC WXVL_AK00678SB1267 [0,2,0,0,0,0|1,1,0]=4 257 B9R0.34 CC[C@H](C)NC(=O)CSC WXVL_AK00678SB1267 [0,2,0,0,0,0|1,1,0]=4 258 B9R0.34 COCC(=O)N[C@@H](C)CF WXVL_AK00558SB0090 [0,2,0,0,0,0|2,0,0]=4 259 B9R0.34 COCC(=O)N[C@@H](C)CF WXVL_AK00558SB0090 [0,2,0,0,0,0|2,0,0]=4 260 B9R0.34 COCC(=O)N[C@@H](C)CO WXVL_AK0109SB0090 [0,2,0,0,0,0|2,0,0]=4 261 B9R0.34 COCC(=O)N[C@@H](C)CO WXVL_AK0109SB0090 [0,2,0,0,0,0|2,0,0]=4 262 B9R0.34 COC[C@@H](C)NC(=O)CO WXVL_AK00613SB2706 [0,2,0,0,0,0|1,0,0]=3 263 B9R0.34 COC[C@@H](C)NC(=O)CO WXVL_AK00613SB2706 [0,2,0,0,0,0|1,0,0]=3 264 B9R0.34 COC[C@H](C)NC(=O)CO WXVL_AK0137SB2706 [0,2,0,0,0,0|1,0,0]=3 265 B9R0.34 COC[C@H](C)NC(=O)CO WXVL_AK0137SB2706 [0,2,0,0,0,0|1,0,0]=3 266 B9R0.34 C[C@@H](CC#N)NC(=O)CO WXVL_AK00595SB2706 [0,2,0,0,0,0|1,0,1]=4 267 B9R0.34 C[C@@H](CC#N)NC(=O)CO WXVL_AK00595SB2706 [0,2,0,0,0,0|1,0,1]=4 268 B9R0.53 CC(=O)NC(C)CN(C)C WXVL_AK0938SB0150 [0,2,0,0,0,0|2,0,0]=4 269 B9R0.53 CC(=O)NC(C)CN(C)C WXVL_AK0938SB0150 [0,2,0,0,0,0|2,0,0]=4 270 B9R0.58 COCC(C)(C)NC(=O)C WXVL_AK1295SB0150 [0,2,0,0,0,0|2,0,0]=4 271 B9R0.58 COCC(C)(C)NC(=O)C WXVL_AK1295SB0150 [0,2,0,0,0,0|2,0,0]=4 272 B9R0.26 C#CC(=O)N[C@H](CC)CO WXVL_AK0111SB0338 [0,2,0,0,0,0|2,0,0]=4 273 B9R0.26 C#CC(=O)N[C@H](CC)CO WXVL_AK0111SB0338 [0,2,0,0,0,0|2,0,0]=4 274 B9R0.26 CCC(=O)N[C@H](CC)CO WXVL_AK0111SB0064 [0,2,0,0,0,0|2,0,0]=4 275 B9R0.26 CCC(=O)N[C@H](CC)CO WXVL_AK0111SB0064 [0,2,0,0,0,0|2,0,0]=4 276 B9R0.26 CC[C@H](CO)NC(=O)CO WXVL_AK0111SB2706 [0,2,0,0,0,0|1,0,0]=3 277 B9R0.26 CC[C@H](CO)NC(=O)CO WXVL_AK0111SB2706 [0,2,0,0,0,0|1,0,0]=3 278 B9R0.26 O=C(CO)NC(CO)CO WXVL_AK0741SB2706 [0,2,0,0,0,0|2,0,0]=4 279 B9R0.26 O=C(CO)NC(CO)CO WXVL_AK0741SB2706 [0,2,0,0,0,0|2,0,0]=4 280 B9R0.39 CC(=O)NC(CO)C(C)C WXVL_AK0106SB0150 [0,2,0,0,0,0|2,0,0]=4 281 B9R0.39 CC(=O)NC(CO)C(C)C WXVL_AK0106SB0150 [0,2,0,0,0,0|2,0,0]=4 282 B9R0.39 CC(=O)N[C@H](CO)[C@@H](C)O WXVL_AK0126SB0150 [0,2,0,0,0,0|2,0,0]=4 283 