0 B16R1.18213 CC(=O)CCC(=O)NCCc1ccccc1 WXVL_AK00498SB0072 [0,0,0,0,0,0|1,0,2]=3 1 B16R1.18213 CC(=O)CCC(=O)NCCc1ccccc1 WXVL_AK00498SB0072 [0,0,0,0,0,0|1,0,2]=3 2 B16R1.18213 CC(=O)CCC(=O)NCCc1ccccn1 WXVL_AK0019SB0072 [0,0,0,0,0,0|2,0,2]=4 3 B16R1.18213 CC(=O)CCC(=O)NCCc1ccccn1 WXVL_AK0019SB0072 [0,0,0,0,0,0|2,0,2]=4 4 B16R1.18213 CC(=O)CCC(=O)NCCc1cccnc1 WXVL_AK00436SB0072 [0,0,0,0,0,0|2,0,2]=4 5 B16R1.18213 CC(=O)CCC(=O)NCCc1cccnc1 WXVL_AK00436SB0072 [0,0,0,0,0,0|2,0,2]=4 6 B16R1.18213 CC(=O)CCC(=O)NCCc1ccncc1 WXVL_AK0093SB0072 [0,0,0,0,0,0|2,0,2]=4 7 B16R1.18213 CC(=O)CCC(=O)NCCc1ccncc1 WXVL_AK0093SB0072 [0,0,0,0,0,0|2,0,2]=4 8 B16R1.18213 CC(=O)NCC(=O)NCCc1ccccc1 WXVL_AK00498SB0357 [0,0,0,0,0,0|2,0,1]=3 9 B16R1.18213 CC(=O)NCC(=O)NCCc1ccccc1 WXVL_AK00498SB0357 [0,0,0,0,0,0|2,0,1]=3 10 B16R1.18213 CC(=O)NCC(=O)NCCc1ccccn1 WXVL_AK0019SB0357 [0,0,0,0,0,0|3,0,1]=4 11 B16R1.18213 CC(=O)NCC(=O)NCCc1ccccn1 WXVL_AK0019SB0357 [0,0,0,0,0,0|3,0,1]=4 12 B16R1.18213 CC(=O)NCC(=O)NCCc1cccnc1 WXVL_AK00436SB0357 [0,0,0,0,0,0|3,0,1]=4 13 B16R1.18213 CC(=O)NCC(=O)NCCc1cccnc1 WXVL_AK00436SB0357 [0,0,0,0,0,0|3,0,1]=4 14 B16R1.18213 CC(=O)NCC(=O)NCCc1ccncc1 WXVL_AK0093SB0357 [0,0,0,0,0,0|3,0,1]=4 15 B16R1.18213 CC(=O)NCC(=O)NCCc1ccncc1 WXVL_AK0093SB0357 [0,0,0,0,0,0|3,0,1]=4 16 B16R1.18213 CC(=O)OCC(=O)NCCc1ccccc1 WXVL_AK00498SB2824 [0,0,0,0,0,0|2,0,1]=3 17 B16R1.18213 CC(=O)OCC(=O)NCCc1ccccc1 WXVL_AK00498SB2824 [0,0,0,0,0,0|2,0,1]=3 18 B16R1.18213 CC(=O)OCC(=O)NCCc1ccccn1 WXVL_AK0019SB2824 [0,0,0,0,0,0|3,0,1]=4 19 B16R1.18213 CC(=O)OCC(=O)NCCc1ccccn1 WXVL_AK0019SB2824 [0,0,0,0,0,0|3,0,1]=4 20 B16R1.18213 CC(=O)OCC(=O)NCCc1cccnc1 WXVL_AK00436SB2824 [0,0,0,0,0,0|3,0,1]=4 21 B16R1.18213 CC(=O)OCC(=O)NCCc1cccnc1 WXVL_AK00436SB2824 [0,0,0,0,0,0|3,0,1]=4 22 B16R1.18213 CC(=O)OCC(=O)NCCc1ccncc1 WXVL_AK0093SB2824 [0,0,0,0,0,0|3,0,1]=4 23 B16R1.18213 CC(=O)OCC(=O)NCCc1ccncc1 WXVL_AK0093SB2824 [0,0,0,0,0,0|3,0,1]=4 24 B16R1.18213 CC(=O)SCC(=O)NCCc1ccccc1 WXVL_AK00498SB3992 [0,0,0,0,0,0|2,0,1]=3 25 B16R1.18213 CC(=O)SCC(=O)NCCc1ccccc1 WXVL_AK00498SB3992 [0,0,0,0,0,0|2,0,1]=3 26 B16R1.18213 CC(=O)SCC(=O)NCCc1ccccn1 WXVL_AK0019SB3992 [0,0,0,0,0,0|3,0,1]=4 27 B16R1.18213 CC(=O)SCC(=O)NCCc1ccccn1 WXVL_AK0019SB3992 [0,0,0,0,0,0|3,0,1]=4 28 B16R1.18213 CC(=O)SCC(=O)NCCc1cccnc1 WXVL_AK00436SB3992 [0,0,0,0,0,0|3,0,1]=4 29 B16R1.18213 CC(=O)SCC(=O)NCCc1cccnc1 WXVL_AK00436SB3992 [0,0,0,0,0,0|3,0,1]=4 30 B16R1.18213 CC(=O)SCC(=O)NCCc1ccncc1 WXVL_AK0093SB3992 [0,0,0,0,0,0|3,0,1]=4 31 B16R1.18213 CC(=O)SCC(=O)NCCc1ccncc1 WXVL_AK0093SB3992 [0,0,0,0,0,0|3,0,1]=4 32 B16R1.18213 CC(C)/C=C/C(=O)NCCc1ccccc1 WXVL_AK00498SB0036 [0,0,0,0,0,0|2,0,1]=3 33 B16R1.18213 CC(C)/C=C/C(=O)NCCc1ccccc1 WXVL_AK00498SB0036 [0,0,0,0,0,0|2,0,1]=3 34 B16R1.18213 CC(C)/C=C/C(=O)NCCc1ccccn1 WXVL_AK0019SB0036 [0,0,0,0,0,0|3,0,1]=4 35 B16R1.18213 CC(C)/C=C/C(=O)NCCc1ccccn1 WXVL_AK0019SB0036 [0,0,0,0,0,0|3,0,1]=4 36 B16R1.18213 CC(C)/C=C/C(=O)NCCc1cccnc1 WXVL_AK00436SB0036 [0,0,0,0,0,0|3,0,1]=4 37 B16R1.18213 CC(C)/C=C/C(=O)NCCc1cccnc1 WXVL_AK00436SB0036 [0,0,0,0,0,0|3,0,1]=4 38 B16R1.18213 CC(C)/C=C/C(=O)NCCc1ccncc1 WXVL_AK0093SB0036 [0,0,0,0,0,0|3,0,1]=4 39 B16R1.18213 CC(C)/C=C/C(=O)NCCc1ccncc1 WXVL_AK0093SB0036 [0,0,0,0,0,0|3,0,1]=4 40 B16R1.18213 NC(=O)CCC(=O)NCCc1ccccc1 WXVL_AK00498SB0358 [0,0,0,0,0,0|1,0,2]=3 41 B16R1.18213 NC(=O)CCC(=O)NCCc1ccccc1 WXVL_AK00498SB0358 [0,0,0,0,0,0|1,0,2]=3 42 B16R1.18213 NC(=O)CCC(=O)NCCc1ccccn1 WXVL_AK0019SB0358 [0,0,0,0,0,0|2,0,2]=4 43 B16R1.18213 NC(=O)CCC(=O)NCCc1ccccn1 WXVL_AK0019SB0358 [0,0,0,0,0,0|2,0,2]=4 44 B16R1.18213 NC(=O)CCC(=O)NCCc1cccnc1 WXVL_AK00436SB0358 [0,0,0,0,0,0|2,0,2]=4 45 B16R1.18213 NC(=O)CCC(=O)NCCc1cccnc1 WXVL_AK00436SB0358 [0,0,0,0,0,0|2,0,2]=4 46 B16R1.18213 NC(=O)CCC(=O)NCCc1ccncc1 WXVL_AK0093SB0358 [0,0,0,0,0,0|2,0,2]=4 47 B16R1.18213 NC(=O)CCC(=O)NCCc1ccncc1 WXVL_AK0093SB0358 [0,0,0,0,0,0|2,0,2]=4 48 B16R1.18213 NC(=O)CNC(=O)CCCc1ccccc1 WXVL_AK0147SB0121 [0,0,0,0,0,0|3,0,1]=4 49 B16R1.18213 NC(=O)CNC(=O)CCCc1ccccc1 WXVL_AK0147SB0121 [0,0,0,0,0,0|3,0,1]=4 50 B16R1.18213 NC(=O)NCC(=O)NCCc1ccccc1 WXVL_AK00498SB0746 [0,0,0,0,0,0|2,0,1]=3 51 B16R1.18213 NC(=O)NCC(=O)NCCc1ccccc1 WXVL_AK00498SB0746 [0,0,0,0,0,0|2,0,1]=3 52 B16R1.18213 NC(=O)NCC(=O)NCCc1ccccn1 WXVL_AK0019SB0746 [0,0,0,0,0,0|3,0,1]=4 53 B16R1.18213 NC(=O)NCC(=O)NCCc1ccccn1 WXVL_AK0019SB0746 [0,0,0,0,0,0|3,0,1]=4 54 B16R1.18213 NC(=O)NCC(=O)NCCc1cccnc1 WXVL_AK00436SB0746 [0,0,0,0,0,0|3,0,1]=4 55 B16R1.18213 NC(=O)NCC(=O)NCCc1cccnc1 WXVL_AK00436SB0746 [0,0,0,0,0,0|3,0,1]=4 56 B16R1.18213 NC(=O)NCC(=O)NCCc1ccncc1 WXVL_AK0093SB0746 [0,0,0,0,0,0|3,0,1]=4 57 B16R1.18213 NC(=O)NCC(=O)NCCc1ccncc1 WXVL_AK0093SB0746 [0,0,0,0,0,0|3,0,1]=4 58 B16R1.18213 O=C(O)C#CC(=O)NCCc1ccccc1 WXVL_AK00498SB1110 [0,0,0,0,0,0|0,0,2]=2 59 B16R1.18213 O=C(O)C#CC(=O)NCCc1ccccc1 WXVL_AK00498SB1110 [0,0,0,0,0,0|0,0,2]=2 60 B16R1.18213 O=C(O)C#CC(=O)NCCc1ccccn1 WXVL_AK0019SB1110 [0,0,0,0,0,0|1,0,2]=3 61 B16R1.18213 O=C(O)C#CC(=O)NCCc1ccccn1 WXVL_AK0019SB1110 [0,0,0,0,0,0|1,0,2]=3 62 B16R1.18213 O=C(O)C#CC(=O)NCCc1cccnc1 WXVL_AK00436SB1110 [0,0,0,0,0,0|1,0,2]=3 63 B16R1.18213 O=C(O)C#CC(=O)NCCc1cccnc1 WXVL_AK00436SB1110 [0,0,0,0,0,0|1,0,2]=3 64 B16R1.18213 O=C(O)C#CC(=O)NCCc1ccncc1 WXVL_AK0093SB1110 [0,0,0,0,0,0|1,0,2]=3 65 B16R1.18213 O=C(O)C#CC(=O)NCCc1ccncc1 WXVL_AK0093SB1110 [0,0,0,0,0,0|1,0,2]=3 66 B16R1.18213 O=C(O)C#CC(=O)NCCc1ccncn1 WXVL_AK6509SB1110 [0,0,0,0,0,0|2,0,2]=4 67 B16R1.18213 O=C(O)C#CC(=O)NCCc1ccncn1 WXVL_AK6509SB1110 [0,0,0,0,0,0|2,0,2]=4 68 B15R1.157 C=CCCC(=O)NCCc1ccccc1 WXVL_AK00498SB1035 [1,0,0,0,0,0|1,0,2]=4 69 B15R1.157 C=CCCC(=O)NCCc1ccccc1 WXVL_AK00498SB1035 [1,0,0,0,0,0|1,0,2]=4 70 B15R1.157 O=C(/C=C/CBr)NCCc1ccccc1 WXVL_AK00498SB0424 [1,0,0,0,0,0|1,0,1]=3 71 B15R1.157 O=C(/C=C/CBr)NCCc1ccccc1 WXVL_AK00498SB0424 [1,0,0,0,0,0|1,0,1]=3 72 B15R1.157 O=C(/C=C/CBr)NCCc1ccccn1 WXVL_AK0019SB0424 [1,0,0,0,0,0|2,0,1]=4 73 B15R1.157 O=C(/C=C/CBr)NCCc1ccccn1 WXVL_AK0019SB0424 [1,0,0,0,0,0|2,0,1]=4 74 B15R1.157 O=C(/C=C/CBr)NCCc1cccnc1 WXVL_AK00436SB0424 [1,0,0,0,0,0|2,0,1]=4 75 B15R1.157 O=C(/C=C/CBr)NCCc1cccnc1 WXVL_AK00436SB0424 [1,0,0,0,0,0|2,0,1]=4 76 B15R1.157 O=C(/C=C/CBr)NCCc1ccncc1 WXVL_AK0093SB0424 [1,0,0,0,0,0|2,0,1]=4 77 B15R1.157 O=C(/C=C/CBr)NCCc1ccncc1 WXVL_AK0093SB0424 [1,0,0,0,0,0|2,0,1]=4 78 B17R1.1143 CC(=O)CCC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB0072 [0,1,0,0,0,0|1,0,2]=4 79 B17R1.1143 CC(=O)CCC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB0072 [0,1,0,0,0,0|1,0,2]=4 80 B17R1.1143 CC(=O)CCC(=O)NCCc1ccc(cc1)C WXVL_AK0066SB0072 [0,1,0,0,0,0|1,0,2]=4 81 B17R1.1143 CC(=O)CCC(=O)NCCc1ccc(cc1)C WXVL_AK0066SB0072 [0,1,0,0,0,0|1,0,2]=4 82 B17R1.1143 CC(=O)CCC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB0072 [0,1,0,0,0,0|1,0,2]=4 83 B17R1.1143 CC(=O)CCC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB0072 [0,1,0,0,0,0|1,0,2]=4 84 B17R1.1143 CC(=O)CCC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB0072 [0,1,0,0,0,0|1,0,2]=4 85 B17R1.1143 CC(=O)CCC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB0072 [0,1,0,0,0,0|1,0,2]=4 86 B17R1.1143 CC(=O)CCC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB0072 [0,1,0,0,0,0|1,0,2]=4 87 B17R1.1143 CC(=O)CCC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB0072 [0,1,0,0,0,0|1,0,2]=4 88 B17R1.1143 CC(=O)NCC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB0357 [0,1,0,0,0,0|2,0,1]=4 89 B17R1.1143 CC(=O)NCC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB0357 [0,1,0,0,0,0|2,0,1]=4 90 B17R1.1143 CC(=O)NCC(=O)NCCc1ccc(cc1)C WXVL_AK0066SB0357 [0,1,0,0,0,0|2,0,1]=4 91 B17R1.1143 CC(=O)NCC(=O)NCCc1ccc(cc1)C WXVL_AK0066SB0357 [0,1,0,0,0,0|2,0,1]=4 92 B17R1.1143 CC(=O)NCC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB0357 [0,1,0,0,0,0|2,0,1]=4 93 B17R1.1143 CC(=O)NCC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB0357 [0,1,0,0,0,0|2,0,1]=4 94 B17R1.1143 CC(=O)NCC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB0357 [0,1,0,0,0,0|2,0,1]=4 95 B17R1.1143 CC(=O)NCC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB0357 [0,1,0,0,0,0|2,0,1]=4 96 B17R1.1143 CC(=O)NCC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB0357 [0,1,0,0,0,0|2,0,1]=4 97 B17R1.1143 CC(=O)NCC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB0357 [0,1,0,0,0,0|2,0,1]=4 98 B17R1.1143 CC(=O)OCC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB2824 [0,1,0,0,0,0|2,0,1]=4 99 B17R1.1143 CC(=O)OCC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB2824 [0,1,0,0,0,0|2,0,1]=4 100 B17R1.1143 CC(=O)OCC(=O)NCCc1ccc(cc1)C WXVL_AK0066SB2824 [0,1,0,0,0,0|2,0,1]=4 101 B17R1.1143 CC(=O)OCC(=O)NCCc1ccc(cc1)C WXVL_AK0066SB2824 [0,1,0,0,0,0|2,0,1]=4 102 B17R1.1143 CC(=O)OCC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB2824 [0,1,0,0,0,0|2,0,1]=4 103 B17R1.1143 CC(=O)OCC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB2824 [0,1,0,0,0,0|2,0,1]=4 104 B17R1.1143 CC(=O)OCC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB2824 [0,1,0,0,0,0|2,0,1]=4 105 B17R1.1143 CC(=O)OCC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB2824 [0,1,0,0,0,0|2,0,1]=4 106 B17R1.1143 CC(=O)OCC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB2824 [0,1,0,0,0,0|2,0,1]=4 107 B17R1.1143 CC(=O)OCC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB2824 [0,1,0,0,0,0|2,0,1]=4 108 B17R1.1143 CC(=O)SCC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB3992 [0,1,0,0,0,0|2,0,1]=4 109 B17R1.1143 CC(=O)SCC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB3992 [0,1,0,0,0,0|2,0,1]=4 110 B17R1.1143 CC(=O)SCC(=O)NCCc1ccc(cc1)C WXVL_AK0066SB3992 [0,1,0,0,0,0|2,0,1]=4 111 B17R1.1143 CC(=O)SCC(=O)NCCc1ccc(cc1)C WXVL_AK0066SB3992 [0,1,0,0,0,0|2,0,1]=4 112 B17R1.1143 CC(=O)SCC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB3992 [0,1,0,0,0,0|2,0,1]=4 113 B17R1.1143 CC(=O)SCC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB3992 [0,1,0,0,0,0|2,0,1]=4 114 B17R1.1143 CC(=O)SCC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB3992 [0,1,0,0,0,0|2,0,1]=4 115 B17R1.1143 CC(=O)SCC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB3992 [0,1,0,0,0,0|2,0,1]=4 116 B17R1.1143 CC(=O)SCC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB3992 [0,1,0,0,0,0|2,0,1]=4 117 B17R1.1143 CC(=O)SCC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB3992 [0,1,0,0,0,0|2,0,1]=4 118 B17R1.1143 CC(C)/C=C/C(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB0036 [0,1,0,0,0,0|2,0,1]=4 119 B17R1.1143 CC(C)/C=C/C(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB0036 [0,1,0,0,0,0|2,0,1]=4 120 B17R1.1143 