0 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [0,0,0,0,0,0|4,0,0]=4 1 B5R0.1 CCCC(=O)N WXVL_AK0084SB0073 [0,0,0,0,0,0|4,0,0]=4 2 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [0,0,0,0,0,0|4,0,0]=4 3 B5R0.1 CCNC(=O)C WXVL_AK00476SB0150 [0,0,0,0,0,0|4,0,0]=4 4 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [1,0,0,0,0,0|3,0,0]=4 5 B4R0.1 CCC(=O)N WXVL_AK0084SB0064 [1,0,0,0,0,0|3,0,0]=4 6 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [1,0,0,0,0,0|3,0,0]=4 7 B4R0.1 CNC(=O)C WXVL_AK00442SB0150 [1,0,0,0,0,0|3,0,0]=4 8 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [1,0,0,0,0,0|3,0,0]=4 9 B4R0.1 NC(=O)CO WXVL_AK0084SB2706 [1,0,0,0,0,0|3,0,0]=4 10 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [0,1,0,0,0,0|3,0,0]=4 11 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [0,1,0,0,0,0|3,0,0]=4 12 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [0,1,0,0,0,0|1,0,2]=4 13 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [0,1,0,0,0,0|1,0,2]=4 14 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [0,1,0,0,0,0|3,0,0]=4 15 B6R0.2 CC(O)CC(=O)N WXVL_AK0084SB3643 [0,1,0,0,0,0|3,0,0]=4 16 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [0,1,0,0,0,0|0,0,2]=3 17 B6R0.2 CN(C)CC(=O)N WXVL_AK0084SB0085 [0,1,0,0,0,0|0,0,2]=3 18 B6R0.3 C#CC(=O)N(C)C WXVL_AN0032SB0338 [0,1,0,0,0,0|1,0,2]=4 19 B6R0.3 C#CC(=O)N(C)C WXVL_AN0032SB0338 [0,1,0,0,0,0|1,0,2]=4 20 B6R0.3 CCC(=O)N(C)C WXVL_AN0032SB0064 [0,1,0,0,0,0|1,0,1]=3 21 B6R0.3 CCC(=O)N(C)C WXVL_AN0032SB0064 [0,1,0,0,0,0|1,0,1]=3 22 B6R0.3 CN(C)C(=O)CO WXVL_AN0032SB2706 [0,1,0,0,0,0|0,0,1]=2 23 B6R0.3 CN(C)C(=O)CO WXVL_AN0032SB2706 [0,1,0,0,0,0|0,0,1]=2 24 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [0,1,0,0,0,0|3,0,0]=4 25 B6R0.4 CC(=O)NCCF WXVL_AK00466SB0150 [0,1,0,0,0,0|3,0,0]=4 26 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [0,1,0,0,0,0|3,0,0]=4 27 B6R0.4 CCCNC(=O)C WXVL_AK00504SB0150 [0,1,0,0,0,0|3,0,0]=4 28 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [0,1,0,0,0,0|3,0,0]=4 29 B6R0.4 COCCC(=O)N WXVL_AK0084SB0156 [0,1,0,0,0,0|3,0,0]=4 30 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [1,1,0,0,0,0|2,0,0]=4 31 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [1,1,0,0,0,0|2,0,0]=4 32 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [1,1,0,0,0,0|2,0,0]=4 33 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [1,1,0,0,0,0|2,0,0]=4 34 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [1,1,0,0,0,0|0,0,1]=3 35 B5R0.5 CC(=O)N(C)C WXVL_AN0032SB0150 [1,1,0,0,0,0|0,0,1]=3 36 B7R0.2 CC(=O)N[C@@H](C)CO WXVL_AK0109SB0150 [0,2,0,0,0,0|2,0,0]=4 37 B7R0.2 CC(=O)N[C@@H](C)CO WXVL_AK0109SB0150 [0,2,0,0,0,0|2,0,0]=4 38 B7R0.2 CC(C)NC(=O)CO WXVL_AK0030SB2706 [0,2,0,0,0,0|1,0,1]=4 39 B7R0.2 CC(C)NC(=O)CO WXVL_AK0030SB2706 [0,2,0,0,0,0|1,0,1]=4 