B9R0.39 CC(=O)N[C@H](CO)[C@@H](C)O WXVL_AK0126SB0150 [0,2,0,0,0,0|2,0,0]=4 284 B9R0.39 CC[C@H](NC(=O)C)[C@@H](C)O WXVL_AK00602SB0150 [0,2,0,0,0,0|2,0,0]=4 285 B9R0.39 CC[C@H](NC(=O)C)[C@@H](C)O WXVL_AK00602SB0150 [0,2,0,0,0,0|2,0,0]=4 286 B9R0.22 CC(C)(CO)NC(=O)CO WXVL_AK0025SB2706 [0,2,0,0,0,0|2,0,0]=4 287 B9R0.22 CC(C)(CO)NC(=O)CO WXVL_AK0025SB2706 [0,2,0,0,0,0|2,0,0]=4 288 B7R1.12 CC1CC1C(=O)N WXVL_AK0084SB0041 [1,0,0,1,0,0|1,0,0]=3 289 B7R1.12 CC1CC1C(=O)N WXVL_AK0084SB0041 [1,0,0,1,0,0|1,0,0]=3 290 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F WXVL_AK0084SB1245 [1,0,0,1,0,0|2,0,0]=4 291 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F WXVL_AK0084SB1245 [1,0,0,1,0,0|2,0,0]=4 292 B7R1.12 NC(=O)[C@H]1C[C@H]1F WXVL_AK0084SB00019 [1,0,0,1,0,0|2,0,0]=4 293 B7R1.12 NC(=O)[C@H]1C[C@H]1F WXVL_AK0084SB00019 [1,0,0,1,0,0|2,0,0]=4 294 B7R1.20 CC(=O)NC1CC1 WXVL_AK0001SB0150 [1,0,0,1,0,0|2,0,0]=4 295 B7R1.20 CC(=O)NC1CC1 WXVL_AK0001SB0150 [1,0,0,1,0,0|2,0,0]=4 296 B7R1.20 NC(=O)CC1CC1 WXVL_AK0084SB0155 [1,0,0,1,0,0|1,0,0]=3 297 B7R1.20 NC(=O)CC1CC1 WXVL_AK0084SB0155 [1,0,0,1,0,0|1,0,0]=3 298 B7R1.18 NC(=O)C1CCC1 WXVL_AK0084SB0042 [1,0,0,1,0,0|1,0,0]=3 299 B7R1.18 NC(=O)C1CCC1 WXVL_AK0084SB0042 [1,0,0,1,0,0|1,0,0]=3 300 B7R1.19 CC1(CC1)C(=O)N WXVL_AK0084SB0040 [0,0,0,1,1,0|1,0,0]=3 301 B7R1.19 CC1(CC1)C(=O)N WXVL_AK0084SB0040 [0,0,0,1,1,0|1,0,0]=3 302 B7R1.19 NC(=O)C1(CC1)Br WXVL_AK0084SB5517 [0,0,0,1,1,0|2,0,0]=4 303 B7R1.19 NC(=O)C1(CC1)Br WXVL_AK0084SB5517 [0,0,0,1,1,0|2,0,0]=4 304 B7R1.19 NC(=O)C1(CC1)F WXVL_AK0084SB0218 [0,0,0,1,1,0|2,0,0]=4 305 B7R1.19 NC(=O)C1(CC1)F WXVL_AK0084SB0218 [0,0,0,1,1,0|2,0,0]=4 306 B7R1.19 NC(=O)C1(CC1)O WXVL_AK0084SB2965 [0,0,0,1,1,0|2,0,0]=4 307 B7R1.19 NC(=O)C1(CC1)O WXVL_AK0084SB2965 [0,0,0,1,1,0|2,0,0]=4 308 B9R1.35 CC(=O)N1CCC(C1)Br WXVL_AN00715SB0150 [0,0,0,1,0,1|2,0,0]=4 309 B9R1.35 CC(=O)N1CCC(C1)C WXVL_AN0556SB0150 [0,0,0,1,0,1|1,0,0]=3 310 B9R1.35 