CC(C)/C=C/C(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB0036 [0,1,0,0,0,0|2,0,1]=4 121 B17R1.1143 CC(C)/C=C/C(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB0036 [0,1,0,0,0,0|2,0,1]=4 122 B17R1.1143 CC(C)/C=C/C(=O)NCCc1ccc(cc1)F WXVL_AK0123SB0036 [0,1,0,0,0,0|2,0,1]=4 123 B17R1.1143 CC(C)/C=C/C(=O)NCCc1ccc(cc1)F WXVL_AK0123SB0036 [0,1,0,0,0,0|2,0,1]=4 124 B17R1.1143 CC(C)/C=C/C(=O)NCCc1ccc(cc1)O WXVL_AK0748SB0036 [0,1,0,0,0,0|2,0,1]=4 125 B17R1.1143 CC(C)/C=C/C(=O)NCCc1ccc(cc1)O WXVL_AK0748SB0036 [0,1,0,0,0,0|2,0,1]=4 126 B17R1.1143 Cc1ccc(cc1)CCNC(=O)/C=C/C(C)C WXVL_AK0066SB0036 [0,1,0,0,0,0|2,0,1]=4 127 B17R1.1143 Cc1ccc(cc1)CCNC(=O)/C=C/C(C)C WXVL_AK0066SB0036 [0,1,0,0,0,0|2,0,1]=4 128 B17R1.1143 Cc1ccc(cc1)CCNC(=O)C#CC(=O)O WXVL_AK0066SB1110 [0,1,0,0,0,0|0,0,2]=3 129 B17R1.1143 Cc1ccc(cc1)CCNC(=O)C#CC(=O)O WXVL_AK0066SB1110 [0,1,0,0,0,0|0,0,2]=3 130 B17R1.1143 Cc1ccc(cc1)CCNC(=O)CCC(=O)N WXVL_AK0066SB0358 [0,1,0,0,0,0|1,0,2]=4 131 B17R1.1143 Cc1ccc(cc1)CCNC(=O)CCC(=O)N WXVL_AK0066SB0358 [0,1,0,0,0,0|1,0,2]=4 132 B17R1.1143 Cc1ccc(cc1)CCNC(=O)CNC(=O)N WXVL_AK0066SB0746 [0,1,0,0,0,0|2,0,1]=4 133 B17R1.1143 Cc1ccc(cc1)CCNC(=O)CNC(=O)N WXVL_AK0066SB0746 [0,1,0,0,0,0|2,0,1]=4 134 B17R1.1143 NC(=O)CCC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB0358 [0,1,0,0,0,0|1,0,2]=4 135 B17R1.1143 NC(=O)CCC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB0358 [0,1,0,0,0,0|1,0,2]=4 136 B17R1.1143 NC(=O)CCC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB0358 [0,1,0,0,0,0|1,0,2]=4 137 B17R1.1143 NC(=O)CCC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB0358 [0,1,0,0,0,0|1,0,2]=4 138 B17R1.1143 NC(=O)CCC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB0358 [0,1,0,0,0,0|1,0,2]=4 139 B17R1.1143 NC(=O)CCC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB0358 [0,1,0,0,0,0|1,0,2]=4 140 B17R1.1143 NC(=O)CCC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB0358 [0,1,0,0,0,0|1,0,2]=4 141 B17R1.1143 NC(=O)CCC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB0358 [0,1,0,0,0,0|1,0,2]=4 142 B17R1.1143 NC(=O)NCC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB0746 [0,1,0,0,0,0|2,0,1]=4 143 B17R1.1143 NC(=O)NCC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB0746 [0,1,0,0,0,0|2,0,1]=4 144 B17R1.1143 NC(=O)NCC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB0746 [0,1,0,0,0,0|2,0,1]=4 145 B17R1.1143 NC(=O)NCC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB0746 [0,1,0,0,0,0|2,0,1]=4 146 B17R1.1143 NC(=O)NCC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB0746 [0,1,0,0,0,0|2,0,1]=4 147 B17R1.1143 NC(=O)NCC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB0746 [0,1,0,0,0,0|2,0,1]=4 148 B17R1.1143 NC(=O)NCC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB0746 [0,1,0,0,0,0|2,0,1]=4 149 B17R1.1143 NC(=O)NCC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB0746 [0,1,0,0,0,0|2,0,1]=4 150 B17R1.1143 O=C(O)C#CC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB1110 [0,1,0,0,0,0|0,0,2]=3 151 B17R1.1143 O=C(O)C#CC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB1110 [0,1,0,0,0,0|0,0,2]=3 152 B17R1.1143 O=C(O)C#CC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB1110 [0,1,0,0,0,0|0,0,2]=3 153 B17R1.1143 O=C(O)C#CC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB1110 [0,1,0,0,0,0|0,0,2]=3 154 B17R1.1143 O=C(O)C#CC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB1110 [0,1,0,0,0,0|0,0,2]=3 155 B17R1.1143 O=C(O)C#CC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB1110 [0,1,0,0,0,0|0,0,2]=3 156 B17R1.1143 O=C(O)C#CC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB1110 [0,1,0,0,0,0|0,0,2]=3 157 B17R1.1143 O=C(O)C#CC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB1110 [0,1,0,0,0,0|0,0,2]=3 158 B17R1.1327 CC(=O)CCC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0072 [0,1,0,0,0,0|1,0,2]=4 159 B17R1.1327 CC(=O)CCC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0072 [0,1,0,0,0,0|1,0,2]=4 160 B17R1.1327 CC(=O)CCC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0072 [0,1,0,0,0,0|1,0,2]=4 161 B17R1.1327 CC(=O)CCC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0072 [0,1,0,0,0,0|1,0,2]=4 162 B17R1.1327 CC(=O)CCC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0072 [0,1,0,0,0,0|1,0,2]=4 163 B17R1.1327 CC(=O)CCC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0072 [0,1,0,0,0,0|1,0,2]=4 164 B17R1.1327 CC(=O)NCC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0357 [0,1,0,0,0,0|2,0,1]=4 165 B17R1.1327 CC(=O)NCC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0357 [0,1,0,0,0,0|2,0,1]=4 166 B17R1.1327 CC(=O)NCC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0357 [0,1,0,0,0,0|2,0,1]=4 167 B17R1.1327 CC(=O)NCC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0357 [0,1,0,0,0,0|2,0,1]=4 168 B17R1.1327 CC(=O)NCC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0357 [0,1,0,0,0,0|2,0,1]=4 169 B17R1.1327 CC(=O)NCC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0357 [0,1,0,0,0,0|2,0,1]=4 170 B17R1.1327 CC(=O)OCC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB2824 [0,1,0,0,0,0|2,0,1]=4 171 B17R1.1327 CC(=O)OCC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB2824 [0,1,0,0,0,0|2,0,1]=4 172 B17R1.1327 CC(=O)OCC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB2824 [0,1,0,0,0,0|2,0,1]=4 173 B17R1.1327 CC(=O)OCC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB2824 [0,1,0,0,0,0|2,0,1]=4 174 B17R1.1327 CC(=O)OCC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB2824 [0,1,0,0,0,0|2,0,1]=4 175 B17R1.1327 CC(=O)OCC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB2824 [0,1,0,0,0,0|2,0,1]=4 176 B17R1.1327 CC(=O)SCC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB3992 [0,1,0,0,0,0|2,0,1]=4 177 B17R1.1327 CC(=O)SCC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB3992 [0,1,0,0,0,0|2,0,1]=4 178 B17R1.1327 CC(=O)SCC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB3992 [0,1,0,0,0,0|2,0,1]=4 179 B17R1.1327 CC(=O)SCC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB3992 [0,1,0,0,0,0|2,0,1]=4 180 B17R1.1327 CC(=O)SCC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB3992 [0,1,0,0,0,0|2,0,1]=4 181 B17R1.1327 CC(=O)SCC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB3992 [0,1,0,0,0,0|2,0,1]=4 182 B17R1.1327 CC(C)/C=C/C(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0036 [0,1,0,0,0,0|2,0,1]=4 183 B17R1.1327 CC(C)/C=C/C(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0036 [0,1,0,0,0,0|2,0,1]=4 184 B17R1.1327 CC(C)/C=C/C(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0036 [0,1,0,0,0,0|2,0,1]=4 185 B17R1.1327 CC(C)/C=C/C(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0036 [0,1,0,0,0,0|2,0,1]=4 186 B17R1.1327 CC(C)/C=C/C(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0036 [0,1,0,0,0,0|2,0,1]=4 187 B17R1.1327 CC(C)/C=C/C(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0036 [0,1,0,0,0,0|2,0,1]=4 188 B17R1.1327 CC(CNC(=O)C#CC(=O)O)c1ccccc1 WXVL_AK00546SB1110 [0,1,0,0,0,0|0,0,2]=3 189 B17R1.1327 CC(CNC(=O)C#CC(=O)O)c1ccccc1 WXVL_AK00546SB1110 [0,1,0,0,0,0|0,0,2]=3 190 B17R1.1327 CC(CNC(=O)CCC(=O)N)c1ccccc1 WXVL_AK00546SB0358 [0,1,0,0,0,0|1,0,2]=4 191 B17R1.1327 CC(CNC(=O)CCC(=O)N)c1ccccc1 WXVL_AK00546SB0358 [0,1,0,0,0,0|1,0,2]=4 192 B17R1.1327 CC(CNC(=O)CNC(=O)N)c1ccccc1 WXVL_AK00546SB0746 [0,1,0,0,0,0|2,0,1]=4 193 B17R1.1327 CC(CNC(=O)CNC(=O)N)c1ccccc1 WXVL_AK00546SB0746 [0,1,0,0,0,0|2,0,1]=4 194 B17R1.1327 C[C@H](CNC(=O)C#CC(=O)O)c1ccccc1 WXVL_AK00506SB1110 [0,1,0,0,0,0|0,0,2]=3 195 B17R1.1327 C[C@H](CNC(=O)C#CC(=O)O)c1ccccc1 WXVL_AK00506SB1110 [0,1,0,0,0,0|0,0,2]=3 196 B17R1.1327 C[C@H](CNC(=O)CCC(=O)N)c1ccccc1 WXVL_AK00506SB0358 [0,1,0,0,0,0|1,0,2]=4 197 B17R1.1327 C[C@H](CNC(=O)CCC(=O)N)c1ccccc1 WXVL_AK00506SB0358 [0,1,0,0,0,0|1,0,2]=4 198 B17R1.1327 C[C@H](CNC(=O)CNC(=O)N)c1ccccc1 WXVL_AK00506SB0746 [0,1,0,0,0,0|2,0,1]=4 199 B17R1.1327 C[C@H](CNC(=O)CNC(=O)N)c1ccccc1 WXVL_AK00506SB0746 [0,1,0,0,0,0|2,0,1]=4 200 B17R1.1327 NC(=O)CCC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0358 [0,1,0,0,0,0|1,0,2]=4 201 B17R1.1327 NC(=O)CCC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0358 [0,1,0,0,0,0|1,0,2]=4 202 B17R1.1327 NC(=O)NCC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0746 [0,1,0,0,0,0|2,0,1]=4 203 B17R1.1327 NC(=O)NCC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0746 [0,1,0,0,0,0|2,0,1]=4 204 B17R1.1327 O=C(O)C#CC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB1110 [0,1,0,0,0,0|0,0,2]=3 205 B17R1.1327 O=C(O)C#CC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB1110 [0,1,0,0,0,0|0,0,2]=3 206 B17R1.11270 CC(=O)CCC(=O)NCCc1ccccc1Br WXVL_AK0778SB0072 [0,1,0,0,0,0|1,0,2]=4 207 B17R1.11270 CC(=O)CCC(=O)NCCc1ccccc1Br WXVL_AK0778SB0072 [0,1,0,0,0,0|1,0,2]=4 208 B17R1.11270 CC(=O)CCC(=O)NCCc1ccccc1C WXVL_AK0254SB0072 [0,1,0,0,0,0|1,0,2]=4 209 B17R1.11270 CC(=O)CCC(=O)NCCc1ccccc1C WXVL_AK0254SB0072 [0,1,0,0,0,0|1,0,2]=4 210 B17R1.11270 CC(=O)CCC(=O)NCCc1ccccc1Cl WXVL_AK0715SB0072 [0,1,0,0,0,0|1,0,2]=4 211 B17R1.11270 CC(=O)CCC(=O)NCCc1ccccc1Cl WXVL_AK0715SB0072 [0,1,0,0,0,0|1,0,2]=4 212 B17R1.11270 CC(=O)CCC(=O)NCCc1ccccc1F WXVL_AK0118SB0072 [0,1,0,0,0,0|1,0,2]=4 213 B17R1.11270 CC(=O)CCC(=O)NCCc1ccccc1F WXVL_AK0118SB0072 [0,1,0,0,0,0|1,0,2]=4 214 B17R1.11270 CC(=O)CCC(=O)NCCc1ccccc1O WXVL_AK2884SB0072 [0,1,0,0,0,0|1,0,2]=4 215 B17R1.11270 CC(=O)CCC(=O)NCCc1ccccc1O WXVL_AK2884SB0072 [0,1,0,0,0,0|1,0,2]=4 216 B17R1.11270 CC(=O)NCC(=O)NCCc1ccccc1Br WXVL_AK0778SB0357 [0,1,0,0,0,0|2,0,1]=4 217 B17R1.11270 CC(=O)NCC(=O)NCCc1ccccc1Br WXVL_AK0778SB0357 [0,1,0,0,0,0|2,0,1]=4 218 B17R1.11270 CC(=O)NCC(=O)NCCc1ccccc1C WXVL_AK0254SB0357 [0,1,0,0,0,0|2,0,1]=4 219 B17R1.11270 CC(=O)NCC(=O)NCCc1ccccc1C WXVL_AK0254SB0357 [0,1,0,0,0,0|2,0,1]=4 220 B17R1.11270 CC(=O)NCC(=O)NCCc1ccccc1Cl WXVL_AK0715SB0357 [0,1,0,0,0,0|2,0,1]=4 221 B17R1.11270 CC(=O)NCC(=O)NCCc1ccccc1Cl WXVL_AK0715SB0357 [0,1,0,0,0,0|2,0,1]=4 222 B17R1.11270 CC(=O)NCC(=O)NCCc1ccccc1F WXVL_AK0118SB0357 [0,1,0,0,0,0|2,0,1]=4 223 B17R1.11270 CC(=O)NCC(=O)NCCc1ccccc1F WXVL_AK0118SB0357 [0,1,0,0,0,0|2,0,1]=4 224 B17R1.11270 CC(=O)NCC(=O)NCCc1ccccc1O WXVL_AK2884SB0357 [0,1,0,0,0,0|2,0,1]=4 225 B17R1.11270 CC(=O)NCC(=O)NCCc1ccccc1O WXVL_AK2884SB0357 [0,1,0,0,0,0|2,0,1]=4 226 B17R1.11270 CC(=O)OCC(=O)NCCc1ccccc1Br WXVL_AK0778SB2824 [0,1,0,0,0,0|2,0,1]=4 227 B17R1.11270 CC(=O)OCC(=O)NCCc1ccccc1Br WXVL_AK0778SB2824 [0,1,0,0,0,0|2,0,1]=4 228 B17R1.11270 CC(=O)OCC(=O)NCCc1ccccc1C WXVL_AK0254SB2824 [0,1,0,0,0,0|2,0,1]=4 229 B17R1.11270 CC(=O)OCC(=O)NCCc1ccccc1C WXVL_AK0254SB2824 [0,1,0,0,0,0|2,0,1]=4 230 B17R1.11270 