0 B11R1.90 CC(=O)NC[C@@H]1CCCN1C WXVL_AK00784SB0150 [0,0,1,0,0,0|2,0,0]=3 1 B11R1.90 CC(=O)NC[C@@H]1CCCN1C WXVL_AK00784SB0150 [0,0,1,0,0,0|2,0,0]=3 2 B10R1.27 CNC(=O)CC1CCCC1 WXVL_AK00442SB0044 [1,0,1,0,0,0|1,0,0]=3 3 B10R1.27 CNC(=O)CC1CCCC1 WXVL_AK00442SB0044 [1,0,1,0,0,0|1,0,0]=3 4 B10R1.27 CNC(=O)CN1CCCC1 WXVL_AK00442SB0201 [1,0,1,0,0,0|2,0,0]=4 5 B10R1.27 CNC(=O)CN1CCCC1 WXVL_AK00442SB0201 [1,0,1,0,0,0|2,0,0]=4 6 B10R1.66 CC(=O)NCC1CCCC1 WXVL_AK0303SB0150 [1,0,1,0,0,0|1,0,0]=3 7 B10R1.66 CC(=O)NCC1CCCC1 WXVL_AK0303SB0150 [1,0,1,0,0,0|1,0,0]=3 8 B10R1.66 CC(=O)NCC1CCOC1 WXVL_AK00634SB0150 [1,0,1,0,0,0|2,0,0]=4 9 B10R1.66 CC(=O)NCC1CCOC1 WXVL_AK00634SB0150 [1,0,1,0,0,0|2,0,0]=4 10 B10R1.66 CC(=O)NC[C@@H]1CCCO1 WXVL_AK00754SB0150 [1,0,1,0,0,0|2,0,0]=4 11 B10R1.66 CC(=O)NC[C@@H]1CCCO1 WXVL_AK00754SB0150 [1,0,1,0,0,0|2,0,0]=4 12 B10R1.66 CC(=O)NC[C@H]1CCOC1 WXVL_AK2110SB0150 [1,0,1,0,0,0|2,0,0]=4 13 B10R1.66 CC(=O)NC[C@H]1CCOC1 WXVL_AK2110SB0150 [1,0,1,0,0,0|2,0,0]=4 14 B10R1.66 NC(=O)CCC1CCCC1 WXVL_AK0084SB0045 [1,0,1,0,0,0|2,0,0]=4 15 B10R1.66 NC(=O)CCC1CCCC1 WXVL_AK0084SB0045 [1,0,1,0,0,0|2,0,0]=4 16 B12R1.17 CCCC(=O)N1CCOC(=O)C1 WXVL_AN4960SB0073 [0,1,1,0,0,0|1,0,1]=4 17 B12R1.353 CCC(=O)NC[C@@H]1CCCN1C WXVL_AK00784SB0064 [0,1,1,0,0,0|2,0,0]=4 18 B12R1.353 CCC(=O)NC[C@@H]1CCCN1C WXVL_AK00784SB0064 [0,1,1,0,0,0|2,0,0]=4 19 B12R1.353 CN1CCC[C@H]1CNC(=O)CO WXVL_AK00784SB2706 [0,1,1,0,0,0|2,0,0]=4 20 B12R1.353 CN1CCC[C@H]1CNC(=O)CO WXVL_AK00784SB2706 [0,1,1,0,0,0|2,0,0]=4 21 B10R0.59 CCC(=O)NCCC(C)CO WXVL_AK4143SB0064 [0,0,2,0,0,0|2,0,0]=4 22 B10R0.59 CCC(=O)NCCC(C)CO WXVL_AK4143SB0064 [0,0,2,0,0,0|2,0,0]=4 23 B10R0.1 CCCCCNC(=O)CCC WXVL_AK0076SB0073 [0,0,2,0,0,0|2,0,0]=4 24 B10R0.1 CCCCCNC(=O)CCC WXVL_AK0076SB0073 [0,0,2,0,0,0|2,0,0]=4 25 B10R0.1 CCNC(=O)CCCCCBr WXVL_AK00476SB2192 [0,0,2,0,0,0|2,0,0]=4 26 B10R0.1 CCNC(=O)CCCCCBr WXVL_AK00476SB2192 [0,0,2,0,0,0|2,0,0]=4 27 B10R0.1 CCNC(=O)CCCCCO WXVL_AK00476SB2973 [0,0,2,0,0,0|2,0,0]=4 28 B10R0.1 CCNC(=O)CCCCCO WXVL_AK00476SB2973 [0,0,2,0,0,0|2,0,0]=4 29 B10R0.4 CC(=O)NCCCCCCO WXVL_AK0751SB0150 [0,0,2,0,0,0|2,0,0]=4 30 B10R0.4 CC(=O)NCCCCCCO WXVL_AK0751SB0150 [0,0,2,0,0,0|2,0,0]=4 31 B10R0.4 CCCCCCCCC(=O)N WXVL_AK0084SB0409 [0,0,2,0,0,0|2,0,0]=4 32 B10R0.4 CCCCCCCCC(=O)N WXVL_AK0084SB0409 [0,0,2,0,0,0|2,0,0]=4 33 B10R0.4 CCCCOCCNC(=O)C WXVL_AK9674SB0150 [0,0,2,0,0,0|2,0,0]=4 34 B10R0.4 CCCCOCCNC(=O)C WXVL_AK9674SB0150 [0,0,2,0,0,0|2,0,0]=4 35 B10R0.91 CCCCNC(=O)CCOC