CC(=O)N1CCC(C1)C WXVL_AN0556SB0150 [0,0,0,1,0,1|1,0,0]=3 311 B9R1.35 CC(=O)N1CCC(C1)F WXVL_AN00338SB0150 [0,0,0,1,0,1|2,0,0]=4 312 B9R1.35 CC(=O)N1CCC(C1)F WXVL_AN00338SB0150 [0,0,0,1,0,1|2,0,0]=4 313 B9R1.35 CC(=O)N1CCC(C1)O WXVL_AN0158SB0150 [0,0,0,1,0,1|2,0,0]=4 314 B9R1.35 CC(=O)N1CCC(C1)O WXVL_AN0158SB0150 [0,0,0,1,0,1|2,0,0]=4 315 B9R1.35 CC(=O)N1CC[C@@H](C1)C WXVL_AN00094SB0150 [0,0,0,1,0,1|1,0,0]=3 316 B9R1.35 CC(=O)N1CC[C@@H](C1)C WXVL_AN00094SB0150 [0,0,0,1,0,1|1,0,0]=3 317 B9R1.35 CC(=O)N1CC[C@@H](C1)O WXVL_AN00391SB0150 [0,0,0,1,0,1|2,0,0]=4 318 B9R1.35 CC(=O)N1CC[C@@H](C1)O WXVL_AN00391SB0150 [0,0,0,1,0,1|2,0,0]=4 319 B9R1.35 CC(=O)N1CC[C@H](C1)C WXVL_AN00488SB0150 [0,0,0,1,0,1|1,0,0]=3 320 B9R1.35 CC(=O)N1CC[C@H](C1)C WXVL_AN00488SB0150 [0,0,0,1,0,1|1,0,0]=3 321 B9R1.35 CC(=O)N1CC[C@H](C1)F WXVL_AN00035SB0150 [0,0,0,1,0,1|2,0,0]=4 322 B9R1.35 CC(=O)N1CC[C@H](C1)F WXVL_AN00035SB0150 [0,0,0,1,0,1|2,0,0]=4 323 B9R1.35 CC(=O)N1CC[C@H](C1)O WXVL_AN00543SB0150 [0,0,0,1,0,1|2,0,0]=4 324 B9R1.35 CN1CCC(C1)C(=O)N WXVL_AK0084SB1540 [0,0,0,1,0,1|2,0,0]=4 325 B9R1.35 CN1CCC(C1)C(=O)N WXVL_AK0084SB1540 [0,0,0,1,0,1|2,0,0]=4 326 B9R1.35 C[C@@H]1CC[C@@H](O1)C(=O)N WXVL_AK0084SB0853 [0,0,0,1,0,1|1,0,0]=3 327 B9R1.35 C[C@@H]1CC[C@@H](O1)C(=O)N WXVL_AK0084SB0853 [0,0,0,1,0,1|1,0,0]=3 328 B9R1.84 CC(=O)NCC1CCC1 WXVL_AK00492SB0150 [0,0,0,1,0,1|1,0,0]=3 329 B9R1.84 CC(=O)NCC1CCC1 WXVL_AK00492SB0150 [0,0,0,1,0,1|1,0,0]=3 330 B9R1.84 CC(=O)NCC1CCO1 WXVL_AK1433SB0150 [0,0,0,1,0,1|2,0,0]=4 331 B9R1.84 CC(=O)NCC1CCO1 WXVL_AK1433SB0150 [0,0,0,1,0,1|2,0,0]=4 332 B9R1.84 CC(=O)NCC1COC1 WXVL_AK0186SB0150 [0,0,0,1,0,1|2,0,0]=4 333 B9R1.84 CC(=O)NCC1COC1 WXVL_AK0186SB0150 [0,0,0,1,0,1|2,0,0]=4 334 B9R1.84 NC(=O)CCC1CCC1 WXVL_AK0084SB8784 [0,0,0,1,0,1|1,0,0]=3 335 B9R1.84 NC(=O)CCC1CCC1 WXVL_AK0084SB8784 [0,0,0,1,0,1|1,0,0]=3 336 B9R1.147 CC(=O)NCC1(CC1)C WXVL_AK00811SB0150 [0,0,0,1,0,1|1,0,0]=3 337 B9R1.147 