CC(=O)OCC(=O)NCCc1ccccc1Cl WXVL_AK0715SB2824 [0,1,0,0,0,0|2,0,1]=4 231 B17R1.11270 CC(=O)OCC(=O)NCCc1ccccc1Cl WXVL_AK0715SB2824 [0,1,0,0,0,0|2,0,1]=4 232 B17R1.11270 CC(=O)OCC(=O)NCCc1ccccc1F WXVL_AK0118SB2824 [0,1,0,0,0,0|2,0,1]=4 233 B17R1.11270 CC(=O)OCC(=O)NCCc1ccccc1F WXVL_AK0118SB2824 [0,1,0,0,0,0|2,0,1]=4 234 B17R1.11270 CC(=O)OCC(=O)NCCc1ccccc1O WXVL_AK2884SB2824 [0,1,0,0,0,0|2,0,1]=4 235 B17R1.11270 CC(=O)OCC(=O)NCCc1ccccc1O WXVL_AK2884SB2824 [0,1,0,0,0,0|2,0,1]=4 236 B17R1.11270 CC(=O)SCC(=O)NCCc1ccccc1Br WXVL_AK0778SB3992 [0,1,0,0,0,0|2,0,1]=4 237 B17R1.11270 CC(=O)SCC(=O)NCCc1ccccc1Br WXVL_AK0778SB3992 [0,1,0,0,0,0|2,0,1]=4 238 B17R1.11270 CC(=O)SCC(=O)NCCc1ccccc1C WXVL_AK0254SB3992 [0,1,0,0,0,0|2,0,1]=4 239 B17R1.11270 CC(=O)SCC(=O)NCCc1ccccc1C WXVL_AK0254SB3992 [0,1,0,0,0,0|2,0,1]=4 240 B17R1.11270 CC(=O)SCC(=O)NCCc1ccccc1Cl WXVL_AK0715SB3992 [0,1,0,0,0,0|2,0,1]=4 241 B17R1.11270 CC(=O)SCC(=O)NCCc1ccccc1Cl WXVL_AK0715SB3992 [0,1,0,0,0,0|2,0,1]=4 242 B17R1.11270 CC(=O)SCC(=O)NCCc1ccccc1F WXVL_AK0118SB3992 [0,1,0,0,0,0|2,0,1]=4 243 B17R1.11270 CC(=O)SCC(=O)NCCc1ccccc1F WXVL_AK0118SB3992 [0,1,0,0,0,0|2,0,1]=4 244 B17R1.11270 CC(=O)SCC(=O)NCCc1ccccc1O WXVL_AK2884SB3992 [0,1,0,0,0,0|2,0,1]=4 245 B17R1.11270 CC(=O)SCC(=O)NCCc1ccccc1O WXVL_AK2884SB3992 [0,1,0,0,0,0|2,0,1]=4 246 B17R1.11270 CC(C)/C=C/C(=O)NCCc1ccccc1Br WXVL_AK0778SB0036 [0,1,0,0,0,0|2,0,1]=4 247 B17R1.11270 CC(C)/C=C/C(=O)NCCc1ccccc1Br WXVL_AK0778SB0036 [0,1,0,0,0,0|2,0,1]=4 248 B17R1.11270 CC(C)/C=C/C(=O)NCCc1ccccc1Cl WXVL_AK0715SB0036 [0,1,0,0,0,0|2,0,1]=4 249 B17R1.11270 CC(C)/C=C/C(=O)NCCc1ccccc1Cl WXVL_AK0715SB0036 [0,1,0,0,0,0|2,0,1]=4 250 B17R1.11270 CC(C)/C=C/C(=O)NCCc1ccccc1F WXVL_AK0118SB0036 [0,1,0,0,0,0|2,0,1]=4 251 B17R1.11270 CC(C)/C=C/C(=O)NCCc1ccccc1F WXVL_AK0118SB0036 [0,1,0,0,0,0|2,0,1]=4 252 B17R1.11270 CC(C)/C=C/C(=O)NCCc1ccccc1O WXVL_AK2884SB0036 [0,1,0,0,0,0|2,0,1]=4 253 B17R1.11270 CC(C)/C=C/C(=O)NCCc1ccccc1O WXVL_AK2884SB0036 [0,1,0,0,0,0|2,0,1]=4 254 B17R1.11270 Cc1ccccc1CCNC(=O)/C=C/C(C)C WXVL_AK0254SB0036 [0,1,0,0,0,0|2,0,1]=4 255 B17R1.11270 Cc1ccccc1CCNC(=O)/C=C/C(C)C WXVL_AK0254SB0036 [0,1,0,0,0,0|2,0,1]=4 256 B17R1.11270 Cc1ccccc1CCNC(=O)C#CC(=O)O WXVL_AK0254SB1110 [0,1,0,0,0,0|0,0,2]=3 257 B17R1.11270 Cc1ccccc1CCNC(=O)C#CC(=O)O WXVL_AK0254SB1110 [0,1,0,0,0,0|0,0,2]=3 258 B17R1.11270 Cc1ccccc1CCNC(=O)CCC(=O)N WXVL_AK0254SB0358 [0,1,0,0,0,0|1,0,2]=4 259 B17R1.11270 Cc1ccccc1CCNC(=O)CCC(=O)N WXVL_AK0254SB0358 [0,1,0,0,0,0|1,0,2]=4 260 B17R1.11270 Cc1ccccc1CCNC(=O)CNC(=O)N WXVL_AK0254SB0746 [0,1,0,0,0,0|2,0,1]=4 261 B17R1.11270 Cc1ccccc1CCNC(=O)CNC(=O)N WXVL_AK0254SB0746 [0,1,0,0,0,0|2,0,1]=4 262 B17R1.11270 NC(=O)CCC(=O)NCCc1ccccc1Br WXVL_AK0778SB0358 [0,1,0,0,0,0|1,0,2]=4 263 B17R1.11270 NC(=O)CCC(=O)NCCc1ccccc1Br WXVL_AK0778SB0358 [0,1,0,0,0,0|1,0,2]=4 264 B17R1.11270 NC(=O)CCC(=O)NCCc1ccccc1Cl WXVL_AK0715SB0358 [0,1,0,0,0,0|1,0,2]=4 265 B17R1.11270 NC(=O)CCC(=O)NCCc1ccccc1Cl WXVL_AK0715SB0358 [0,1,0,0,0,0|1,0,2]=4 266 B17R1.11270 NC(=O)CCC(=O)NCCc1ccccc1F WXVL_AK0118SB0358 [0,1,0,0,0,0|1,0,2]=4 267 B17R1.11270 NC(=O)CCC(=O)NCCc1ccccc1F WXVL_AK0118SB0358 [0,1,0,0,0,0|1,0,2]=4 268 B17R1.11270 NC(=O)CCC(=O)NCCc1ccccc1O WXVL_AK2884SB0358 [0,1,0,0,0,0|1,0,2]=4 269 B17R1.11270 NC(=O)CCC(=O)NCCc1ccccc1O WXVL_AK2884SB0358 [0,1,0,0,0,0|1,0,2]=4 270 B17R1.11270 NC(=O)NCC(=O)NCCc1ccccc1Br WXVL_AK0778SB0746 [0,1,0,0,0,0|2,0,1]=4 271 B17R1.11270 NC(=O)NCC(=O)NCCc1ccccc1Br WXVL_AK0778SB0746 [0,1,0,0,0,0|2,0,1]=4 272 B17R1.11270 NC(=O)NCC(=O)NCCc1ccccc1Cl WXVL_AK0715SB0746 [0,1,0,0,0,0|2,0,1]=4 273 B17R1.11270 NC(=O)NCC(=O)NCCc1ccccc1Cl WXVL_AK0715SB0746 [0,1,0,0,0,0|2,0,1]=4 274 B17R1.11270 NC(=O)NCC(=O)NCCc1ccccc1F WXVL_AK0118SB0746 [0,1,0,0,0,0|2,0,1]=4 275 B17R1.11270 NC(=O)NCC(=O)NCCc1ccccc1F WXVL_AK0118SB0746 [0,1,0,0,0,0|2,0,1]=4 276 B17R1.11270 NC(=O)NCC(=O)NCCc1ccccc1O WXVL_AK2884SB0746 [0,1,0,0,0,0|2,0,1]=4 277 B17R1.11270 NC(=O)NCC(=O)NCCc1ccccc1O WXVL_AK2884SB0746 [0,1,0,0,0,0|2,0,1]=4 278 B17R1.11270 O=C(O)C#CC(=O)NCCc1ccccc1Br WXVL_AK0778SB1110 [0,1,0,0,0,0|0,0,2]=3 279 B17R1.11270 O=C(O)C#CC(=O)NCCc1ccccc1Br WXVL_AK0778SB1110 [0,1,0,0,0,0|0,0,2]=3 280 B17R1.11270 O=C(O)C#CC(=O)NCCc1ccccc1Cl WXVL_AK0715SB1110 [0,1,0,0,0,0|0,0,2]=3 281 B17R1.11270 O=C(O)C#CC(=O)NCCc1ccccc1Cl WXVL_AK0715SB1110 [0,1,0,0,0,0|0,0,2]=3 282 B17R1.11270 O=C(O)C#CC(=O)NCCc1ccccc1F WXVL_AK0118SB1110 [0,1,0,0,0,0|0,0,2]=3 283 B17R1.11270 O=C(O)C#CC(=O)NCCc1ccccc1F WXVL_AK0118SB1110 [0,1,0,0,0,0|0,0,2]=3 284 B17R1.11270 O=C(O)C#CC(=O)NCCc1ccccc1O WXVL_AK2884SB1110 [0,1,0,0,0,0|0,0,2]=3 285 B17R1.11270 O=C(O)C#CC(=O)NCCc1ccccc1O WXVL_AK2884SB1110 [0,1,0,0,0,0|0,0,2]=3 286 B17R1.14436 CC(=O)CCC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB0072 [0,1,0,0,0,0|1,0,2]=4 287 B17R1.14436 CC(=O)CCC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB0072 [0,1,0,0,0,0|1,0,2]=4 288 B17R1.14436 CC(=O)CCC(=O)NCCc1cccc(c1)C WXVL_AK8219SB0072 [0,1,0,0,0,0|1,0,2]=4 289 B17R1.14436 CC(=O)CCC(=O)NCCc1cccc(c1)C WXVL_AK8219SB0072 [0,1,0,0,0,0|1,0,2]=4 290 B17R1.14436 CC(=O)CCC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB0072 [0,1,0,0,0,0|1,0,2]=4 291 B17R1.14436 CC(=O)CCC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB0072 [0,1,0,0,0,0|1,0,2]=4 292 B17R1.14436 CC(=O)CCC(=O)NCCc1cccc(c1)F WXVL_AK0117SB0072 [0,1,0,0,0,0|1,0,2]=4 293 B17R1.14436 CC(=O)CCC(=O)NCCc1cccc(c1)F WXVL_AK0117SB0072 [0,1,0,0,0,0|1,0,2]=4 294 B17R1.14436 CC(=O)CCC(=O)NCCc1cccc(c1)O WXVL_AK00421SB0072 [0,1,0,0,0,0|1,0,2]=4 295 B17R1.14436 CC(=O)CCC(=O)NCCc1cccc(c1)O WXVL_AK00421SB0072 [0,1,0,0,0,0|1,0,2]=4 296 B17R1.14436 CC(=O)NCC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB0357 [0,1,0,0,0,0|2,0,1]=4 297 B17R1.14436 CC(=O)NCC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB0357 [0,1,0,0,0,0|2,0,1]=4 298 B17R1.14436 CC(=O)NCC(=O)NCCc1cccc(c1)C WXVL_AK8219SB0357 [0,1,0,0,0,0|2,0,1]=4 299 B17R1.14436 CC(=O)NCC(=O)NCCc1cccc(c1)C WXVL_AK8219SB0357 [0,1,0,0,0,0|2,0,1]=4 300 B17R1.14436 CC(=O)NCC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB0357 [0,1,0,0,0,0|2,0,1]=4 301 B17R1.14436 CC(=O)NCC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB0357 [0,1,0,0,0,0|2,0,1]=4 302 B17R1.14436 CC(=O)NCC(=O)NCCc1cccc(c1)F WXVL_AK0117SB0357 [0,1,0,0,0,0|2,0,1]=4 303 B17R1.14436 CC(=O)NCC(=O)NCCc1cccc(c1)F WXVL_AK0117SB0357 [0,1,0,0,0,0|2,0,1]=4 304 B17R1.14436 CC(=O)NCC(=O)NCCc1cccc(c1)O WXVL_AK00421SB0357 [0,1,0,0,0,0|2,0,1]=4 305 B17R1.14436 CC(=O)NCC(=O)NCCc1cccc(c1)O WXVL_AK00421SB0357 [0,1,0,0,0,0|2,0,1]=4 306 B17R1.14436 CC(=O)OCC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB2824 [0,1,0,0,0,0|2,0,1]=4 307 B17R1.14436 CC(=O)OCC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB2824 [0,1,0,0,0,0|2,0,1]=4 308 B17R1.14436 CC(=O)OCC(=O)NCCc1cccc(c1)C WXVL_AK8219SB2824 [0,1,0,0,0,0|2,0,1]=4 309 B17R1.14436 CC(=O)OCC(=O)NCCc1cccc(c1)C WXVL_AK8219SB2824 [0,1,0,0,0,0|2,0,1]=4 310 B17R1.14436 CC(=O)OCC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB2824 [0,1,0,0,0,0|2,0,1]=4 311 B17R1.14436 CC(=O)OCC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB2824 [0,1,0,0,0,0|2,0,1]=4 312 B17R1.14436 CC(=O)OCC(=O)NCCc1cccc(c1)F WXVL_AK0117SB2824 [0,1,0,0,0,0|2,0,1]=4 313 B17R1.14436 CC(=O)OCC(=O)NCCc1cccc(c1)F WXVL_AK0117SB2824 [0,1,0,0,0,0|2,0,1]=4 314 B17R1.14436 CC(=O)OCC(=O)NCCc1cccc(c1)O WXVL_AK00421SB2824 [0,1,0,0,0,0|2,0,1]=4 315 B17R1.14436 CC(=O)OCC(=O)NCCc1cccc(c1)O WXVL_AK00421SB2824 [0,1,0,0,0,0|2,0,1]=4 316 B17R1.14436 CC(=O)SCC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB3992 [0,1,0,0,0,0|2,0,1]=4 317 B17R1.14436 CC(=O)SCC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB3992 [0,1,0,0,0,0|2,0,1]=4 318 B17R1.14436 CC(=O)SCC(=O)NCCc1cccc(c1)C WXVL_AK8219SB3992 [0,1,0,0,0,0|2,0,1]=4 319 B17R1.14436 CC(=O)SCC(=O)NCCc1cccc(c1)C WXVL_AK8219SB3992 [0,1,0,0,0,0|2,0,1]=4 320 B17R1.14436 CC(=O)SCC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB3992 [0,1,0,0,0,0|2,0,1]=4 321 B17R1.14436 CC(=O)SCC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB3992 [0,1,0,0,0,0|2,0,1]=4 322 B17R1.14436 CC(=O)SCC(=O)NCCc1cccc(c1)F WXVL_AK0117SB3992 [0,1,0,0,0,0|2,0,1]=4 323 B17R1.14436 CC(=O)SCC(=O)NCCc1cccc(c1)F WXVL_AK0117SB3992 [0,1,0,0,0,0|2,0,1]=4 324 B17R1.14436 CC(=O)SCC(=O)NCCc1cccc(c1)O WXVL_AK00421SB3992 [0,1,0,0,0,0|2,0,1]=4 325 B17R1.14436 CC(=O)SCC(=O)NCCc1cccc(c1)O WXVL_AK00421SB3992 [0,1,0,0,0,0|2,0,1]=4 326 B17R1.14436 CC(C)/C=C/C(=O)NCCc1cccc(c1)Br WXVL_AK0800SB0036 [0,1,0,0,0,0|2,0,1]=4 327 B17R1.14436 CC(C)/C=C/C(=O)NCCc1cccc(c1)Br WXVL_AK0800SB0036 [0,1,0,0,0,0|2,0,1]=4 328 B17R1.14436 CC(C)/C=C/C(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB0036 [0,1,0,0,0,0|2,0,1]=4 329 B17R1.14436 CC(C)/C=C/C(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB0036 [0,1,0,0,0,0|2,0,1]=4 330 B17R1.14436 CC(C)/C=C/C(=O)NCCc1cccc(c1)F WXVL_AK0117SB0036 [0,1,0,0,0,0|2,0,1]=4 331 B17R1.14436 CC(C)/C=C/C(=O)NCCc1cccc(c1)F WXVL_AK0117SB0036 [0,1,0,0,0,0|2,0,1]=4 332 B17R1.14436 CC(C)/C=C/C(=O)NCCc1cccc(c1)O WXVL_AK00421SB0036 [0,1,0,0,0,0|2,0,1]=4 333 B17R1.14436 CC(C)/C=C/C(=O)NCCc1cccc(c1)O WXVL_AK00421SB0036 [0,1,0,0,0,0|2,0,1]=4 334 B17R1.14436 Cc1cccc(c1)CCNC(=O)/C=C/C(C)C WXVL_AK8219SB0036 [0,1,0,0,0,0|2,0,1]=4 335 B17R1.14436 Cc1cccc(c1)CCNC(=O)/C=C/C(C)C WXVL_AK8219SB0036 [0,1,0,0,0,0|2,0,1]=4 336 B17R1.14436 Cc1cccc(c1)CCNC(=O)C#CC(=O)O WXVL_AK8219SB1110 [0,1,0,0,0,0|0,0,2]=3 337 B17R1.14436 Cc1cccc(c1)CCNC(=O)C#CC(=O)O WXVL_AK8219SB1110 [0,1,0,0,0,0|0,0,2]=3 338 B17R1.14436 Cc1cccc(c1)CCNC(=O)CCC(=O)N WXVL_AK8219SB0358 [0,1,0,0,0,0|1,0,2]=4 339 B17R1.14436 Cc1cccc(c1)CCNC(=O)CCC(=O)N WXVL_AK8219SB0358 [0,1,0,0,0,0|1,0,2]=4 340 B17R1.14436 Cc1cccc(c1)CCNC(=O)CNC(=O)N WXVL_AK8219SB0746 [0,1,0,0,0,0|2,0,1]=4 341 B17R1.14436 Cc1cccc(c1)CCNC(=O)CNC(=O)N WXVL_AK8219SB0746 [0,1,0,0,0,0|2,0,1]=4 342 B17R1.14436 NC(=O)CCC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB0358 [0,1,0,0,0,0|1,0,2]=4 343 B17R1.14436 NC(=O)CCC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB0358 [0,1,0,0,0,0|1,0,2]=4 344 B17R1.14436 NC(=O)CCC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB0358 [0,1,0,0,0,0|1,0,2]=4 345 B17R1.14436 NC(=O)CCC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB0358 [0,1,0,0,0,0|1,0,2]=4 346 B17R1.14436 NC(=O)CCC(=O)NCCc1cccc(c1)F WXVL_AK0117SB0358 [0,1,0,0,0,0|1,0,2]=4 347 B17R1.14436 NC(=O)CCC(=O)NCCc1cccc(c1)F WXVL_AK0117SB0358 [0,1,0,0,0,0|1,0,2]=4 348 B17R1.14436 NC(=O)CCC(=O)NCCc1cccc(c1)O WXVL_AK00421SB0358 [0,1,0,0,0,0|1,0,2]=4 349 B17R1.14436 NC(=O)CCC(=O)NCCc1cccc(c1)O WXVL_AK00421SB0358 [0,1,0,0,0,0|1,0,2]=4 350 B17R1.14436 