40 B7R0.2 CNC(=O)CC(C)O WXVL_AK00442SB3643 [0,2,0,0,0,0|2,0,0]=4 41 B7R0.2 CNC(=O)CC(C)O WXVL_AK00442SB3643 [0,2,0,0,0,0|2,0,0]=4 42 B7R0.2 CNC(=O)CN(C)C WXVL_AK00442SB0085 [0,2,0,0,0,0|0,0,2]=4 43 B7R0.2 CNC(=O)CN(C)C WXVL_AK00442SB0085 [0,2,0,0,0,0|0,0,2]=4 44 B7R0.3 CNC(=O)CCOC WXVL_AK00442SB0156 [0,2,0,0,0,0|2,0,0]=4 45 B7R0.3 CNC(=O)CCOC WXVL_AK00442SB0156 [0,2,0,0,0,0|2,0,0]=4 46 B7R0.5 C#CCC(=O)N(C)C WXVL_AN0032SB3070 [0,2,0,0,0,0|1,0,1]=4 47 B7R0.5 C#CCC(=O)N(C)C WXVL_AN0032SB3070 [0,2,0,0,0,0|1,0,1]=4 48 B7R0.5 C=CCC(=O)N(C)C WXVL_AN0032SB2732 [0,2,0,0,0,0|1,0,1]=4 49 B7R0.5 C=CCC(=O)N(C)C WXVL_AN0032SB2732 [0,2,0,0,0,0|1,0,1]=4 50 B7R0.5 CC(=O)N(C)CC#N WXVL_AN2942SB0150 [0,2,0,0,0,0|1,0,1]=4 51 B7R0.5 CC(=O)N(C)CC#N WXVL_AN2942SB0150 [0,2,0,0,0,0|1,0,1]=4 52 B7R0.5 CC(=O)N(C)CCO WXVL_AN2670SB0150 [0,2,0,0,0,0|0,0,0]=2 53 B7R0.5 CC(=O)N(C)CCO WXVL_AN2670SB0150 [0,2,0,0,0,0|0,0,0]=2 54 B7R0.5 CCCC(=O)N(C)C WXVL_AN0032SB0073 [0,2,0,0,0,0|1,0,0]=3 55 B7R0.5 CCCC(=O)N(C)C WXVL_AN0032SB0073 [0,2,0,0,0,0|1,0,0]=3 56 B7R0.5 CN(C)C(=O)CC#N WXVL_AN0032SB0057 [0,2,0,0,0,0|1,0,1]=4 57 B7R0.5 CN(C)C(=O)CC#N WXVL_AN0032SB0057 [0,2,0,0,0,0|1,0,1]=4 58 B7R0.5 COCC(=O)N(C)C WXVL_AN0032SB0090 [0,2,0,0,0,0|0,0,1]=3 59 B7R0.5 COCC(=O)N(C)C WXVL_AN0032SB0090 [0,2,0,0,0,0|0,0,1]=3 60 B7R0.5 CSCC(=O)N(C)C WXVL_AN0032SB1267 [0,2,0,0,0,0|0,1,1]=4 61 B7R0.5 CSCC(=O)N(C)C WXVL_AN0032SB1267 [0,2,0,0,0,0|0,1,1]=4 62 B7R0.16 CC(C)C(=O)N(C)C WXVL_AN0032SB0052 [0,2,0,0,0,0|1,0,1]=4 63 B7R0.16 CC(C)C(=O)N(C)C WXVL_AN0032SB0052 [0,2,0,0,0,0|1,0,1]=4 64 B7R0.16 CC(S)C(=O)N(C)C WXVL_AN0032SB2708 [0,2,0,0,0,0|0,1,1]=4 65 B7R0.16 CC(S)C(=O)N(C)C WXVL_AN0032SB2708 [0,2,0,0,0,0|0,1,1]=4 66 B7R0.16 CN(C)C(=O)C(F)F WXVL_AN0032SB0079 [0,2,0,0,0,0|1,0,1]=4 67 B7R0.16 CN(C)C(=O)C(F)F WXVL_AN0032SB0079 [0,2,0,0,0,0|1,0,1]=4 68 B7R0.16 C[C@@H](O)C(=O)N(C)C WXVL_AN0032SB1085 [0,2,0,0,0,0|0,0,1]=3 69 B7R0.16 C[C@@H](O)C(=O)N(C)C WXVL_AN0032SB1085 [0,2,0,0,0,0|0,0,1]=3 70 B7R0.13 CCS(=O)(=O)N(C)C WXVL_AN0032HU0028 [0,2,0,0,0,0|2,0,0]=4 71 B7R0.13 CCS(=O)(=O)N(C)C WXVL_AN0032HU0028 [0,2,0,0,0,0|2,0,0]=4 72 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [0,2,0,0,0,0|2,0,0]=4 73 B7R0.4 CC(=O)NCCCO WXVL_AK0073SB0150 [0,2,0,0,0,0|2,0,0]=4 74 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [0,2,0,0,0,0|2,0,0]=4 75 B7R0.6 CC(=O)NCC(C)O WXVL_AK0052SB0150 [0,2,0,0,0,0|2,0,0]=4 76 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [0,2,0,0,0,0|2,0,0]=4 77 B7R0.6 CC(=O)NC[C@H](C)O WXVL_AK0113SB0150 [0,2,0,0,0,0|2,0,0]=4 78 B7R0.6 CC(C)CCC(=O)N WXVL_AK0084SB0354 [0,2,0,0,0,0|1,0,1]=4 79 B7R0.6 CC(C)CCC(=O)N WXVL_AK0084SB0354 [0,2,0,0,0,0|1,0,1]=4 80 B7R0.6 CN(C)CCC(=O)N WXVL_AK0084SB00052 [0,2,0,0,0,0|0,0,1]=3 81 B7R0.6 CN(C)CCC(=O)N WXVL_AK0084SB00052 [0,2,0,0,0,0|0,0,1]=3