WXVL_AK00588SB0156 [0,0,2,0,0,0|2,0,0]=4 36 B10R0.91 CCCCNC(=O)CCOC WXVL_AK00588SB0156 [0,0,2,0,0,0|2,0,0]=4 37 B10R0.91 CCCCNC(=O)CCSC WXVL_AK00588SB0361 [0,0,2,0,0,0|2,0,0]=4 38 B10R0.91 CCCCNC(=O)CCSC WXVL_AK00588SB0361 [0,0,2,0,0,0|2,0,0]=4 39 B10R0.91 CCCCNC(=O)COCC WXVL_AK00588SB0091 [0,0,2,0,0,0|2,0,0]=4 40 B10R0.91 CCCCNC(=O)COCC WXVL_AK00588SB0091 [0,0,2,0,0,0|2,0,0]=4 41 B10R0.91 CCCCNC(=O)CSCC WXVL_AK00588SB0002 [0,0,2,0,0,0|2,0,0]=4 42 B10R0.91 CCCCNC(=O)CSCC WXVL_AK00588SB0002 [0,0,2,0,0,0|2,0,0]=4 43 B10R0.3 CCCC(=O)NCCC(C)C WXVL_AK0068SB0073 [0,0,2,0,0,0|1,0,0]=3 44 B10R0.3 CCCC(=O)NCCC(C)C WXVL_AK0068SB0073 [0,0,2,0,0,0|1,0,0]=3 45 B10R0.3 CCCC(=O)NCCN(C)C WXVL_AK0058SB0073 [0,0,2,0,0,0|2,0,0]=4 46 B10R0.3 CCCC(=O)NCCN(C)C WXVL_AK0058SB0073 [0,0,2,0,0,0|2,0,0]=4 47 B10R0.3 CCNC(=O)CCCC(C)C WXVL_AK00476SB1301 [0,0,2,0,0,0|2,0,0]=4 48 B10R0.3 CCNC(=O)CCCC(C)C WXVL_AK00476SB1301 [0,0,2,0,0,0|2,0,0]=4 49 B10R0.3 COCC(=O)NCCC(C)C WXVL_AK0068SB0090 [0,0,2,0,0,0|2,0,0]=4 50 B10R0.3 COCC(=O)NCCC(C)C WXVL_AK0068SB0090 [0,0,2,0,0,0|2,0,0]=4 51 B10R0.3 CSCC(=O)NCCC(C)C WXVL_AK0068SB1267 [0,0,2,0,0,0|2,0,0]=4 52 B10R0.3 CSCC(=O)NCCC(C)C WXVL_AK0068SB1267 [0,0,2,0,0,0|2,0,0]=4 53 B12R2.1596 CCC(=O)N1CC2CCC1C2 WXVL_AN3504SB0064 [0,0,1,1,0,0|2,0,0]=4 54 B12R2.1596 CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2 WXVL_AK00442SB1121 [0,0,1,1,0,0|2,0,0]=4 55 B12R2.1596 CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2 WXVL_AK00442SB1121 [0,0,1,1,0,0|2,0,0]=4 56 B12R2.252 CC(=O)N1CC2CCCC2C1 WXVL_AN0179SB0150 [0,0,1,1,0,0|1,0,0]=3 57 B12R2.252 CC(=O)N1CC2CCCC2C1 WXVL_AN0179SB0150 [0,0,1,1,0,0|1,0,0]=3 58 B12R2.252 CC(=O)N1CC2COCC2C1 WXVL_AN0908SB0150 [0,0,1,1,0,0|2,0,0]=4 59 B12R2.252 CC(=O)N1C[C@H]2COC[C@H]2C1 WXVL_AN00205SB0150 [0,0,1,1,0,0|2,0,0]=4 60 B12R2.252 CC(=O)N1C[C@H]2COC[C@H]2C1 WXVL_AN00205SB0150 [0,0,1,1,0,0|2,0,0]=4 61 B12R2.1017 CC(=O)N1C[C@@H]2C[C@H]1CN2C WXVL_AN00538SB0150 [0,0,1,1,0,0|2,0,0]=4 62 B12R2.1017 CC(=O)N1C[C@H]2C[C@@H]1CN2C WXVL_AN00645SB0150 [0,0,1,1,0,0|2,0,0]=4 63 B10R1.150 CCC(=O)NC1CC(C1)C WXVL_AK0309SB0064 [0,0,1,0,1,0|2,0,0]=4 64 B10R1.150 CCC(=O)NC1CC(C1)C WXVL_AK0309SB0064 [0,0,1,0,1,0|2,0,0]=4 65 B12R1.26 CCC(=O)NCC1CCC(C1)F WXVL_AK00226SB0064 [0,0,1,0,0,1|2,0,0]=4 66 B12R1.26 CCC(=O)NCC1CCC(C1)F WXVL_AK00226SB0064 [0,0,1,0,0,1|2,0,0]=4 67 B12R1.130 CC(=O)NCCC1CCCN1C WXVL_AK2343SB0150 [0,0,1,0,0,1|2,0,0]=4 68 B12R1.130 CC(=O)NCCC1CCCN1C WXVL_AK2343SB0150 [0,0,1,0,0,1|2,0,0]=4