NC(=O)NCC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB0746 [0,1,0,0,0,0|2,0,1]=4 351 B17R1.14436 NC(=O)NCC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB0746 [0,1,0,0,0,0|2,0,1]=4 352 B17R1.14436 NC(=O)NCC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB0746 [0,1,0,0,0,0|2,0,1]=4 353 B17R1.14436 NC(=O)NCC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB0746 [0,1,0,0,0,0|2,0,1]=4 354 B17R1.14436 NC(=O)NCC(=O)NCCc1cccc(c1)F WXVL_AK0117SB0746 [0,1,0,0,0,0|2,0,1]=4 355 B17R1.14436 NC(=O)NCC(=O)NCCc1cccc(c1)F WXVL_AK0117SB0746 [0,1,0,0,0,0|2,0,1]=4 356 B17R1.14436 NC(=O)NCC(=O)NCCc1cccc(c1)O WXVL_AK00421SB0746 [0,1,0,0,0,0|2,0,1]=4 357 B17R1.14436 NC(=O)NCC(=O)NCCc1cccc(c1)O WXVL_AK00421SB0746 [0,1,0,0,0,0|2,0,1]=4 358 B17R1.14436 O=C(O)C#CC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB1110 [0,1,0,0,0,0|0,0,2]=3 359 B17R1.14436 O=C(O)C#CC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB1110 [0,1,0,0,0,0|0,0,2]=3 360 B17R1.14436 O=C(O)C#CC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB1110 [0,1,0,0,0,0|0,0,2]=3 361 B17R1.14436 O=C(O)C#CC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB1110 [0,1,0,0,0,0|0,0,2]=3 362 B17R1.14436 O=C(O)C#CC(=O)NCCc1cccc(c1)F WXVL_AK0117SB1110 [0,1,0,0,0,0|0,0,2]=3 363 B17R1.14436 O=C(O)C#CC(=O)NCCc1cccc(c1)F WXVL_AK0117SB1110 [0,1,0,0,0,0|0,0,2]=3 364 B17R1.14436 O=C(O)C#CC(=O)NCCc1cccc(c1)O WXVL_AK00421SB1110 [0,1,0,0,0,0|0,0,2]=3 365 B17R1.14436 O=C(O)C#CC(=O)NCCc1cccc(c1)O WXVL_AK00421SB1110 [0,1,0,0,0,0|0,0,2]=3 366 B17R1.16303 C/C(=C/C(=O)NCCc1ccccc1)/C(=O)O WXVL_AK00498SB2187 [0,1,0,0,0,0|0,0,0]=1 367 B17R1.16303 C/C(=C/C(=O)NCCc1ccccc1)/C(=O)O WXVL_AK00498SB2187 [0,1,0,0,0,0|0,0,0]=1 368 B17R1.16303 C/C(=C/C(=O)NCCc1ccccn1)/C(=O)O WXVL_AK0019SB2187 [0,1,0,0,0,0|1,0,0]=2 369 B17R1.16303 C/C(=C/C(=O)NCCc1ccccn1)/C(=O)O WXVL_AK0019SB2187 [0,1,0,0,0,0|1,0,0]=2 370 B17R1.16303 C/C(=C/C(=O)NCCc1cccnc1)/C(=O)O WXVL_AK00436SB2187 [0,1,0,0,0,0|1,0,0]=2 371 B17R1.16303 C/C(=C/C(=O)NCCc1cccnc1)/C(=O)O WXVL_AK00436SB2187 [0,1,0,0,0,0|1,0,0]=2 372 B17R1.16303 C/C(=C/C(=O)NCCc1ccncc1)/C(=O)O WXVL_AK0093SB2187 [0,1,0,0,0,0|1,0,0]=2 373 B17R1.16303 C/C(=C/C(=O)NCCc1ccncc1)/C(=O)O WXVL_AK0093SB2187 [0,1,0,0,0,0|1,0,0]=2 374 B17R1.16303 C/C(=C/C(=O)NCCc1ccncn1)/C(=O)O WXVL_AK6509SB2187 [0,1,0,0,0,0|2,0,0]=3 375 B17R1.16303 C/C(=C/C(=O)NCCc1ccncn1)/C(=O)O WXVL_AK6509SB2187 [0,1,0,0,0,0|2,0,0]=3 376 B17R1.16318 CC(=O)NC(C)C(=O)NCCc1ccccc1 WXVL_AK00498SB0373 [0,1,0,0,0,0|2,0,1]=4 377 B17R1.16318 CC(=O)NC(C)C(=O)NCCc1ccccc1 WXVL_AK00498SB0373 [0,1,0,0,0,0|2,0,1]=4 378 B17R1.26833 C=CC(=O)NCC(=O)NCCc1ccccc1 WXVL_AK00498SB9931 [0,1,0,0,0,0|2,0,1]=4 379 B17R1.26833 C=CC(=O)NCC(=O)NCCc1ccccc1 WXVL_AK00498SB9931 [0,1,0,0,0,0|2,0,1]=4 380 B17R1.26833 COC(=O)CCC(=O)NCCc1ccccc1 WXVL_AK00498SB0069 [0,1,0,0,0,0|0,0,2]=3 381 B17R1.26833 COC(=O)CCC(=O)NCCc1ccccc1 WXVL_AK00498SB0069 [0,1,0,0,0,0|0,0,2]=3 382 B17R1.26833 COC(=O)CCC(=O)NCCc1ccccn1 WXVL_AK0019SB0069 [0,1,0,0,0,0|1,0,2]=4 383 B17R1.26833 COC(=O)CCC(=O)NCCc1ccccn1 WXVL_AK0019SB0069 [0,1,0,0,0,0|1,0,2]=4 384 B17R1.26833 COC(=O)CCC(=O)NCCc1cccnc1 WXVL_AK00436SB0069 [0,1,0,0,0,0|1,0,2]=4 385 B17R1.26833 COC(=O)CCC(=O)NCCc1cccnc1 WXVL_AK00436SB0069 [0,1,0,0,0,0|1,0,2]=4 386 B17R1.26833 COC(=O)CCC(=O)NCCc1ccncc1 WXVL_AK0093SB0069 [0,1,0,0,0,0|1,0,2]=4 387 B17R1.26833 COC(=O)CCC(=O)NCCc1ccncc1 WXVL_AK0093SB0069 [0,1,0,0,0,0|1,0,2]=4 388 B17R2.5242 O=C1CC(N1)C(=O)NCCc2ccccc2 WXVL_AK00498SB3574 [0,0,0,1,0,0|1,0,2]=4 389 B17R2.5242 O=C1CC(N1)C(=O)NCCc2ccccc2 WXVL_AK00498SB3574 [0,0,0,1,0,0|1,0,2]=4 390 B17R2.294966 O=C(C=CC1CC1)NCCc2ccccc2 WXVL_AK00498SB4216 [0,0,0,1,0,0|2,0,1]=4 391 B17R2.294966 O=C(C=CC1CC1)NCCc2ccccc2 WXVL_AK00498SB4216 [0,0,0,1,0,0|2,0,1]=4 392 B15R1.5919 CC(=O)CCC(=O)NCc1ccccc1 WXVL_AK00502SB0072 [0,0,0,0,1,0|1,0,2]=4 393 B15R1.5919 CC(=O)CCC(=O)NCc1ccccc1 WXVL_AK00502SB0072 [0,0,0,0,1,0|1,0,2]=4 394 B15R1.5919 CC(=O)NCC(=O)NCc1ccccc1 WXVL_AK00502SB0357 [0,0,0,0,1,0|2,0,1]=4 395 B15R1.5919 CC(=O)NCC(=O)NCc1ccccc1 WXVL_AK00502SB0357 [0,0,0,0,1,0|2,0,1]=4 396 B15R1.5919 CC(=O)OCC(=O)NCc1ccccc1 WXVL_AK00502SB2824 [0,0,0,0,1,0|2,0,1]=4 397 B15R1.5919 CC(=O)OCC(=O)NCc1ccccc1 WXVL_AK00502SB2824 [0,0,0,0,1,0|2,0,1]=4 398 B15R1.5919 CC(=O)SCC(=O)NCc1ccccc1 WXVL_AK00502SB3992 [0,0,0,0,1,0|2,0,1]=4 399 B15R1.5919 CC(=O)SCC(=O)NCc1ccccc1 WXVL_AK00502SB3992 [0,0,0,0,1,0|2,0,1]=4 400 B15R1.5919 CC(C)/C=C/C(=O)NCc1ccccc1 WXVL_AK00502SB0036 [0,0,0,0,1,0|2,0,1]=4 401 B15R1.5919 CC(C)/C=C/C(=O)NCc1ccccc1 WXVL_AK00502SB0036 [0,0,0,0,1,0|2,0,1]=4 402 B15R1.5919 NC(=O)/C=C\C(=O)NCc1ccccc1 WXVL_AK0084SB3786 [0,0,0,0,1,0|1,0,0]=2 403 B15R1.5919 NC(=O)/C=C\C(=O)NCc1ccccc1 WXVL_AK0084SB3786 [0,0,0,0,1,0|1,0,0]=2 404 B15R1.5919 NC(=O)CCC(=O)NCc1ccccc1 WXVL_AK00502SB0358 [0,0,0,0,1,0|1,0,2]=4 405 B15R1.5919 NC(=O)CCC(=O)NCc1ccccc1 WXVL_AK00502SB0358 [0,0,0,0,1,0|1,0,2]=4 406 B15R1.5919 NC(=O)CNC(=O)CCc1ccccc1 WXVL_AK0147SB0067 [0,0,0,0,1,0|2,0,1]=4 407 B15R1.5919 NC(=O)CNC(=O)CCc1ccccc1 WXVL_AK0147SB0067 [0,0,0,0,1,0|2,0,1]=4 408 B15R1.5919 NC(=O)NCC(=O)NCc1ccccc1 WXVL_AK00502SB0746 [0,0,0,0,1,0|2,0,1]=4 409 B15R1.5919 NC(=O)NCC(=O)NCc1ccccc1 WXVL_AK00502SB0746 [0,0,0,0,1,0|2,0,1]=4 410 B15R1.5919 O=C(O)C#CC(=O)NCc1ccccc1 WXVL_AK00502SB1110 [0,0,0,0,1,0|0,0,2]=3 411 B15R1.5919 O=C(O)C#CC(=O)NCc1ccccc1 WXVL_AK00502SB1110 [0,0,0,0,1,0|0,0,2]=3 412 B15R1.5919 O=C(O)C#CC(=O)NCc1ccccn1 WXVL_AK0018SB1110 [0,0,0,0,1,0|1,0,2]=4 413 B15R1.5919 O=C(O)C#CC(=O)NCc1ccccn1 WXVL_AK0018SB1110 [0,0,0,0,1,0|1,0,2]=4 414 B15R1.5919 O=C(O)C#CC(=O)NCc1cccnc1 WXVL_AK0020SB1110 [0,0,0,0,1,0|1,0,2]=4 415 B15R1.5919 O=C(O)C#CC(=O)NCc1cccnc1 WXVL_AK0020SB1110 [0,0,0,0,1,0|1,0,2]=4 416 B15R1.5919 O=C(O)C#CC(=O)NCc1ccncc1 WXVL_AK0021SB1110 [0,0,0,0,1,0|1,0,2]=4 417 B15R1.5919 O=C(O)C#CC(=O)NCc1ccncc1 WXVL_AK0021SB1110 [0,0,0,0,1,0|1,0,2]=4 418 B15R1.9084 CC(=CC(=O)NCCc1ccccc1)C WXVL_AK00498SB0342 [0,0,0,0,1,0|2,0,0]=3 419 B15R1.9084 CC(=CC(=O)NCCc1ccccc1)C WXVL_AK00498SB0342 [0,0,0,0,1,0|2,0,0]=3 420 B15R1.9084 CC(=CC(=O)NCCc1ccccn1)C WXVL_AK0019SB0342 [0,0,0,0,1,0|3,0,0]=4 421 B15R1.9084 CC(=CC(=O)NCCc1ccccn1)C WXVL_AK0019SB0342 [0,0,0,0,1,0|3,0,0]=4 422 B15R1.9084 CC(=CC(=O)NCCc1cccnc1)C WXVL_AK00436SB0342 [0,0,0,0,1,0|3,0,0]=4 423 B15R1.9084 CC(=CC(=O)NCCc1cccnc1)C WXVL_AK00436SB0342 [0,0,0,0,1,0|3,0,0]=4 424 B15R1.9084 CC(=CC(=O)NCCc1ccncc1)C WXVL_AK0093SB0342 [0,0,0,0,1,0|3,0,0]=4 425 B15R1.9084 CC(=CC(=O)NCCc1ccncc1)C WXVL_AK0093SB0342 [0,0,0,0,1,0|3,0,0]=4 426 B15R1.9084 CC(O)CC(=O)NCCc1ccccc1 WXVL_AK00498SB3643 [0,0,0,0,1,0|1,0,2]=4 427 B15R1.9084 CC(O)CC(=O)NCCc1ccccc1 WXVL_AK00498SB3643 [0,0,0,0,1,0|1,0,2]=4 428 B15R1.12292 O=C(O)C#CC(=O)NCCc1ccco1 WXVL_AK0989SB1110 [0,0,0,0,1,0|1,0,2]=4 429 B15R1.12292 O=C(O)C#CC(=O)NCCc1ccco1 WXVL_AK0989SB1110 [0,0,0,0,1,0|1,0,2]=4 430 B15R1.12292 O=C(O)C#CC(=O)NCCc1cccs1 WXVL_AK0098SB1110 [0,0,0,0,1,0|1,0,2]=4 431 B15R1.12292 O=C(O)C#CC(=O)NCCc1cccs1 WXVL_AK0098SB1110 [0,0,0,0,1,0|1,0,2]=4 432 B15R1.12292 O=C(O)C#CC(=O)NCCc1ccsc1 WXVL_AK1342SB1110 [0,0,0,0,1,0|1,0,2]=4 433 B15R1.12292 O=C(O)C#CC(=O)NCCc1ccsc1 WXVL_AK1342SB1110 [0,0,0,0,1,0|1,0,2]=4 434 B15R1.12292 O=C(O)C#CC(=O)NCCn1cccc1 WXVL_AK1188SB1110 [0,0,0,0,1,0|1,0,2]=4 435 B15R1.12292 O=C(O)C#CC(=O)NCCn1cccc1 WXVL_AK1188SB1110 [0,0,0,0,1,0|1,0,2]=4 436 B17R1.4992 CC(=O)CCC(=O)NCCCc1ccccc1 WXVL_AK0074SB0072 [0,0,0,0,0,1|1,0,2]=4 437 B17R1.4992 CC(=O)CCC(=O)NCCCc1ccccc1 WXVL_AK0074SB0072 [0,0,0,0,0,1|1,0,2]=4 438 B17R1.4992 CC(=O)CCC(=O)NCCNc1ccccc1 WXVL_AK2478SB0072 [0,0,0,0,0,1|1,0,2]=4 439 B17R1.4992 CC(=O)CCC(=O)NCCNc1ccccc1 WXVL_AK2478SB0072 [0,0,0,0,0,1|1,0,2]=4 440 B17R1.4992 CC(=O)CCC(=O)NCCOc1ccccc1 WXVL_AK0103SB0072 [0,0,0,0,0,1|1,0,2]=4 441 B17R1.4992 CC(=O)CCC(=O)NCCOc1ccccc1 WXVL_AK0103SB0072 [0,0,0,0,0,1|1,0,2]=4 442 B17R1.4992 CC(=O)NCC(=O)NCCCc1ccccc1 WXVL_AK0074SB0357 [0,0,0,0,0,1|2,0,1]=4 443 B17R1.4992 CC(=O)NCC(=O)NCCCc1ccccc1 WXVL_AK0074SB0357 [0,0,0,0,0,1|2,0,1]=4 444 B17R1.4992 CC(=O)NCC(=O)NCCNc1ccccc1 WXVL_AK2478SB0357 [0,0,0,0,0,1|2,0,1]=4 445 B17R1.4992 CC(=O)NCC(=O)NCCNc1ccccc1 WXVL_AK2478SB0357 [0,0,0,0,0,1|2,0,1]=4 446 B17R1.4992 CC(=O)NCC(=O)NCCOc1ccccc1 WXVL_AK0103SB0357 [0,0,0,0,0,1|2,0,1]=4 447 B17R1.4992 CC(=O)NCC(=O)NCCOc1ccccc1 WXVL_AK0103SB0357 [0,0,0,0,0,1|2,0,1]=4 448 B17R1.4992 CC(=O)OCC(=O)NCCCc1ccccc1 WXVL_AK0074SB2824 [0,0,0,0,0,1|2,0,1]=4 449 B17R1.4992 CC(=O)OCC(=O)NCCCc1ccccc1 WXVL_AK0074SB2824 [0,0,0,0,0,1|2,0,1]=4 450 B17R1.4992 CC(=O)OCC(=O)NCCNc1ccccc1 WXVL_AK2478SB2824 [0,0,0,0,0,1|2,0,1]=4 451 B17R1.4992 CC(=O)OCC(=O)NCCNc1ccccc1 WXVL_AK2478SB2824 [0,0,0,0,0,1|2,0,1]=4 452 B17R1.4992 CC(=O)OCC(=O)NCCOc1ccccc1 WXVL_AK0103SB2824 [0,0,0,0,0,1|2,0,1]=4 453 B17R1.4992 CC(=O)OCC(=O)NCCOc1ccccc1 WXVL_AK0103SB2824 [0,0,0,0,0,1|2,0,1]=4 454 B17R1.4992 CC(=O)SCC(=O)NCCCc1ccccc1 WXVL_AK0074SB3992 [0,0,0,0,0,1|2,0,1]=4 455 B17R1.4992 CC(=O)SCC(=O)NCCCc1ccccc1 WXVL_AK0074SB3992 [0,0,0,0,0,1|2,0,1]=4 456 B17R1.4992 CC(=O)SCC(=O)NCCNc1ccccc1 WXVL_AK2478SB3992 [0,0,0,0,0,1|2,0,1]=4 457 B17R1.4992 CC(=O)SCC(=O)NCCNc1ccccc1 WXVL_AK2478SB3992 [0,0,0,0,0,1|2,0,1]=4 458 B17R1.4992 CC(=O)SCC(=O)NCCOc1ccccc1 WXVL_AK0103SB3992 [0,0,0,0,0,1|2,0,1]=4 459 B17R1.4992 CC(=O)SCC(=O)NCCOc1ccccc1 WXVL_AK0103SB3992 [0,0,0,0,0,1|2,0,1]=4 460 B17R1.4992 CC(C)/C=C/C(=O)NCCCc1ccccc1 WXVL_AK0074SB0036 [0,0,0,0,0,1|2,0,1]=4 461 B17R1.4992 CC(C)/C=C/C(=O)NCCCc1ccccc1 WXVL_AK0074SB0036 [0,0,0,0,0,1|2,0,1]=4 462 B17R1.4992 CC(C)/C=C/C(=O)NCCNc1ccccc1 WXVL_AK2478SB0036 [0,0,0,0,0,1|2,0,1]=4 463 B17R1.4992 CC(C)/C=C/C(=O)NCCNc1ccccc1 WXVL_AK2478SB0036 [0,0,0,0,0,1|2,0,1]=4 464 B17R1.4992 CC(C)/C=C/C(=O)NCCOc1ccccc1 WXVL_AK0103SB0036 [0,0,0,0,0,1|2,0,1]=4 465 B17R1.4992 CC(C)/C=C/C(=O)NCCOc1ccccc1 WXVL_AK0103SB0036 [0,0,0,0,0,1|2,0,1]=4 466 B17R1.4992 NC(=O)CCC(=O)NCCCc1ccccc1 WXVL_AK0074SB0358 [0,0,0,0,0,1|1,0,2]=4 467 B17R1.4992 NC(=O)CCC(=O)NCCCc1ccccc1 WXVL_AK0074SB0358 [0,0,0,0,0,1|1,0,2]=4 468 B17R1.4992 NC(=O)CCC(=O)NCCNc1ccccc1 WXVL_AK2478SB0358 [0,0,0,0,0,1|1,0,2]=4 469 B17R1.4992 NC(=O)CCC(=O)NCCNc1ccccc1 WXVL_AK2478SB0358 [0,0,0,0,0,1|1,0,2]=4 470 B17R1.4992 NC(=O)CCC(=O)NCCOc1ccccc1 WXVL_AK0103SB0358 [0,0,0,0,0,1|1,0,2]=4 471 B17R1.4992 NC(=O)CCC(=O)NCCOc1ccccc1 WXVL_AK0103SB0358 [0,0,0,0,0,1|1,0,2]=4 472 B17R1.4992 NC(=O)NCC(=O)NCCCc1ccccc1 WXVL_AK0074SB0746 [0,0,0,0,0,1|2,0,1]=4 473 B17R1.4992 NC(=O)NCC(=O)NCCCc1ccccc1 WXVL_AK0074SB0746 [0,0,0,0,0,1|2,0,1]=4 474 B17R1.4992 NC(=O)NCC(=O)NCCNc1ccccc1 WXVL_AK2478SB0746 [0,0,0,0,0,1|2,0,1]=4 475 B17R1.4992 NC(=O)NCC(=O)NCCNc1ccccc1 WXVL_AK2478SB0746 [0,0,0,0,0,1|2,0,1]=4 476 B17R1.4992 