CC(=O)NCC1(CC1)C WXVL_AK00811SB0150 [0,0,0,1,0,1|1,0,0]=3 338 B9R1.147 CC(=O)NCC1(CC1)O WXVL_AK0301SB0150 [0,0,0,1,0,1|2,0,0]=4 339 B9R1.147 CC(=O)NCC1(CC1)O WXVL_AK0301SB0150 [0,0,0,1,0,1|2,0,0]=4 340 B9R1.41 CC(=O)N1CCC[C@H]1C WXVL_AN00593SB0150 [0,1,0,1,0,0|2,0,0]=4 341 B9R1.41 CC1CCCC1C(=O)N WXVL_AK0084SB0904 [0,1,0,1,0,0|1,0,0]=3 342 B9R1.41 CC1CCCC1C(=O)N WXVL_AK0084SB0904 [0,1,0,1,0,0|1,0,0]=3 343 B9R1.41 CN1CCC[C@H]1C(=O)N WXVL_AK0084SB1197 [0,1,0,1,0,0|2,0,0]=4 344 B9R1.41 CN1CCC[C@H]1C(=O)N WXVL_AK0084SB1197 [0,1,0,1,0,0|2,0,0]=4 345 B9R1.96 CC(=O)N1CC[C@@H]1CO WXVL_AN00694SB0150 [0,1,0,1,0,0|2,0,0]=4 346 B9R1.96 CC(=O)N1CC[C@H]1CO WXVL_AN3414SB0150 [0,1,0,1,0,0|2,0,0]=4 347 B9R1.96 CC(=O)N1CC[C@H]1CO WXVL_AN3414SB0150 [0,1,0,1,0,0|2,0,0]=4 348 B9R1.13 NC(=O)CC1CCCC1 WXVL_AK0084SB0044 [0,1,0,1,0,0|1,0,0]=3 349 B9R1.13 NC(=O)CC1CCCC1 WXVL_AK0084SB0044 [0,1,0,1,0,0|1,0,0]=3 350 B9R1.13 NC(=O)CN1CCCC1 WXVL_AK0084SB0201 [0,1,0,1,0,0|2,0,0]=4 351 B9R1.13 NC(=O)CN1CCCC1 WXVL_AK0084SB0201 [0,1,0,1,0,0|2,0,0]=4 352 B9R1.53 CC(=O)NC1CC(C1)C WXVL_AK0309SB0150 [0,1,0,1,0,0|2,0,0]=4 353 B9R1.53 CC(=O)NC1CC(C1)C WXVL_AK0309SB0150 [0,1,0,1,0,0|2,0,0]=4 354 B9R1.53 CC(=O)NC1CC(C1)F WXVL_AK0307SB0150 [0,1,0,1,0,0|2,0,0]=4 355 B9R1.53 CC(=O)NC1CC(C1)F WXVL_AK0307SB0150 [0,1,0,1,0,0|2,0,0]=4 356 B9R1.53 CC(=O)NC1CC(C1)O WXVL_AK0306SB0150 [0,1,0,1,0,0|2,0,0]=4 357 B9R1.53 CC(=O)NC1CC(C1)O WXVL_AK0306SB0150 [0,1,0,1,0,0|2,0,0]=4 358 B9R1.53 CC(=O)NC1CN(C1)C WXVL_AK1377SB0150 [0,1,0,1,0,0|2,0,0]=4 359 B9R1.53 CC(=O)NC1CN(C1)C WXVL_AK1377SB0150 [0,1,0,1,0,0|2,0,0]=4 360 B9R1.53 CC(=O)N[C@H]1C[C@H](C1)O WXVL_AK1397SB0150 [0,1,0,1,0,0|2,0,0]=4 361 B9R1.53 CC(=O)N[C@H]1C[C@H](C1)O WXVL_AK1397SB0150 [0,1,0,1,0,0|2,0,0]=4 362 B9R1.137 CC(=O)NC(C)C1CC1 WXVL_AK00200SB0150 [0,1,0,1,0,0|2,0,0]=4 363 B9R1.137 CC(=O)NC(C)C1CC1 WXVL_AK00200SB0150 [0,1,0,1,0,0|2,0,0]=4 364 B9R1.137 CC(=O)N[C@@H](C)C1CC1 WXVL_AK0484SB0150 [0,1,0,1,0,0|2,0,0]=4 365 B9R1.137 CC(=O)N[C@@H](C)C1CC1 WXVL_AK0484SB0150 [0,1,0,1,0,0|2,0,0]=4 366 B9R1.171 NC(=O)CC1(CCC1)O WXVL_AK0084SB0026 [0,1,0,1,0,0|1,0,0]=3 367 B9R1.171 NC(=O)CC1(CCC1)O WXVL_AK0084SB0026 [0,1,0,1,0,0|1,0,0]=3 368 B9R1.79 CNC(=O)CC1CCC1 WXVL_AK00442SB2207 [0,1,0,1,0,0|1,0,0]=3 369 B9R1.79 CNC(=O)CC1CCC1 WXVL_AK00442SB2207 [0,1,0,1,0,0|1,0,0]=3 370 B9R1.79 O=C(CO)NC1CNC1 WXVL_AK1291SB2706 [0,1,0,1,0,0|2,0,0]=4 371 B9R1.79 O=C(CO)NC1CNC1 WXVL_AK1291SB2706 [0,1,0,1,0,0|2,0,0]=4 372 B9R1.79 O=C(CO)NC1CSC1 WXVL_AK2089SB2706 [0,1,0,1,0,0|2,0,0]=4 373 B9R1.79 O=C(CO)NC1CSC1 WXVL_AK2089SB2706 [0,1,0,1,0,0|2,0,0]=4 374 B9R1.113 C#CC(=O)NC1(CC1)C WXVL_AK0263SB0338 [0,1,0,1,0,0|2,0,0]=4 375 B9R1.113 C#CC(=O)NC1(CC1)C WXVL_AK0263SB0338 [0,1,0,1,0,0|2,0,0]=4 376 B9R1.113 CC1(CC1)NC(=O)CO WXVL_AK0263SB2706 [0,1,0,1,0,0|1,0,0]=3 377 B9R1.113 CC1(CC1)NC(=O)CO WXVL_AK0263SB2706 [0,1,0,1,0,0|1,0,0]=3 378 B9R1.113 CCC(=O)NC1(CC1)C WXVL_AK0263SB0064 [0,1,0,1,0,0|2,0,0]=4 379 B9R1.113 CCC(=O)NC1(CC1)C WXVL_AK0263SB0064 [0,1,0,1,0,0|2,0,0]=4 380 B9R1.114 NS(=O)(=O)CC1CCC1 WXVL_AK0084HU0422 [0,1,0,1,0,0|1,0,1]=4 381 B9R1.114 NS(=O)(=O)CC1CCC1 WXVL_AK0084HU0422 [0,1,0,1,0,0|1,0,1]=4 382 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [1,0,0,0,1,0|2,0,0]=4 383 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [1,0,0,0,1,0|2,0,0]=4 384 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [1,0,0,0,1,0|1,0,0]=3 385 B5R0.5 CC(C)C(=O)N WXVL_AK0084SB0052 [1,0,0,0,1,0|1,0,0]=3 386 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [1,0,0,0,1,0|2,0,0]=4 387 B5R0.5 CC(S)C(=O)N WXVL_AK0084SB2708 [1,0,0,0,1,0|2,0,0]=4 388 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [1,0,0,0,1,0|2,0,0]=4 389 B5R0.5 C[C@@H](O)C(=O)N WXVL_AK0084SB1085 [1,0,0,0,1,0|2,0,0]=4 390 B9R0.1 CC(=O)NCCC(C)CO WXVL_AK4143SB0150 [0,0,0,0,0,2|2,0,0]=4 391 B9R0.1 CC(=O)NCCC(C)CO WXVL_AK4143SB0150 [0,0,0,0,0,2|2,0,0]=4