NC(=O)NCC(=O)NCCOc1ccccc1 WXVL_AK0103SB0746 [0,0,0,0,0,1|2,0,1]=4 477 B17R1.4992 NC(=O)NCC(=O)NCCOc1ccccc1 WXVL_AK0103SB0746 [0,0,0,0,0,1|2,0,1]=4 478 B17R1.4992 O=C(O)C#CC(=O)NC/C=C/c1ccccc1 WXVL_AK00073SB1110 [0,0,0,0,0,1|0,0,3]=4 479 B17R1.4992 O=C(O)C#CC(=O)NC/C=C/c1ccccc1 WXVL_AK00073SB1110 [0,0,0,0,0,1|0,0,3]=4 480 B17R1.4992 O=C(O)C#CC(=O)NCCCc1ccccc1 WXVL_AK0074SB1110 [0,0,0,0,0,1|0,0,2]=3 481 B17R1.4992 O=C(O)C#CC(=O)NCCCc1ccccc1 WXVL_AK0074SB1110 [0,0,0,0,0,1|0,0,2]=3 482 B17R1.4992 O=C(O)C#CC(=O)NCCCc1cccnc1 WXVL_AK2339SB1110 [0,0,0,0,0,1|1,0,2]=4 483 B17R1.4992 O=C(O)C#CC(=O)NCCCc1cccnc1 WXVL_AK2339SB1110 [0,0,0,0,0,1|1,0,2]=4 484 B17R1.4992 O=C(O)C#CC(=O)NCCCc1ccncc1 WXVL_AK1251SB1110 [0,0,0,0,0,1|1,0,2]=4 485 B17R1.4992 O=C(O)C#CC(=O)NCCCc1ccncc1 WXVL_AK1251SB1110 [0,0,0,0,0,1|1,0,2]=4 486 B17R1.4992 O=C(O)C#CC(=O)NCCNc1ccccc1 WXVL_AK2478SB1110 [0,0,0,0,0,1|0,0,2]=3 487 B17R1.4992 O=C(O)C#CC(=O)NCCNc1ccccc1 WXVL_AK2478SB1110 [0,0,0,0,0,1|0,0,2]=3 488 B17R1.4992 O=C(O)C#CC(=O)NCCOc1ccccc1 WXVL_AK0103SB1110 [0,0,0,0,0,1|0,0,2]=3 489 B17R1.4992 O=C(O)C#CC(=O)NCCOc1ccccc1 WXVL_AK0103SB1110 [0,0,0,0,0,1|0,0,2]=3 490 B17R1.4992 O=C(O)C#CC(=O)NCCOc1ccccn1 WXVL_AK2654SB1110 [0,0,0,0,0,1|1,0,2]=4 491 B17R1.4992 O=C(O)C#CC(=O)NCCOc1ccccn1 WXVL_AK2654SB1110 [0,0,0,0,0,1|1,0,2]=4 492 B17R1.4992 O=C(O)C#CC(=O)NCCOc1cccnc1 WXVL_AK2245SB1110 [0,0,0,0,0,1|1,0,2]=4 493 B17R1.4992 O=C(O)C#CC(=O)NCCOc1cccnc1 WXVL_AK2245SB1110 [0,0,0,0,0,1|1,0,2]=4 494 B17R1.4992 O=C(O)C#CC(=O)NCCOc1ccncc1 WXVL_AK00818SB1110 [0,0,0,0,0,1|1,0,2]=4 495 B17R1.4992 O=C(O)C#CC(=O)NCCOc1ccncc1 WXVL_AK00818SB1110 [0,0,0,0,0,1|1,0,2]=4 496 B17R1.16611 CC(=CCCC(=O)NCCc1ccccc1)C WXVL_AK00498SB00030 [0,0,0,0,0,1|2,0,1]=4 497 B17R1.16611 CC(=CCCC(=O)NCCc1ccccc1)C WXVL_AK00498SB00030 [0,0,0,0,0,1|2,0,1]=4 498 B17R1.16611 CC(=O)NCCC(=O)NCCc1ccccc1 WXVL_AK00498SB0374 [0,0,0,0,0,1|1,0,2]=4 499 B17R1.16611 CC(=O)NCCC(=O)NCCc1ccccc1 WXVL_AK00498SB0374 [0,0,0,0,0,1|1,0,2]=4 500 B14R1.520 C/C=C/C(=O)NCCc1ccccc1 WXVL_AK00498SB0340 [2,0,0,0,0,0|0,0,1]=3 501 B14R1.520 C/C=C/C(=O)NCCc1ccccc1 WXVL_AK00498SB0340 [2,0,0,0,0,0|0,0,1]=3 502 B14R1.520 C/C=C/C(=O)NCCc1ccccn1 WXVL_AK0019SB0340 [2,0,0,0,0,0|1,0,1]=4 503 B14R1.520 C/C=C/C(=O)NCCc1ccccn1 WXVL_AK0019SB0340 [2,0,0,0,0,0|1,0,1]=4 504 B14R1.520 C/C=C/C(=O)NCCc1cccnc1 WXVL_AK00436SB0340 [2,0,0,0,0,0|1,0,1]=4 505 B14R1.520 C/C=C/C(=O)NCCc1cccnc1 WXVL_AK00436SB0340 [2,0,0,0,0,0|1,0,1]=4 506 B14R1.520 C/C=C/C(=O)NCCc1ccncc1 WXVL_AK0093SB0340 [2,0,0,0,0,0|1,0,1]=4 507 B14R1.520 C/C=C/C(=O)NCCc1ccncc1 WXVL_AK0093SB0340 [2,0,0,0,0,0|1,0,1]=4 508 B14R1.520 C=CCC(=O)NCCc1ccccc1 WXVL_AK00498SB2732 [2,0,0,0,0,0|0,0,1]=3 509 B14R1.520 C=CCC(=O)NCCc1ccccc1 WXVL_AK00498SB2732 [2,0,0,0,0,0|0,0,1]=3 510 B14R1.520 C=CCC(=O)NCCc1ccccn1 WXVL_AK0019SB2732 [2,0,0,0,0,0|1,0,1]=4 511 B14R1.520 C=CCC(=O)NCCc1ccccn1 WXVL_AK0019SB2732 [2,0,0,0,0,0|1,0,1]=4 512 B14R1.520 C=CCC(=O)NCCc1cccnc1 WXVL_AK00436SB2732 [2,0,0,0,0,0|1,0,1]=4 513 B14R1.520 C=CCC(=O)NCCc1cccnc1 WXVL_AK00436SB2732 [2,0,0,0,0,0|1,0,1]=4 514 B14R1.520 C=CCC(=O)NCCc1ccncc1 WXVL_AK0093SB2732 [2,0,0,0,0,0|1,0,1]=4 515 B14R1.520 C=CCC(=O)NCCc1ccncc1 WXVL_AK0093SB2732 [2,0,0,0,0,0|1,0,1]=4 516 B16R1.8 Cc1ccc(cc1)CCNC(=O)/C=C/CBr WXVL_AK0066SB0424 [1,1,0,0,0,0|1,0,1]=4 517 B16R1.8 Cc1ccc(cc1)CCNC(=O)/C=C/CBr WXVL_AK0066SB0424 [1,1,0,0,0,0|1,0,1]=4 518 B16R1.8 O=C(/C=C/CBr)NCCc1ccc(cc1)Br WXVL_AK0745SB0424 [1,1,0,0,0,0|1,0,1]=4 519 B16R1.8 O=C(/C=C/CBr)NCCc1ccc(cc1)Br WXVL_AK0745SB0424 [1,1,0,0,0,0|1,0,1]=4 520 B16R1.8 O=C(/C=C/CBr)NCCc1ccc(cc1)Cl WXVL_AK1369SB0424 [1,1,0,0,0,0|1,0,1]=4 521 B16R1.8 O=C(/C=C/CBr)NCCc1ccc(cc1)Cl WXVL_AK1369SB0424 [1,1,0,0,0,0|1,0,1]=4 522 B16R1.8 O=C(/C=C/CBr)NCCc1ccc(cc1)F WXVL_AK0123SB0424 [1,1,0,0,0,0|1,0,1]=4 523 B16R1.8 O=C(/C=C/CBr)NCCc1ccc(cc1)F WXVL_AK0123SB0424 [1,1,0,0,0,0|1,0,1]=4 524 B16R1.8 O=C(/C=C/CBr)NCCc1ccc(cc1)O WXVL_AK0748SB0424 [1,1,0,0,0,0|1,0,1]=4 525 B16R1.8 O=C(/C=C/CBr)NCCc1ccc(cc1)O WXVL_AK0748SB0424 [1,1,0,0,0,0|1,0,1]=4 526 B16R1.119 Cc1cccc(c1)CCNC(=O)/C=C/CBr WXVL_AK8219SB0424 [1,1,0,0,0,0|1,0,1]=4 527 B16R1.119 Cc1cccc(c1)CCNC(=O)/C=C/CBr WXVL_AK8219SB0424 [1,1,0,0,0,0|1,0,1]=4 528 B16R1.119 O=C(/C=C/CBr)NCCc1cccc(c1)Br WXVL_AK0800SB0424 [1,1,0,0,0,0|1,0,1]=4 529 B16R1.119 O=C(/C=C/CBr)NCCc1cccc(c1)Br WXVL_AK0800SB0424 [1,1,0,0,0,0|1,0,1]=4 530 B16R1.119 O=C(/C=C/CBr)NCCc1cccc(c1)Cl WXVL_AK0776SB0424 [1,1,0,0,0,0|1,0,1]=4 531 B16R1.119 O=C(/C=C/CBr)NCCc1cccc(c1)Cl WXVL_AK0776SB0424 [1,1,0,0,0,0|1,0,1]=4 532 B16R1.119 O=C(/C=C/CBr)NCCc1cccc(c1)F WXVL_AK0117SB0424 [1,1,0,0,0,0|1,0,1]=4 533 B16R1.119 O=C(/C=C/CBr)NCCc1cccc(c1)F WXVL_AK0117SB0424 [1,1,0,0,0,0|1,0,1]=4 534 B16R1.119 O=C(/C=C/CBr)NCCc1cccc(c1)O WXVL_AK00421SB0424 [1,1,0,0,0,0|1,0,1]=4 535 B16R1.119 O=C(/C=C/CBr)NCCc1cccc(c1)O WXVL_AK00421SB0424 [1,1,0,0,0,0|1,0,1]=4 536 B16R1.700 CC(CNC(=O)/C=C/CBr)c1ccccc1 WXVL_AK00546SB0424 [1,1,0,0,0,0|1,0,1]=4 537 B16R1.700 CC(CNC(=O)/C=C/CBr)c1ccccc1 WXVL_AK00546SB0424 [1,1,0,0,0,0|1,0,1]=4 538 B16R1.700 C[C@H](CNC(=O)/C=C/CBr)c1ccccc1 WXVL_AK00506SB0424 [1,1,0,0,0,0|1,0,1]=4 539 B16R1.700 C[C@H](CNC(=O)/C=C/CBr)c1ccccc1 WXVL_AK00506SB0424 [1,1,0,0,0,0|1,0,1]=4 540 B16R1.700 O=C(/C=C/CBr)NCC(O)c1ccccc1 WXVL_AK0051SB0424 [1,1,0,0,0,0|1,0,1]=4 541 B16R1.700 O=C(/C=C/CBr)NCC(O)c1ccccc1 WXVL_AK0051SB0424 [1,1,0,0,0,0|1,0,1]=4 542 B16R1.1694 C/C=C/C=C/C(=O)NCCc1ccccc1 WXVL_AK00498SB0348 [1,1,0,0,0,0|1,0,0]=3 543 B16R1.1694 C/C=C/C=C/C(=O)NCCc1ccccc1 WXVL_AK00498SB0348 [1,1,0,0,0,0|1,0,0]=3 544 B16R1.1694 C/C=C/C=C/C(=O)NCCc1ccccn1 WXVL_AK0019SB0348 [1,1,0,0,0,0|2,0,0]=4 545 B16R1.1694 C/C=C/C=C/C(=O)NCCc1ccccn1 WXVL_AK0019SB0348 [1,1,0,0,0,0|2,0,0]=4 546 B16R1.1694 C/C=C/C=C/C(=O)NCCc1cccnc1 WXVL_AK00436SB0348 [1,1,0,0,0,0|2,0,0]=4 547 B16R1.1694 C/C=C/C=C/C(=O)NCCc1cccnc1 WXVL_AK00436SB0348 [1,1,0,0,0,0|2,0,0]=4 548 B16R1.1694 C/C=C/C=C/C(=O)NCCc1ccncc1 WXVL_AK0093SB0348 [1,1,0,0,0,0|2,0,0]=4 549 B16R1.1694 C/C=C/C=C/C(=O)NCCc1ccncc1 WXVL_AK0093SB0348 [1,1,0,0,0,0|2,0,0]=4 550 B16R1.1694 CC/C=C/CC(=O)NCCc1ccccc1 WXVL_AK00498SB0349 [1,1,0,0,0,0|1,0,1]=4 551 B16R1.1694 CC/C=C/CC(=O)NCCc1ccccc1 WXVL_AK00498SB0349 [1,1,0,0,0,0|1,0,1]=4 552 B16R1.1694 CCO/C=C/C(=O)NCCc1ccccc1 WXVL_AK00498SB3226 [1,1,0,0,0,0|1,0,1]=4 553 B16R1.1694 CCO/C=C/C(=O)NCCc1ccccc1 WXVL_AK00498SB3226 [1,1,0,0,0,0|1,0,1]=4 554 B16R1.4473 Cc1ccccc1CCNC(=O)/C=C/CBr WXVL_AK0254SB0424 [1,1,0,0,0,0|1,0,1]=4 555 B16R1.4473 Cc1ccccc1CCNC(=O)/C=C/CBr WXVL_AK0254SB0424 [1,1,0,0,0,0|1,0,1]=4 556 B16R1.4473 O=C(/C=C/CBr)NCCc1ccccc1Br WXVL_AK0778SB0424 [1,1,0,0,0,0|1,0,1]=4 557 B16R1.4473 O=C(/C=C/CBr)NCCc1ccccc1Br WXVL_AK0778SB0424 [1,1,0,0,0,0|1,0,1]=4 558 B16R1.4473 O=C(/C=C/CBr)NCCc1ccccc1Cl WXVL_AK0715SB0424 [1,1,0,0,0,0|1,0,1]=4 559 B16R1.4473 O=C(/C=C/CBr)NCCc1ccccc1Cl WXVL_AK0715SB0424 [1,1,0,0,0,0|1,0,1]=4 560 B16R1.4473 O=C(/C=C/CBr)NCCc1ccccc1F WXVL_AK0118SB0424 [1,1,0,0,0,0|1,0,1]=4 561 B16R1.4473 O=C(/C=C/CBr)NCCc1ccccc1F WXVL_AK0118SB0424 [1,1,0,0,0,0|1,0,1]=4 562 B16R1.4473 O=C(/C=C/CBr)NCCc1ccccc1O WXVL_AK2884SB0424 [1,1,0,0,0,0|1,0,1]=4 563 B16R1.4473 O=C(/C=C/CBr)NCCc1ccccc1O WXVL_AK2884SB0424 [1,1,0,0,0,0|1,0,1]=4 564 B16R1.14049 CC/C=C(\C)/C(=O)NCCc1ccccc1 WXVL_AK00498SB0037 [1,1,0,0,0,0|1,0,1]=4 565 B16R1.14049 CC/C=C(\C)/C(=O)NCCc1ccccc1 WXVL_AK00498SB0037 [1,1,0,0,0,0|1,0,1]=4 566 B16R1.14049 C[C@H](NC=O)C(=O)NCCc1ccccc1 WXVL_AK00498SB5176 [1,1,0,0,0,0|1,0,1]=4 567 B16R1.14049 C[C@H](NC=O)C(=O)NCCc1ccccc1 WXVL_AK00498SB5176 [1,1,0,0,0,0|1,0,1]=4 568 B16R1.400 Cc1ccccc1CNC(=O)C#CC(=O)O WXVL_AK0040SB1110 [0,1,0,0,1,0|0,0,2]=4 569 B16R1.400 Cc1ccccc1CNC(=O)C#CC(=O)O WXVL_AK0040SB1110 [0,1,0,0,1,0|0,0,2]=4 570 B16R1.400 O=C(O)C#CC(=O)NCc1ccccc1Br WXVL_AK1632SB1110 [0,1,0,0,1,0|0,0,2]=4 571 B16R1.400 O=C(O)C#CC(=O)NCc1ccccc1Br WXVL_AK1632SB1110 [0,1,0,0,1,0|0,0,2]=4 572 B16R1.400 O=C(O)C#CC(=O)NCc1ccccc1Cl WXVL_AK0038SB1110 [0,1,0,0,1,0|0,0,2]=4 573 B16R1.400 O=C(O)C#CC(=O)NCc1ccccc1Cl WXVL_AK0038SB1110 [0,1,0,0,1,0|0,0,2]=4 574 B16R1.400 O=C(O)C#CC(=O)NCc1ccccc1F WXVL_AK0037SB1110 [0,1,0,0,1,0|0,0,2]=4 575 B16R1.400 O=C(O)C#CC(=O)NCc1ccccc1F WXVL_AK0037SB1110 [0,1,0,0,1,0|0,0,2]=4 576 B16R1.400 O=C(O)C#CC(=O)NCc1ccccc1I WXVL_AK3923SB1110 [0,1,0,0,1,0|0,0,2]=4 577 B16R1.400 O=C(O)C#CC(=O)NCc1ccccc1I WXVL_AK3923SB1110 [0,1,0,0,1,0|0,0,2]=4 578 B16R1.400 O=C(O)C#CC(=O)NCc1ccccc1O WXVL_AK0963SB1110 [0,1,0,0,1,0|0,0,2]=4 579 B16R1.400 O=C(O)C#CC(=O)NCc1ccccc1O WXVL_AK0963SB1110 [0,1,0,0,1,0|0,0,2]=4 580 B16R1.1061 Cc1ccc(cc1)CNC(=O)C#CC(=O)O WXVL_AK0048SB1110 [0,1,0,0,1,0|0,0,2]=4 581 B16R1.1061 Cc1ccc(cc1)CNC(=O)C#CC(=O)O WXVL_AK0048SB1110 [0,1,0,0,1,0|0,0,2]=4 582 B16R1.1061 O=C(O)C#CC(=O)NCc1ccc(cc1)Br WXVL_AK1474SB1110 [0,1,0,0,1,0|0,0,2]=4 583 B16R1.1061 O=C(O)C#CC(=O)NCc1ccc(cc1)Br WXVL_AK1474SB1110 [0,1,0,0,1,0|0,0,2]=4 584 B16R1.1061 O=C(O)C#CC(=O)NCc1ccc(cc1)Cl WXVL_AK0047SB1110 [0,1,0,0,1,0|0,0,2]=4 585 B16R1.1061 O=C(O)C#CC(=O)NCc1ccc(cc1)Cl WXVL_AK0047SB1110 [0,1,0,0,1,0|0,0,2]=4 586 B16R1.1061 O=C(O)C#CC(=O)NCc1ccc(cc1)F WXVL_AK0046SB1110 [0,1,0,0,1,0|0,0,2]=4 587 B16R1.1061 O=C(O)C#CC(=O)NCc1ccc(cc1)F WXVL_AK0046SB1110 [0,1,0,0,1,0|0,0,2]=4 588 B16R1.1061 O=C(O)C#CC(=O)NCc1ccc(cc1)I WXVL_AK1644SB1110 [0,1,0,0,1,0|0,0,2]=4 589 B16R1.1061 O=C(O)C#CC(=O)NCc1ccc(cc1)I WXVL_AK1644SB1110 [0,1,0,0,1,0|0,0,2]=4 590 B16R1.1061 O=C(O)C#CC(=O)NCc1ccc(cc1)O WXVL_AK0926SB1110 [0,1,0,0,1,0|0,0,2]=4 591 B16R1.1061 O=C(O)C#CC(=O)NCc1ccc(cc1)O WXVL_AK0926SB1110 [0,1,0,0,1,0|0,0,2]=4 592 B16R1.1284 CN(Cc1ccccc1)C(=O)C#CC(=O)O WXVL_AN0033SB1110 [0,1,0,0,1,0|0,0,2]=4 593 B16R1.1284 CN(Cc1ccccc1)C(=O)C#CC(=O)O WXVL_AN0033SB1110 [0,1,0,0,1,0|0,0,2]=4 594 B16R1.1343 CNC(=O)/C=C\C(=O)NCc1ccccc1 WXVL_AK00442SB3786 [0,1,0,0,1,0|1,0,0]=3 595 B16R1.1343 CNC(=O)/C=C\C(=O)NCc1ccccc1 WXVL_AK00442SB3786 [0,1,0,0,1,0|1,0,0]=3 596 B16R1.1343 COC(=O)CCC(=O)NCc1ccccc1 WXVL_AK00502SB0069 [0,1,0,0,1,0|0,0,2]=4 597 B16R1.1343 COC(=O)CCC(=O)NCc1ccccc1 WXVL_AK00502SB0069 [0,1,0,0,1,0|0,0,2]=4 598 B16R1.4122 C/C(=C/C(=O)NCc1ccccc1)/C(=O)O WXVL_AK00502SB2187 [0,1,0,0,1,0|0,0,0]=2 599 B16R1.4122 C/C(=C/C(=O)NCc1ccccc1)/C(=O)O WXVL_AK00502SB2187 [0,1,0,0,1,0|0,0,0]=2 600 B16R1.4122 C/C(=C/C(=O)NCc1ccccn1)/C(=O)O WXVL_AK0018SB2187 [0,1,0,0,1,0|1,0,0]=3 601 B16R1.4122 C/C(=C/C(=O)NCc1ccccn1)/C(=O)O WXVL_AK0018SB2187 [0,1,0,0,1,0|1,0,0]=3 602 B16R1.4122 C/C(=C/C(=O)NCc1cccnc1)/C(=O)O WXVL_AK0020SB2187 [0,1,0,0,1,0|1,0,0]=3 603 B16R1.4122 C/C(=C/C(=O)NCc1cccnc1)/C(=O)O WXVL_AK0020SB2187 [0,1,0,0,1,0|1,0,0]=3 604 B16R1.4122 C/C(=C/C(=O)NCc1ccncc1)/C(=O)O WXVL_AK0021SB2187 [0,1,0,0,1,0|1,0,0]=3 605 B16R1.4122 C/C(=C/C(=O)NCc1ccncc1)/C(=O)O WXVL_AK0021SB2187 [0,1,0,0,1,0|1,0,0]=3 606 B16R1.4122 C/C(=C/C(=O)NCc1ccncn1)/C(=O)O WXVL_AK1356SB2187 [0,1,0,0,1,0|2,0,0]=4 607 B16R1.4122 C/C(=C/C(=O)NCc1ccncn1)/C(=O)O WXVL_AK1356SB2187 [0,1,0,0,1,0|2,0,0]=4 608 B16R1.4122 C/C(=C/C(=O)NCc1cnccn1)/C(=O)O WXVL_AK00262SB2187 [0,1,0,0,1,0|2,0,0]=4 609 B16R1.4122 C/C(=C/C(=O)NCc1cnccn1)/C(=O)O WXVL_AK00262SB2187 [0,1,0,0,1,0|2,0,0]=4 610 B16R1.4122 C/C(=C/C(=O)NCc1cncnc1)/C(=O)O WXVL_AK1364SB2187 [0,1,0,0,1,0|2,0,0]=4 611 B16R1.4122 C/C(=C/C(=O)NCc1cncnc1)/C(=O)O WXVL_AK1364SB2187 [0,1,0,0,1,0|2,0,0]=4 612 B16R1.4122 C/C(=C/C(=O)NCc1ncccn1)/C(=O)O WXVL_AK0279SB2187 [0,1,0,0,1,0|2,0,0]=4 613 B16R1.4122 C/C(=C/C(=O)NCc1ncccn1)/C(=O)O WXVL_AK0279SB2187 [0,1,0,0,1,0|2,0,0]=4 614 B16R1.11227 Cc1cccc(c1)CNC(=O)C#CC(=O)O WXVL_AK0045SB1110 [0,1,0,0,1,0|0,0,2]=4 615 B16R1.11227 Cc1cccc(c1)CNC(=O)C#CC(=O)O WXVL_AK0045SB1110 [0,1,0,0,1,0|0,0,2]=4 616 B16R1.11227 O=C(O)C#CC(=O)NCc1cccc(c1)Br WXVL_AK1177SB1110 [0,1,0,0,1,0|0,0,2]=4 617 B16R1.11227 O=C(O)C#CC(=O)NCc1cccc(c1)Br WXVL_AK1177SB1110 [0,1,0,0,1,0|0,0,2]=4 618 B16R1.11227 O=C(O)C#CC(=O)NCc1cccc(c1)Cl WXVL_AK0094SB1110 [0,1,0,0,1,0|0,0,2]=4 619 B16R1.11227 O=C(O)C#CC(=O)NCc1cccc(c1)Cl WXVL_AK0094SB1110 [0,1,0,0,1,0|0,0,2]=4 620 B16R1.11227 O=C(O)C#CC(=O)NCc1cccc(c1)F WXVL_AK0041SB1110 [0,1,0,0,1,0|0,0,2]=4 621 B16R1.11227 O=C(O)C#CC(=O)NCc1cccc(c1)F WXVL_AK0041SB1110 [0,1,0,0,1,0|0,0,2]=4 622 B16R1.11227 O=C(O)C#CC(=O)NCc1cccc(c1)I WXVL_AK1572SB1110 [0,1,0,0,1,0|0,0,2]=4 623 B16R1.11227 O=C(O)C#CC(=O)NCc1cccc(c1)I WXVL_AK1572SB1110 [0,1,0,0,1,0|0,0,2]=4 624 B16R1.11227 O=C(O)C#CC(=O)NCc1cccc(c1)O WXVL_AK0974SB1110 [0,1,0,0,1,0|0,0,2]=4 625 B16R1.11227 O=C(O)C#CC(=O)NCc1cccc(c1)O WXVL_AK0974SB1110 [0,1,0,0,1,0|0,0,2]=4 626 B16R1.76 CC(=CC(=O)NCCc1ccc(cc1)Br)C WXVL_AK0745SB0342 [0,1,0,0,1,0|2,0,0]=4 627 B16R1.76 CC(=CC(=O)NCCc1ccc(cc1)Br)C WXVL_AK0745SB0342 [0,1,0,0,1,0|2,0,0]=4 628 B16R1.76 CC(=CC(=O)NCCc1ccc(cc1)C)C WXVL_AK0066SB0342 [0,1,0,0,1,0|2,0,0]=4 629 B16R1.76 CC(=CC(=O)NCCc1ccc(cc1)C)C WXVL_AK0066SB0342 [0,1,0,0,1,0|2,0,0]=4 630 B16R1.76 CC(=CC(=O)NCCc1ccc(cc1)Cl)C WXVL_AK1369SB0342 [0,1,0,0,1,0|2,0,0]=4 631 B16R1.76 CC(=CC(=O)NCCc1ccc(cc1)Cl)C WXVL_AK1369SB0342 [0,1,0,0,1,0|2,0,0]=4 632 B16R1.76 CC(=CC(=O)NCCc1ccc(cc1)F)C WXVL_AK0123SB0342 [0,1,0,0,1,0|2,0,0]=4 633 B16R1.76 CC(=CC(=O)NCCc1ccc(cc1)F)C WXVL_AK0123SB0342 [0,1,0,0,1,0|2,0,0]=4 634 B16R1.76 CC(=CC(=O)NCCc1ccc(cc1)O)C WXVL_AK0748SB0342 [0,1,0,0,1,0|2,0,0]=4 635 B16R1.76 CC(=CC(=O)NCCc1ccc(cc1)O)C WXVL_AK0748SB0342 [0,1,0,0,1,0|2,0,0]=4 636 B16R1.82 CC(=CC(=O)NCCc1cccc(c1)Br)C WXVL_AK0800SB0342 [0,1,0,0,1,0|2,0,0]=4 637 B16R1.82 CC(=CC(=O)NCCc1cccc(c1)Br)C WXVL_AK0800SB0342 [0,1,0,0,1,0|2,0,0]=4 638 B16R1.82 CC(=CC(=O)NCCc1cccc(c1)C)C WXVL_AK8219SB0342 [0,1,0,0,1,0|2,0,0]=4 639 B16R1.82 CC(=CC(=O)NCCc1cccc(c1)C)C WXVL_AK8219SB0342 [0,1,0,0,1,0|2,0,0]=4 640 B16R1.82 CC(=CC(=O)NCCc1cccc(c1)Cl)C WXVL_AK0776SB0342 [0,1,0,0,1,0|2,0,0]=4 641 B16R1.82 CC(=CC(=O)NCCc1cccc(c1)Cl)C WXVL_AK0776SB0342 [0,1,0,0,1,0|2,0,0]=4 642 B16R1.82 CC(=CC(=O)NCCc1cccc(c1)F)C WXVL_AK0117SB0342 [0,1,0,0,1,0|2,0,0]=4 643 B16R1.82 CC(=CC(=O)NCCc1cccc(c1)F)C WXVL_AK0117SB0342 [0,1,0,0,1,0|2,0,0]=4 644 B16R1.82 CC(=CC(=O)NCCc1cccc(c1)O)C WXVL_AK00421SB0342 [0,1,0,0,1,0|2,0,0]=4 645 B16R1.82 CC(=CC(=O)NCCc1cccc(c1)O)C WXVL_AK00421SB0342 [0,1,0,0,1,0|2,0,0]=4 646 B16R1.289 CC(=CC(=O)NCCc1ccccc1Br)C WXVL_AK0778SB0342 [0,1,0,0,1,0|2,0,0]=4 647 B16R1.289 CC(=CC(=O)NCCc1ccccc1Br)C WXVL_AK0778SB0342 [0,1,0,0,1,0|2,0,0]=4 648 B16R1.289 CC(=CC(=O)NCCc1ccccc1C)C WXVL_AK0254SB0342 [0,1,0,0,1,0|2,0,0]=4 649 B16R1.289 CC(=CC(=O)NCCc1ccccc1C)C WXVL_AK0254SB0342 [0,1,0,0,1,0|2,0,0]=4 650 B16R1.289 CC(=CC(=O)NCCc1ccccc1Cl)C WXVL_AK0715SB0342 [0,1,0,0,1,0|2,0,0]=4 651 B16R1.289 CC(=CC(=O)NCCc1ccccc1Cl)C WXVL_AK0715SB0342 [0,1,0,0,1,0|2,0,0]=4 652 B16R1.289 CC(=CC(=O)NCCc1ccccc1F)C WXVL_AK0118SB0342 [0,1,0,0,1,0|2,0,0]=4 653 B16R1.289 CC(=CC(=O)NCCc1ccccc1F)C WXVL_AK0118SB0342 [0,1,0,0,1,0|2,0,0]=4 654 B16R1.289 CC(=CC(=O)NCCc1ccccc1O)C WXVL_AK2884SB0342 [0,1,0,0,1,0|2,0,0]=4 655 B16R1.289 CC(=CC(=O)NCCc1ccccc1O)C WXVL_AK2884SB0342 [0,1,0,0,1,0|2,0,0]=4 656 B16R1.612 CC(=CC(=O)NCC(C)c1ccccc1)C WXVL_AK00546SB0342 [0,1,0,0,1,0|2,0,0]=4 657 B16R1.612 CC(=CC(=O)NCC(C)c1ccccc1)C WXVL_AK00546SB0342 [0,1,0,0,1,0|2,0,0]=4 658 B16R1.612 CC(=CC(=O)NCC(O)c1ccccc1)C WXVL_AK0051SB0342 [0,1,0,0,1,0|2,0,0]=4 659 B16R1.612 CC(=CC(=O)NCC(O)c1ccccc1)C WXVL_AK0051SB0342 [0,1,0,0,1,0|2,0,0]=4 660 B16R1.612 CC(=CC(=O)NC[C@@H](C)c1ccccc1)C WXVL_AK00506SB0342 [0,1,0,0,1,0|2,0,0]=4 661 B16R1.612 CC(=CC(=O)NC[C@@H](C)c1ccccc1)C WXVL_AK00506SB0342 [0,1,0,0,1,0|2,0,0]=4 662 B16R1.12333 C/C(=C/C(=O)NCCc1cc[nH]n1)/C(=O)O WXVL_AK1576SB2187 [0,1,0,0,1,0|2,0,0]=4 663 B16R1.12333 C/C(=C/C(=O)NCCc1cc[nH]n1)/C(=O)O WXVL_AK1576SB2187 [0,1,0,0,1,0|2,0,0]=4 664 B16R1.12333 C/C(=C/C(=O)NCCc1ccco1)/C(=O)O WXVL_AK0989SB2187 [0,1,0,0,1,0|1,0,0]=3 665 B16R1.12333 C/C(=C/C(=O)NCCc1ccco1)/C(=O)O WXVL_AK0989SB2187 [0,1,0,0,1,0|1,0,0]=3 666 B16R1.12333 C/C(=C/C(=O)NCCc1cccs1)/C(=O)O WXVL_AK0098SB2187 [0,1,0,0,1,0|1,0,0]=3 667 B16R1.12333 C/C(=C/C(=O)NCCc1cccs1)/C(=O)O WXVL_AK0098SB2187 [0,1,0,0,1,0|1,0,0]=3 668 B16R1.12333 C/C(=C/C(=O)NCCc1ccsc1)/C(=O)O WXVL_AK1342SB2187 [0,1,0,0,1,0|1,0,0]=3 669 B16R1.12333 C/C(=C/C(=O)NCCc1ccsc1)/C(=O)O WXVL_AK1342SB2187 [0,1,0,0,1,0|1,0,0]=3 670 B16R1.12333 C/C(=C/C(=O)NCCc1cnc[nH]1)/C(=O)O WXVL_AK0479SB2187 [0,1,0,0,1,0|2,0,0]=4 671 B16R1.12333 C/C(=C/C(=O)NCCc1cnc[nH]1)/C(=O)O WXVL_AK0479SB2187 [0,1,0,0,1,0|2,0,0]=4 672 B16R1.12333 C/C(=C/C(=O)NCCc1ncc[nH]1)/C(=O)O WXVL_AK00009SB2187 [0,1,0,0,1,0|2,0,0]=4 673 B16R1.12333 C/C(=C/C(=O)NCCc1ncc[nH]1)/C(=O)O WXVL_AK00009SB2187 [0,1,0,0,1,0|2,0,0]=4 674 B16R1.12333 C/C(=C/C(=O)NCCc1nccs1)/C(=O)O WXVL_AK0181SB2187 [0,1,0,0,1,0|2,0,0]=4 675 B16R1.12333 C/C(=C/C(=O)NCCc1nccs1)/C(=O)O WXVL_AK0181SB2187 [0,1,0,0,1,0|2,0,0]=4 676 B16R1.12333 C/C(=C/C(=O)NCCn1cccc1)/C(=O)O WXVL_AK1188SB2187 [0,1,0,0,1,0|1,0,0]=3 677 B16R1.12333 C/C(=C/C(=O)NCCn1cccc1)/C(=O)O WXVL_AK1188SB2187 [0,1,0,0,1,0|1,0,0]=3 678 B16R1.12333 C/C(=C/C(=O)NCCn1ccnc1)/C(=O)O WXVL_AK00034SB2187 [0,1,0,0,1,0|2,0,0]=4 679 B16R1.12333 C/C(=C/C(=O)NCCn1ccnc1)/C(=O)O WXVL_AK00034SB2187 [0,1,0,0,1,0|2,0,0]=4 680 B18R1.1032 Cc1ccc(cc1)OCCNC(=O)C#CC(=O)O WXVL_AK7560SB1110 [0,1,0,0,0,1|0,0,2]=4 681 B18R1.1032 Cc1ccc(cc1)OCCNC(=O)C#CC(=O)O WXVL_AK7560SB1110 [0,1,0,0,0,1|0,0,2]=4 682 B18R1.1032 O=C(O)C#CC(=O)NCCOc1ccc(cc1)Cl WXVL_AK0501SB1110 [0,1,0,0,0,1|0,0,2]=4 683 B18R1.1032 O=C(O)C#CC(=O)NCCOc1ccc(cc1)Cl WXVL_AK0501SB1110 [0,1,0,0,0,1|0,0,2]=4 684 B18R1.1032 O=C(O)C#CC(=O)NCCOc1ccc(cc1)F WXVL_AK0979SB1110 [0,1,0,0,0,1|0,0,2]=4 685 B18R1.1032 O=C(O)C#CC(=O)NCCOc1ccc(cc1)F WXVL_AK0979SB1110 [0,1,0,0,0,1|0,0,2]=4 686 B18R1.5070 CN(CCNC(=O)C#CC(=O)O)c1ccccc1 WXVL_AK00706SB1110 [0,1,0,0,0,1|0,0,2]=4 687 B18R1.5070 CN(CCNC(=O)C#CC(=O)O)c1ccccc1 WXVL_AK00706SB1110 [0,1,0,0,0,1|0,0,2]=4 688 B18R1.5073 O=C(O)C#CC(=O)NC[C@H](O)Cc1ccccc1 WXVL_AKA020SB1110 [0,1,0,0,0,1|0,0,2]=4 689 B18R1.5073 O=C(O)C#CC(=O)NC[C@H](O)Cc1ccccc1 WXVL_AKA020SB1110 [0,1,0,0,0,1|0,0,2]=4 690 B18R1.10198 Cc1ccccc1OCCNC(=O)C#CC(=O)O WXVL_AK1111SB1110 [0,1,0,0,0,1|0,0,2]=4 691 B18R1.10198 Cc1ccccc1OCCNC(=O)C#CC(=O)O WXVL_AK1111SB1110 [0,1,0,0,0,1|0,0,2]=4 692 B18R1.10198 O=C(O)C#CC(=O)NCCOc1ccccc1Cl WXVL_AK0815SB1110 [0,1,0,0,0,1|0,0,2]=4 693 B18R1.10198 O=C(O)C#CC(=O)NCCOc1ccccc1Cl WXVL_AK0815SB1110 [0,1,0,0,0,1|0,0,2]=4 694 B18R1.10265 COC(=O)CCC(=O)NCCCc1ccccc1 WXVL_AK0074SB0069 [0,1,0,0,0,1|0,0,2]=4 695 B18R1.10265 COC(=O)CCC(=O)NCCCc1ccccc1 WXVL_AK0074SB0069 [0,1,0,0,0,1|0,0,2]=4 696 B18R1.10265 COC(=O)CCC(=O)NCCNc1ccccc1 WXVL_AK2478SB0069 [0,1,0,0,0,1|0,0,2]=4 697 B18R1.10265 COC(=O)CCC(=O)NCCNc1ccccc1 WXVL_AK2478SB0069 [0,1,0,0,0,1|0,0,2]=4 698 B18R1.10265 COC(=O)CCC(=O)NCCOc1ccccc1 WXVL_AK0103SB0069 [0,1,0,0,0,1|0,0,2]=4 699 B18R1.10265 COC(=O)CCC(=O)NCCOc1ccccc1 WXVL_AK0103SB0069 [0,1,0,0,0,1|0,0,2]=4 700 B18R1.17766 O=C(O)C#CC(=O)NCCOc1cccc(c1)Br WXVL_AK0441SB1110 [0,1,0,0,0,1|0,0,2]=4 701 B18R1.17766 O=C(O)C#CC(=O)NCCOc1cccc(c1)Br WXVL_AK0441SB1110 [0,1,0,0,0,1|0,0,2]=4 702 B18R1.17766 O=C(O)C#CC(=O)NCCOc1cccc(c1)F WXVL_AK2572SB1110 [0,1,0,0,0,1|0,0,2]=4 703 B18R1.17766 O=C(O)C#CC(=O)NCCOc1cccc(c1)F WXVL_AK2572SB1110 [0,1,0,0,0,1|0,0,2]=4 704 B18R1.20938 C/C(=C/C(=O)NC/C=C/c1ccccc1)/C(=O)O WXVL_AK00073SB2187 [0,1,0,0,0,1|0,0,1]=3 705 B18R1.20938 C/C(=C/C(=O)NC/C=C/c1ccccc1)/C(=O)O WXVL_AK00073SB2187 [0,1,0,0,0,1|0,0,1]=3 706 B18R1.20938 C/C(=C/C(=O)NCCCc1ccccc1)/C(=O)O WXVL_AK0074SB2187 [0,1,0,0,0,1|0,0,0]=2 707 B18R1.20938 C/C(=C/C(=O)NCCCc1ccccc1)/C(=O)O WXVL_AK0074SB2187 [0,1,0,0,0,1|0,0,0]=2 708 B18R1.20938 C/C(=C/C(=O)NCCCc1cccnc1)/C(=O)O WXVL_AK2339SB2187 [0,1,0,0,0,1|1,0,0]=3 709 B18R1.20938 C/C(=C/C(=O)NCCCc1cccnc1)/C(=O)O WXVL_AK2339SB2187 [0,1,0,0,0,1|1,0,0]=3 710 B18R1.20938 C/C(=C/C(=O)NCCCc1ccncc1)/C(=O)O WXVL_AK1251SB2187 [0,1,0,0,0,1|1,0,0]=3 711 B18R1.20938 C/C(=C/C(=O)NCCCc1ccncc1)/C(=O)O WXVL_AK1251SB2187 [0,1,0,0,0,1|1,0,0]=3 712 B18R1.20938 C/C(=C/C(=O)NCCNc1ccccc1)/C(=O)O WXVL_AK2478SB2187 [0,1,0,0,0,1|0,0,0]=2 713 B18R1.20938 C/C(=C/C(=O)NCCNc1ccccc1)/C(=O)O WXVL_AK2478SB2187 [0,1,0,0,0,1|0,0,0]=2 714 B18R1.20938 C/C(=C/C(=O)NCCOc1ccccc1)/C(=O)O WXVL_AK0103SB2187 [0,1,0,0,0,1|0,0,0]=2 715 B18R1.20938 C/C(=C/C(=O)NCCOc1ccccc1)/C(=O)O WXVL_AK0103SB2187 [0,1,0,0,0,1|0,0,0]=2 716 B18R1.20938 C/C(=C/C(=O)NCCOc1ccccn1)/C(=O)O WXVL_AK2654SB2187 [0,1,0,0,0,1|1,0,0]=3 717 B18R1.20938 C/C(=C/C(=O)NCCOc1ccccn1)/C(=O)O WXVL_AK2654SB2187 [0,1,0,0,0,1|1,0,0]=3 718 B18R1.20938 C/C(=C/C(=O)NCCOc1cccnc1)/C(=O)O WXVL_AK2245SB2187 [0,1,0,0,0,1|1,0,0]=3 719 B18R1.20938 C/C(=C/C(=O)NCCOc1cccnc1)/C(=O)O WXVL_AK2245SB2187 [0,1,0,0,0,1|1,0,0]=3 720 B18R1.20938 C/C(=C/C(=O)NCCOc1ccncc1)/C(=O)O WXVL_AK00818SB2187 [0,1,0,0,0,1|1,0,0]=3 721 B18R1.20938 C/C(=C/C(=O)NCCOc1ccncc1)/C(=O)O WXVL_AK00818SB2187 [0,1,0,0,0,1|1,0,0]=3 722 B18R1.36867 CN(CCCc1ccccc1)C(=O)C#CC(=O)O WXVL_AN2288SB1110 [0,1,0,0,0,1|0,0,2]=4 723 B18R1.36867 CN(CCCc1ccccc1)C(=O)C#CC(=O)O WXVL_AN2288SB1110 [0,1,0,0,0,1|0,0,2]=4 724 B18R1.30 COC(=O)CCC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB0069 [0,2,0,0,0,0|0,0,2]=4 725 B18R1.30 COC(=O)CCC(=O)NCCc1ccc(cc1)Br WXVL_AK0745SB0069 [0,2,0,0,0,0|0,0,2]=4 726 B18R1.30 COC(=O)CCC(=O)NCCc1ccc(cc1)C WXVL_AK0066SB0069 [0,2,0,0,0,0|0,0,2]=4 727 B18R1.30 COC(=O)CCC(=O)NCCc1ccc(cc1)C WXVL_AK0066SB0069 [0,2,0,0,0,0|0,0,2]=4 728 B18R1.30 COC(=O)CCC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB0069 [0,2,0,0,0,0|0,0,2]=4 729 B18R1.30 COC(=O)CCC(=O)NCCc1ccc(cc1)Cl WXVL_AK1369SB0069 [0,2,0,0,0,0|0,0,2]=4 730 B18R1.30 COC(=O)CCC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB0069 [0,2,0,0,0,0|0,0,2]=4 731 B18R1.30 COC(=O)CCC(=O)NCCc1ccc(cc1)F WXVL_AK0123SB0069 [0,2,0,0,0,0|0,0,2]=4 732 B18R1.30 COC(=O)CCC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB0069 [0,2,0,0,0,0|0,0,2]=4 733 B18R1.30 COC(=O)CCC(=O)NCCc1ccc(cc1)O WXVL_AK0748SB0069 [0,2,0,0,0,0|0,0,2]=4 734 B18R1.190 COc1ccc(cc1)CCNC(=O)C#CC(=O)O WXVL_AK2321SB1110 [0,2,0,0,0,0|0,0,2]=4 735 B18R1.190 COc1ccc(cc1)CCNC(=O)C#CC(=O)O WXVL_AK2321SB1110 [0,2,0,0,0,0|0,0,2]=4 736 B18R1.972 O=C(O)C#CC(=O)NCC(O)c1ccc(cc1)O WXVL_AK00470SB1110 [0,2,0,0,0,0|0,0,2]=4 737 B18R1.972 O=C(O)C#CC(=O)NCC(O)c1ccc(cc1)O WXVL_AK00470SB1110 [0,2,0,0,0,0|0,0,2]=4 738 B18R1.980 CN(CCc1ccc(cc1)Cl)C(=O)C#CC(=O)O WXVL_AN3038SB1110 [0,2,0,0,0,0|0,0,2]=4 739 B18R1.980 CN(CCc1ccc(cc1)Cl)C(=O)C#CC(=O)O WXVL_AN3038SB1110 [0,2,0,0,0,0|0,0,2]=4 740 B18R1.10383 O=C(O)C#CC(=O)NCCc1ccc(cc1Cl)Cl WXVL_AK0889SB1110 [0,2,0,0,0,0|0,0,2]=4 741 B18R1.10383 O=C(O)C#CC(=O)NCCc1ccc(cc1Cl)Cl WXVL_AK0889SB1110 [0,2,0,0,0,0|0,0,2]=4 742 B18R1.10383 O=C(O)C#CC(=O)NCCc1ccc(cc1F)F WXVL_AK3943SB1110 [0,2,0,0,0,0|0,0,2]=4 743 B18R1.10383 O=C(O)C#CC(=O)NCCc1ccc(cc1F)F WXVL_AK3943SB1110 [0,2,0,0,0,0|0,0,2]=4 744 B18R1.32363 Cc1ccc(cc1C)CCNC(=O)C#CC(=O)O WXVL_AK0924SB1110 [0,2,0,0,0,0|0,0,2]=4 745 B18R1.32363 Cc1ccc(cc1C)CCNC(=O)C#CC(=O)O WXVL_AK0924SB1110 [0,2,0,0,0,0|0,0,2]=4 746 B18R1.32363 O=C(O)C#CC(=O)NCCc1ccc(c(c1)Cl)Cl WXVL_AK0874SB1110 [0,2,0,0,0,0|0,0,2]=4 747 B18R1.32363 O=C(O)C#CC(=O)NCCc1ccc(c(c1)Cl)Cl WXVL_AK0874SB1110 [0,2,0,0,0,0|0,0,2]=4 748 B18R1.32363 O=C(O)C#CC(=O)NCCc1ccc(c(c1)O)O WXVL_AK00493SB1110 [0,2,0,0,0,0|0,0,2]=4 749 B18R1.32363 O=C(O)C#CC(=O)NCCc1ccc(c(c1)O)O WXVL_AK00493SB1110 [0,2,0,0,0,0|0,0,2]=4 750 B18R1.32394 C/C(=C/C(=O)NCCc1ccc(cc1)Br)/C(=O)O WXVL_AK0745SB2187 [0,2,0,0,0,0|0,0,0]=2 751 B18R1.32394 C/C(=C/C(=O)NCCc1ccc(cc1)Br)/C(=O)O WXVL_AK0745SB2187 [0,2,0,0,0,0|0,0,0]=2 752 B18R1.32394 C/C(=C/C(=O)NCCc1ccc(cc1)C)/C(=O)O WXVL_AK0066SB2187 [0,2,0,0,0,0|0,0,0]=2 753 B18R1.32394 C/C(=C/C(=O)NCCc1ccc(cc1)C)/C(=O)O WXVL_AK0066SB2187 [0,2,0,0,0,0|0,0,0]=2 754 B18R1.32394 C/C(=C/C(=O)NCCc1ccc(cc1)Cl)/C(=O)O WXVL_AK1369SB2187 [0,2,0,0,0,0|0,0,0]=2 755 B18R1.32394 C/C(=C/C(=O)NCCc1ccc(cc1)Cl)/C(=O)O WXVL_AK1369SB2187 [0,2,0,0,0,0|0,0,0]=2 756 B18R1.32394 C/C(=C/C(=O)NCCc1ccc(cc1)F)/C(=O)O WXVL_AK0123SB2187 [0,2,0,0,0,0|0,0,0]=2 757 B18R1.32394 C/C(=C/C(=O)NCCc1ccc(cc1)F)/C(=O)O WXVL_AK0123SB2187 [0,2,0,0,0,0|0,0,0]=2 758 B18R1.32394 C/C(=C/C(=O)NCCc1ccc(cc1)O)/C(=O)O WXVL_AK0748SB2187 [0,2,0,0,0,0|0,0,0]=2 759 B18R1.32394 C/C(=C/C(=O)NCCc1ccc(cc1)O)/C(=O)O WXVL_AK0748SB2187 [0,2,0,0,0,0|0,0,0]=2 760 B18R1.32394 C/C(=C/C(=O)NCCc1ncc(cn1)C)/C(=O)O WXVL_AK00290SB2187 [0,2,0,0,0,0|2,0,0]=4 761 B18R1.32394 C/C(=C/C(=O)NCCc1ncc(cn1)C)/C(=O)O WXVL_AK00290SB2187 [0,2,0,0,0,0|2,0,0]=4 762 B18R1.1204 COC(=O)CCC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0069 [0,2,0,0,0,0|0,0,2]=4 763 B18R1.1204 COC(=O)CCC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0069 [0,2,0,0,0,0|0,0,2]=4 764 B18R1.1204 COC(=O)CCC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0069 [0,2,0,0,0,0|0,0,2]=4 765 B18R1.1204 COC(=O)CCC(=O)NCC(O)c1ccccc1 WXVL_AK0051SB0069 [0,2,0,0,0,0|0,0,2]=4 766 B18R1.1204 COC(=O)CCC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0069 [0,2,0,0,0,0|0,0,2]=4 767 B18R1.1204 COC(=O)CCC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0069 [0,2,0,0,0,0|0,0,2]=4 768 B18R1.4487 C/C(=C/C(=O)NCC(C)c1ccccc1)/C(=O)O WXVL_AK00546SB2187 [0,2,0,0,0,0|0,0,0]=2 769 B18R1.4487 C/C(=C/C(=O)NCC(C)c1ccccc1)/C(=O)O WXVL_AK00546SB2187 [0,2,0,0,0,0|0,0,0]=2 770 B18R1.4487 C/C(=C/C(=O)NCC(O)c1ccccc1)/C(=O)O WXVL_AK0051SB2187 [0,2,0,0,0,0|0,0,0]=2 771 B18R1.4487 C/C(=C/C(=O)NCC(O)c1ccccc1)/C(=O)O WXVL_AK0051SB2187 [0,2,0,0,0,0|0,0,0]=2 772 B18R1.4487 C/C(=C/C(=O)NC[C@@H](C)c1ccccc1)/C(=O)O WXVL_AK00506SB2187 [0,2,0,0,0,0|0,0,0]=2 773 B18R1.4487 C/C(=C/C(=O)NC[C@@H](C)c1ccccc1)/C(=O)O WXVL_AK00506SB2187 [0,2,0,0,0,0|0,0,0]=2 774 B18R1.5064 CN(CC(O)c1ccccc1)C(=O)C#CC(=O)O WXVL_AN3044SB1110 [0,2,0,0,0,0|0,0,2]=4 775 B18R1.5064 CN(CC(O)c1ccccc1)C(=O)C#CC(=O)O WXVL_AN3044SB1110 [0,2,0,0,0,0|0,0,2]=4 776 B18R1.17702 O=C(O)C#CC(=O)NCC(O)c1cccc(c1)O WXVL_AK00484SB1110 [0,2,0,0,0,0|0,0,2]=4 777 B18R1.17702 O=C(O)C#CC(=O)NCC(O)c1cccc(c1)O WXVL_AK00484SB1110 [0,2,0,0,0,0|0,0,2]=4 778 B18R1.21101 CC(O)(CNC(=O)C#CC(=O)O)c1ccccc1 WXVL_AK0159SB1110 [0,2,0,0,0,0|0,0,2]=4 779 B18R1.21101 CC(O)(CNC(=O)C#CC(=O)O)c1ccccc1 WXVL_AK0159SB1110 [0,2,0,0,0,0|0,0,2]=4 780 B18R1.718 O=C(O)C#CC(=O)N[C@H](CO)Cc1ccccc1 WXVL_AK00517SB1110 [0,2,0,0,0,0|0,0,2]=4 781 B18R1.718 O=C(O)C#CC(=O)N[C@H](CO)Cc1ccccc1 WXVL_AK00517SB1110 [0,2,0,0,0,0|0,0,2]=4 782 B18R1.17750 CC(Cc1cccc(c1)Br)NC(=O)C#CC(=O)O WXVL_AK4310SB1110 [0,2,0,0,0,0|0,0,2]=4 783 B18R1.17750 CC(Cc1cccc(c1)Br)NC(=O)C#CC(=O)O WXVL_AK4310SB1110 [0,2,0,0,0,0|0,0,2]=4 784 B18R1.17710 CN(CCc1cccc(c1)F)C(=O)C#CC(=O)O WXVL_AN5203SB1110 [0,2,0,0,0,0|0,0,2]=4 785 B18R1.17710 CN(CCc1cccc(c1)F)C(=O)C#CC(=O)O WXVL_AN5203SB1110 [0,2,0,0,0,0|0,0,2]=4 786 B18R1.17710 Cc1cccc(c1)CCN(C)C(=O)C#CC(=O)O WXVL_AN3025SB1110 [0,2,0,0,0,0|0,0,2]=4 787 B18R1.17710 Cc1cccc(c1)CCN(C)C(=O)C#CC(=O)O WXVL_AN3025SB1110 [0,2,0,0,0,0|0,0,2]=4 788 B18R1.10216 C/C(=C/C(=O)NCCc1ccccc1Br)/C(=O)O WXVL_AK0778SB2187 [0,2,0,0,0,0|0,0,0]=2 789 B18R1.10216 C/C(=C/C(=O)NCCc1ccccc1Br)/C(=O)O WXVL_AK0778SB2187 [0,2,0,0,0,0|0,0,0]=2 790 B18R1.10216 C/C(=C/C(=O)NCCc1ccccc1C)/C(=O)O WXVL_AK0254SB2187 [0,2,0,0,0,0|0,0,0]=2 791 B18R1.10216 C/C(=C/C(=O)NCCc1ccccc1C)/C(=O)O WXVL_AK0254SB2187 [0,2,0,0,0,0|0,0,0]=2 792 B18R1.10216 C/C(=C/C(=O)NCCc1ccccc1Cl)/C(=O)O WXVL_AK0715SB2187 [0,2,0,0,0,0|0,0,0]=2 793 B18R1.10216 C/C(=C/C(=O)NCCc1ccccc1Cl)/C(=O)O WXVL_AK0715SB2187 [0,2,0,0,0,0|0,0,0]=2 794 B18R1.10216 C/C(=C/C(=O)NCCc1ccccc1F)/C(=O)O WXVL_AK0118SB2187 [0,2,0,0,0,0|0,0,0]=2 795 B18R1.10216 C/C(=C/C(=O)NCCc1ccccc1F)/C(=O)O WXVL_AK0118SB2187 [0,2,0,0,0,0|0,0,0]=2 796 B18R1.10216 C/C(=C/C(=O)NCCc1ccccc1O)/C(=O)O WXVL_AK2884SB2187 [0,2,0,0,0,0|0,0,0]=2 797 B18R1.10216 C/C(=C/C(=O)NCCc1ccccc1O)/C(=O)O WXVL_AK2884SB2187 [0,2,0,0,0,0|0,0,0]=2 798 B18R1.10370 O=C(O)C#CC(=O)NCCc1cc(ccc1Cl)Cl WXVL_AK0419SB1110 [0,2,0,0,0,0|0,0,2]=4 799 B18R1.10370 O=C(O)C#CC(=O)NCCc1cc(ccc1Cl)Cl WXVL_AK0419SB1110 [0,2,0,0,0,0|0,0,2]=4 800 B18R1.17776 O=C(O)C#CC(=O)NCCc1c(cccc1Cl)Cl WXVL_AK0905SB1110 [0,2,0,0,0,0|0,0,2]=4 801 B18R1.17776 O=C(O)C#CC(=O)NCCc1c(cccc1Cl)Cl WXVL_AK0905SB1110 [0,2,0,0,0,0|0,0,2]=4 802 B18R1.17776 O=C(O)C#CC(=O)NCCc1c(cccc1Cl)F WXVL_AK0192SB1110 [0,2,0,0,0,0|0,0,2]=4 803 B18R1.17776 O=C(O)C#CC(=O)NCCc1c(cccc1Cl)F WXVL_AK0192SB1110 [0,2,0,0,0,0|0,0,2]=4 804 B18R1.34040 COC(=O)CCC(=O)NCCc1ccccc1Br WXVL_AK0778SB0069 [0,2,0,0,0,0|0,0,2]=4 805 B18R1.34040 COC(=O)CCC(=O)NCCc1ccccc1Br WXVL_AK0778SB0069 [0,2,0,0,0,0|0,0,2]=4 806 B18R1.34040 COC(=O)CCC(=O)NCCc1ccccc1C WXVL_AK0254SB0069 [0,2,0,0,0,0|0,0,2]=4 807 B18R1.34040 COC(=O)CCC(=O)NCCc1ccccc1C WXVL_AK0254SB0069 [0,2,0,0,0,0|0,0,2]=4 808 B18R1.34040 COC(=O)CCC(=O)NCCc1ccccc1Cl WXVL_AK0715SB0069 [0,2,0,0,0,0|0,0,2]=4 809 B18R1.34040 COC(=O)CCC(=O)NCCc1ccccc1Cl WXVL_AK0715SB0069 [0,2,0,0,0,0|0,0,2]=4 810 B18R1.34040 COC(=O)CCC(=O)NCCc1ccccc1F WXVL_AK0118SB0069 [0,2,0,0,0,0|0,0,2]=4 811 B18R1.34040 COC(=O)CCC(=O)NCCc1ccccc1F WXVL_AK0118SB0069 [0,2,0,0,0,0|0,0,2]=4 812 B18R1.34040 COC(=O)CCC(=O)NCCc1ccccc1O WXVL_AK2884SB0069 [0,2,0,0,0,0|0,0,2]=4 813 B18R1.34040 COC(=O)CCC(=O)NCCc1ccccc1O WXVL_AK2884SB0069 [0,2,0,0,0,0|0,0,2]=4 814 B18R1.37991 COc1ccccc1CCNC(=O)C#CC(=O)O WXVL_AK00321SB1110 [0,2,0,0,0,0|0,0,2]=4 815 B18R1.37991 COc1ccccc1CCNC(=O)C#CC(=O)O WXVL_AK00321SB1110 [0,2,0,0,0,0|0,0,2]=4 816 B18R1.9175 O=C(O)C#CC(=O)NCCc1cc(cc(c1)Cl)Cl WXVL_AK2851SB1110 [0,2,0,0,0,0|0,0,2]=4 817 B18R1.9175 O=C(O)C#CC(=O)NCCc1cc(cc(c1)Cl)Cl WXVL_AK2851SB1110 [0,2,0,0,0,0|0,0,2]=4 818 B18R1.9964 C/C(=C/C(=O)NCCc1cccc(c1)Br)/C(=O)O WXVL_AK0800SB2187 [0,2,0,0,0,0|0,0,0]=2 819 B18R1.9964 C/C(=C/C(=O)NCCc1cccc(c1)Br)/C(=O)O WXVL_AK0800SB2187 [0,2,0,0,0,0|0,0,0]=2 820 B18R1.9964 C/C(=C/C(=O)NCCc1cccc(c1)C)/C(=O)O WXVL_AK8219SB2187 [0,2,0,0,0,0|0,0,0]=2 821 B18R1.9964 C/C(=C/C(=O)NCCc1cccc(c1)C)/C(=O)O WXVL_AK8219SB2187 [0,2,0,0,0,0|0,0,0]=2 822 B18R1.9964 C/C(=C/C(=O)NCCc1cccc(c1)Cl)/C(=O)O WXVL_AK0776SB2187 [0,2,0,0,0,0|0,0,0]=2 823 B18R1.9964 C/C(=C/C(=O)NCCc1cccc(c1)Cl)/C(=O)O WXVL_AK0776SB2187 [0,2,0,0,0,0|0,0,0]=2 824 B18R1.9964 C/C(=C/C(=O)NCCc1cccc(c1)F)/C(=O)O WXVL_AK0117SB2187 [0,2,0,0,0,0|0,0,0]=2 825 B18R1.9964 C/C(=C/C(=O)NCCc1cccc(c1)F)/C(=O)O WXVL_AK0117SB2187 [0,2,0,0,0,0|0,0,0]=2 826 B18R1.9964 C/C(=C/C(=O)NCCc1cccc(c1)O)/C(=O)O WXVL_AK00421SB2187 [0,2,0,0,0,0|0,0,0]=2 827 B18R1.9964 C/C(=C/C(=O)NCCc1cccc(c1)O)/C(=O)O WXVL_AK00421SB2187 [0,2,0,0,0,0|0,0,0]=2 828 B18R1.37838 COC(=O)CCC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB0069 [0,2,0,0,0,0|0,0,2]=4 829 B18R1.37838 COC(=O)CCC(=O)NCCc1cccc(c1)Br WXVL_AK0800SB0069 [0,2,0,0,0,0|0,0,2]=4 830 B18R1.37838 COC(=O)CCC(=O)NCCc1cccc(c1)C WXVL_AK8219SB0069 [0,2,0,0,0,0|0,0,2]=4 831 B18R1.37838 COC(=O)CCC(=O)NCCc1cccc(c1)C WXVL_AK8219SB0069 [0,2,0,0,0,0|0,0,2]=4 832 B18R1.37838 COC(=O)CCC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB0069 [0,2,0,0,0,0|0,0,2]=4 833 B18R1.37838 COC(=O)CCC(=O)NCCc1cccc(c1)Cl WXVL_AK0776SB0069 [0,2,0,0,0,0|0,0,2]=4 834 B18R1.37838 COC(=O)CCC(=O)NCCc1cccc(c1)F WXVL_AK0117SB0069 [0,2,0,0,0,0|0,0,2]=4 835 B18R1.37838 COC(=O)CCC(=O)NCCc1cccc(c1)F WXVL_AK0117SB0069 [0,2,0,0,0,0|0,0,2]=4 836 B18R1.37838 COC(=O)CCC(=O)NCCc1cccc(c1)O WXVL_AK00421SB0069 [0,2,0,0,0,0|0,0,2]=4 837 B18R1.37838 COC(=O)CCC(=O)NCCc1cccc(c1)O WXVL_AK00421SB0069 [0,2,0,0,0,0|0,0,2]=4 838 B18R1.39728 COc1cccc(c1)CCNC(=O)C#CC(=O)O WXVL_AK0065SB1110 [0,2,0,0,0,0|0,0,2]=4 839 B18R1.39728 COc1cccc(c1)CCNC(=O)C#CC(=O)O WXVL_AK0065SB1110 [0,2,0,0,0,0|0,0,2]=4 840 B18R1.2149 COC(=O)[C@H](C)NC(=O)NCCc1ccccc1 WXVL_AK00498YV0164 [0,2,0,0,0,0|1,0,1]=4 841 B18R1.2149 COC(=O)[C@H](C)NC(=O)NCCc1ccccc1 WXVL_AK00498YV0164 [0,2,0,0,0,0|1,0,1]=4 842 B18R1.43609 CCOC(=O)/C=C/C(=O)NCCc1ccccc1 WXVL_AK00498SB0061 [0,2,0,0,0,0|0,0,0]=2 843 B18R1.43609 CCOC(=O)/C=C/C(=O)NCCc1ccccc1 WXVL_AK00498SB0061 [0,2,0,0,0,0|0,0,0]=2 844 B18R1.43609 CCOC(=O)/C=C/C(=O)NCCc1ccccn1 WXVL_AK0019SB0061 [0,2,0,0,0,0|1,0,0]=3 845 B18R1.43609 CCOC(=O)/C=C/C(=O)NCCc1ccccn1 WXVL_AK0019SB0061 [0,2,0,0,0,0|1,0,0]=3 846 B18R1.43609 CCOC(=O)/C=C/C(=O)NCCc1cccnc1 WXVL_AK00436SB0061 [0,2,0,0,0,0|1,0,0]=3 847 B18R1.43609 CCOC(=O)/C=C/C(=O)NCCc1cccnc1 WXVL_AK00436SB0061 [0,2,0,0,0,0|1,0,0]=3 848 B18R1.43609 CCOC(=O)/C=C/C(=O)NCCc1ccncc1 WXVL_AK0093SB0061 [0,2,0,0,0,0|1,0,0]=3 849 B18R1.43609 CCOC(=O)/C=C/C(=O)NCCc1ccncc1 WXVL_AK0093SB0061 [0,2,0,0,0,0|1,0,0]=3 850 B18R1.43609 CCOC(=O)/C=C/C(=O)NCCc1ccncn1 WXVL_AK6509SB0061 [0,2,0,0,0,0|2,0,0]=4 851 B18R1.43609 CCOC(=O)/C=C/C(=O)NCCc1ccncn1 WXVL_AK6509SB0061 [0,2,0,0,0,0|2,0,0]=4 852 B18R1.43609 CCOC(=O)CNC(=O)NCCc1ccccc1 WXVL_AK00498YV0151 [0,2,0,0,0,0|1,0,1]=4 853 B18R1.43609 CCOC(=O)CNC(=O)NCCc1ccccc1 WXVL_AK00498YV0151 [0,2,0,0,0,0|1,0,1]=4 854 B18R2.11 O=C(O)C#CC(=O)NC1CCc2c1cccc2 WXVL_AK1156SB1110 [0,0,0,1,0,1|0,0,2]=4 855 B18R2.11 O=C(O)C#CC(=O)NC1CCc2c1cccc2 WXVL_AK1156SB1110 [0,0,0,1,0,1|0,0,2]=4 856 B18R2.11 O=C(O)C#CC(=O)NC1COc2c1cccc2 WXVL_AK2368SB1110 [0,0,0,1,0,1|0,0,2]=4 857 B18R2.11 O=C(O)C#CC(=O)NC1COc2c1cccc2 WXVL_AK2368SB1110 [0,0,0,1,0,1|0,0,2]=4 858 B18R2.11 O=C(O)C#CC(=O)N[C@H]1CCc2c1cccc2 WXVL_AK00474SB1110 [0,0,0,1,0,1|0,0,2]=4 859 B18R2.11 O=C(O)C#CC(=O)N[C@H]1CCc2c1cccc2 WXVL_AK00474SB1110 [0,0,0,1,0,1|0,0,2]=4 860 B18R2.14643 O=C(O)C#CC(=O)N1CCC1c2ccccc2 WXVL_AN3661SB1110 [0,0,0,1,0,1|0,0,2]=4 861 B18R2.3732 Cc1c[nH]c(c1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0830 [0,0,0,1,0,1|2,0,0]=4 862 B18R2.3732 Cc1c[nH]c(c1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0830 [0,0,0,1,0,1|2,0,0]=4 863 B18R2.3732 Cc1cc(c[nH]1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0298 [0,0,0,1,0,1|2,0,0]=4 864 B18R2.3732 Cc1cc(c[nH]1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0298 [0,0,0,1,0,1|2,0,0]=4 865 B18R2.3732 Cc1ccc(o1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0005 [0,0,0,1,0,1|1,0,0]=3 866 B18R2.3732 Cc1ccc(o1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0005 [0,0,0,1,0,1|1,0,0]=3 867 B18R2.3732 Cc1ccc(o1)C(=O)NCCc2ccccn2 WXVL_AK0019SC0005 [0,0,0,1,0,1|2,0,0]=4 868 B18R2.3732 Cc1ccc(o1)C(=O)NCCc2ccccn2 WXVL_AK0019SC0005 [0,0,0,1,0,1|2,0,0]=4 869 B18R2.3732 Cc1ccc(o1)C(=O)NCCc2cccnc2 WXVL_AK00436SC0005 [0,0,0,1,0,1|2,0,0]=4 870 B18R2.3732 Cc1ccc(o1)C(=O)NCCc2cccnc2 WXVL_AK00436SC0005 [0,0,0,1,0,1|2,0,0]=4 871 B18R2.3732 Cc1ccc(o1)C(=O)NCCc2ccncc2 WXVL_AK0093SC0005 [0,0,0,1,0,1|2,0,0]=4 872 B18R2.3732 Cc1ccc(o1)C(=O)NCCc2ccncc2 WXVL_AK0093SC0005 [0,0,0,1,0,1|2,0,0]=4 873 B18R2.3732 Cc1ccc(s1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0053 [0,0,0,1,0,1|1,1,0]=4 874 B18R2.3732 Cc1ccc(s1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0053 [0,0,0,1,0,1|1,1,0]=4 875 B18R2.3732 Cc1cnc(s1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0031 [0,0,0,1,0,1|1,1,0]=4 876 B18R2.3732 Cc1cnc(s1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0031 [0,0,0,1,0,1|1,1,0]=4 877 B18R2.3732 Cc1csc(c1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0004 [0,0,0,1,0,1|2,0,0]=4 878 B18R2.3732 Cc1csc(c1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0004 [0,0,0,1,0,1|2,0,0]=4 879 B18R2.3732 Cc1csc(n1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0538 [0,0,0,1,0,1|2,0,0]=4 880 B18R2.3732 Cc1csc(n1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0538 [0,0,0,1,0,1|2,0,0]=4 881 B18R2.3732 Cc1nc(c[nH]1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0009 [0,0,0,1,0,1|2,0,0]=4 882 B18R2.3732 Cc1nc(c[nH]1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0009 [0,0,0,1,0,1|2,0,0]=4 883 B18R2.3732 Cc1nc(co1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0086 [0,0,0,1,0,1|2,0,0]=4 884 B18R2.3732 Cc1nc(co1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0086 [0,0,0,1,0,1|2,0,0]=4 885 B18R2.3732 Cc1nc(cs1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0112 [0,0,0,1,0,1|2,0,0]=4 886 B18R2.3732 Cc1nc(cs1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0112 [0,0,0,1,0,1|2,0,0]=4 887 B18R2.3732 Cc1ncc(s1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0326 [0,0,0,1,0,1|1,1,0]=4 888 B18R2.3732 Cc1ncc(s1)C(=O)NCCc2ccccc2 WXVL_AK00498SC0326 [0,0,0,1,0,1|1,1,0]=4 889 B18R2.3732 O=C(NCCc1ccccc1)c2cc(c[nH]2)Br WXVL_AK00498SC0644 [0,0,0,1,0,1|2,0,0]=4 890 B18R2.3732 O=C(NCCc1ccccc1)c2cc(c[nH]2)Br WXVL_AK00498SC0644 [0,0,0,1,0,1|2,0,0]=4 891 B18R2.3732 O=C(NCCc1ccccc1)c2cc(c[nH]2)F WXVL_AK00498SC0334 [0,0,0,1,0,1|2,0,0]=4 892 B18R2.3732 O=C(NCCc1ccccc1)c2cc(c[nH]2)F WXVL_AK00498SC0334 [0,0,0,1,0,1|2,0,0]=4 893 B18R2.3732 O=C(NCCc1ccccc1)c2cc(cs2)Br WXVL_AK00498SC0188 [0,0,0,1,0,1|2,0,0]=4 894 B18R2.3732 O=C(NCCc1ccccc1)c2cc(cs2)Br WXVL_AK00498SC0188 [0,0,0,1,0,1|2,0,0]=4 895 B18R2.3732 O=C(NCCc1ccccc1)c2cc(no2)O WXVL_AK00498SC0522 [0,0,0,1,0,1|2,0,0]=4 896 B18R2.3732 O=C(NCCc1ccccc1)c2cc(no2)O WXVL_AK00498SC0522 [0,0,0,1,0,1|2,0,0]=4 897 B18R2.3732 O=C(NCCc1ccccc1)c2ccc(o2)Cl WXVL_AK00498SC0926 [0,0,0,1,0,1|1,0,0]=3 898 B18R2.3732 O=C(NCCc1ccccc1)c2ccc(o2)Cl WXVL_AK00498SC0926 [0,0,0,1,0,1|1,0,0]=3 899 B18R2.3732 O=C(NCCc1ccccc1)c2ccc(s2)Br WXVL_AK00498SC0359 [0,0,0,1,0,1|1,1,0]=4 900 B18R2.3732 O=C(NCCc1ccccc1)c2ccc(s2)Br WXVL_AK00498SC0359 [0,0,0,1,0,1|1,1,0]=4 901 B18R2.3732 O=C(NCCc1ccccc1)c2ccc(s2)Cl WXVL_AK00498SC0067 [0,0,0,1,0,1|1,1,0]=4 902 B18R2.3732 O=C(NCCc1ccccc1)c2ccc(s2)Cl WXVL_AK00498SC0067 [0,0,0,1,0,1|1,1,0]=4 903 B18R2.3732 O=C(NCCc1ccccc1)c2cnc([nH]2)O WXVL_AK00498SC0498 [0,0,0,1,0,1|1,0,0]=3 904 B18R2.3732 O=C(NCCc1ccccc1)c2cnc([nH]2)O WXVL_AK00498SC0498 [0,0,0,1,0,1|1,0,0]=3 905 B18R2.3732 O=C(NCCc1ccccc1)c2cnc(o2)Br WXVL_AK00498SC0815 [0,0,0,1,0,1|1,0,0]=3 906 B18R2.3732 O=C(NCCc1ccccc1)c2cnc(o2)Br WXVL_AK00498SC0815 [0,0,0,1,0,1|1,0,0]=3 907 B18R2.3732 O=C(NCCc1ccccc1)c2cnc(s2)Br WXVL_AK00498SC0723 [0,0,0,1,0,1|1,1,0]=4 908 B18R2.3732 O=C(NCCc1ccccc1)c2cnc(s2)Br WXVL_AK00498SC0723 [0,0,0,1,0,1|1,1,0]=4 909 B18R2.3732 O=C(NCCc1ccccc1)c2cnc(s2)Cl WXVL_AK00498SC0638 [0,0,0,1,0,1|1,1,0]=4 910 B18R2.3732 O=C(NCCc1ccccc1)c2cnc(s2)Cl WXVL_AK00498SC0638 [0,0,0,1,0,1|1,1,0]=4 911 B18R2.3732 O=C(NCCc1ccccc1)c2coc(n2)Cl WXVL_AK00498SC1341 [0,0,0,1,0,1|2,0,0]=4 912 B18R2.3732 O=C(NCCc1ccccc1)c2coc(n2)Cl WXVL_AK00498SC1341 [0,0,0,1,0,1|2,0,0]=4 913 B18R2.3732 O=C(NCCc1ccccc1)c2csc(c2)Br WXVL_AK00498SC0189 [0,0,0,1,0,1|2,0,0]=4 914 B18R2.3732 O=C(NCCc1ccccc1)c2csc(c2)Br WXVL_AK00498SC0189 [0,0,0,1,0,1|2,0,0]=4 915 B18R2.3732 O=C(NCCc1ccccc1)c2csc(n2)Cl WXVL_AK00498SC0688 [0,0,0,1,0,1|2,0,0]=4 916 B18R2.3732 O=C(NCCc1ccccc1)c2csc(n2)Cl WXVL_AK00498SC0688 [0,0,0,1,0,1|2,0,0]=4 917 B18R2.3732 O=C(NCCc1ccccc1)c2nc(cs2)Br WXVL_AK00498SC0687 [0,0,0,1,0,1|2,0,0]=4 918 B18R2.3732 O=C(NCCc1ccccc1)c2nc(cs2)Br WXVL_AK00498SC0687 [0,0,0,1,0,1|2,0,0]=4 919 B18R2.3732 O=C(NCCc1ccccn1)c2ccc(o2)Cl WXVL_AK0019SC0926 [0,0,0,1,0,1|2,0,0]=4 920 B18R2.3732 O=C(NCCc1ccccn1)c2ccc(o2)Cl WXVL_AK0019SC0926 [0,0,0,1,0,1|2,0,0]=4 921 B18R2.3732 O=C(NCCc1ccccn1)c2cnc([nH]2)O WXVL_AK0019SC0498 [0,0,0,1,0,1|2,0,0]=4 922 B18R2.3732 O=C(NCCc1ccccn1)c2cnc([nH]2)O WXVL_AK0019SC0498 [0,0,0,1,0,1|2,0,0]=4 923 B18R2.3732 O=C(NCCc1ccccn1)c2cnc(o2)Br WXVL_AK0019SC0815 [0,0,0,1,0,1|2,0,0]=4 924 B18R2.3732 O=C(NCCc1ccccn1)c2cnc(o2)Br WXVL_AK0019SC0815 [0,0,0,1,0,1|2,0,0]=4 925 B18R2.3732 O=C(NCCc1cccnc1)c2ccc(o2)Cl WXVL_AK00436SC0926 [0,0,0,1,0,1|2,0,0]=4 926 B18R2.3732 O=C(NCCc1cccnc1)c2ccc(o2)Cl WXVL_AK00436SC0926 [0,0,0,1,0,1|2,0,0]=4 927 B18R2.3732 O=C(NCCc1cccnc1)c2cnc([nH]2)O WXVL_AK00436SC0498 [0,0,0,1,0,1|2,0,0]=4 928 B18R2.3732 O=C(NCCc1cccnc1)c2cnc([nH]2)O WXVL_AK00436SC0498 [0,0,0,1,0,1|2,0,0]=4 929 B18R2.3732 O=C(NCCc1cccnc1)c2cnc(o2)Br WXVL_AK00436SC0815 [0,0,0,1,0,1|2,0,0]=4 930 B18R2.3732 O=C(NCCc1cccnc1)c2cnc(o2)Br WXVL_AK00436SC0815 [0,0,0,1,0,1|2,0,0]=4 931 B18R2.3732 O=C(NCCc1ccncc1)c2ccc(o2)Cl WXVL_AK0093SC0926 [0,0,0,1,0,1|2,0,0]=4 932 B18R2.3732 O=C(NCCc1ccncc1)c2ccc(o2)Cl WXVL_AK0093SC0926 [0,0,0,1,0,1|2,0,0]=4 933 B18R2.3732 O=C(NCCc1ccncc1)c2cnc([nH]2)O WXVL_AK0093SC0498 [0,0,0,1,0,1|2,0,0]=4 934 B18R2.3732 O=C(NCCc1ccncc1)c2cnc([nH]2)O WXVL_AK0093SC0498 [0,0,0,1,0,1|2,0,0]=4 935 B18R2.3732 O=C(NCCc1ccncc1)c2cnc(o2)Br WXVL_AK0093SC0815 [0,0,0,1,0,1|2,0,0]=4 936 B18R2.3732 O=C(NCCc1ccncc1)c2cnc(o2)Br WXVL_AK0093SC0815 [0,0,0,1,0,1|2,0,0]=4 937 B18R2.3732 O=C1NC[C@H](O1)C(=O)NCCc2ccccc2 WXVL_AK00498SBF634 [0,0,0,1,0,1|0,0,2]=4 938 B18R2.3732 O=C1NC[C@H](O1)C(=O)NCCc2ccccc2 WXVL_AK00498SBF634 [0,0,0,1,0,1|0,0,2]=4 939 B18R2.14644 O=C(O)C#CC(=O)N1CCc2ccccc2C1 WXVL_AN00480SB1110 [0,1,0,1,0,0|0,0,2]=4 940 B18R2.14644 O=C(O)C#CC(=O)N1CCc2ccccc2C1 WXVL_AN00480SB1110 [0,1,0,1,0,0|0,0,2]=4 941 B14R1.156 O=C(/C=C/CBr)NCc1ccccc1 WXVL_AK00502SB0424 [1,0,0,0,1,0|1,0,1]=4 942 B14R1.156 O=C(/C=C/CBr)NCc1ccccc1 WXVL_AK00502SB0424 [1,0,0,0,1,0|1,0,1]=4 943 B14R1.423 O=C(O)C#CC(=O)Nc1ccccc1 WXVL_AG00183SB1110 [0,0,0,0,2,0|0,0,2]=4 944 B14R1.423 O=C(O)C#CC(=O)Nc1ccccc1 WXVL_AG00183SB1110 [0,0,0,0,2,0|0,0,2]=4 945 B14R1.818 CC(=CC(=O)NCc1ccccc1)C WXVL_AK00502SB0342 [0,0,0,0,2,0|2,0,0]=4 946 B14R1.818 CC(=CC(=O)NCc1ccccc1)C WXVL_AK00502SB0342 [0,0,0,0,2,0|2,0,0]=4 947 B14R1.6449 C=C(F)C(=O)NCCc1ccccc1 WXVL_AK00498SB1376 [0,0,0,0,2,0|2,0,0]=4 948 B14R1.6449 C=C(F)C(=O)NCCc1ccccc1 WXVL_AK00498SB1376 [0,0,0,0,2,0|2,0,0]=4 949 B14R1.6449 CC(=O)C(=O)NCCc1ccccc1 WXVL_AK00498SB0051 [0,0,0,0,2,0|1,0,0]=3 950 B14R1.6449 CC(=O)C(=O)NCCc1ccccc1 WXVL_AK00498SB0051 [0,0,0,0,2,0|1,0,0]=3 951 B14R1.6449 CC(=O)C(=O)NCCc1ccccn1 WXVL_AK0019SB0051 [0,0,0,0,2,0|2,0,0]=4 952 B14R1.6449 CC(=O)C(=O)NCCc1ccccn1 WXVL_AK0019SB0051 [0,0,0,0,2,0|2,0,0]=4 953 B14R1.6449 CC(=O)C(=O)NCCc1cccnc1 WXVL_AK00436SB0051 [0,0,0,0,2,0|2,0,0]=4 954 B14R1.6449 CC(=O)C(=O)NCCc1cccnc1 WXVL_AK00436SB0051 [0,0,0,0,2,0|2,0,0]=4 955 B14R1.6449 CC(=O)C(=O)NCCc1ccncc1 WXVL_AK0093SB0051 [0,0,0,0,2,0|2,0,0]=4 956 B14R1.6449 CC(=O)C(=O)NCCc1ccncc1 WXVL_AK0093SB0051 [0,0,0,0,2,0|2,0,0]=4 957 B14R1.6449 C[C@@H](O)C(=O)NCCc1ccccc1 WXVL_AK00498SB1085 [0,0,0,0,2,0|1,0,1]=4 958 B14R1.6449 C[C@@H](O)C(=O)NCCc1ccccc1 WXVL_AK00498SB1085 [0,0,0,0,2,0|1,0,1]=4 959 B14R1.6449 NC(=O)C(=O)NCCc1ccccc1 WXVL_AK00498SB0128 [0,0,0,0,2,0|1,0,0]=3 960 B14R1.6449 NC(=O)C(=O)NCCc1ccccc1 WXVL_AK00498SB0128 [0,0,0,0,2,0|1,0,0]=3 961 B14R1.6449 NC(=O)C(=O)NCCc1ccccn1 WXVL_AK0019SB0128 [0,0,0,0,2,0|2,0,0]=4 962 B14R1.6449 NC(=O)C(=O)NCCc1ccccn1 WXVL_AK0019SB0128 [0,0,0,0,2,0|2,0,0]=4 963 B14R1.6449 NC(=O)C(=O)NCCc1cccnc1 WXVL_AK00436SB0128 [0,0,0,0,2,0|2,0,0]=4 964 B14R1.6449 NC(=O)C(=O)NCCc1cccnc1 WXVL_AK00436SB0128 [0,0,0,0,2,0|2,0,0]=4 965 B14R1.6449 NC(=O)C(=O)NCCc1ccncc1 WXVL_AK0093SB0128 [0,0,0,0,2,0|2,0,0]=4 966 B14R1.6449 NC(=O)C(=O)NCCc1ccncc1 WXVL_AK0093SB0128 [0,0,0,0,2,0|2,0,0]=4 967 B16R1.1465 O=C(/C=C/CBr)NCCCc1ccccc1 WXVL_AK0074SB0424 [1,0,0,0,0,1|1,0,1]=4 968 B16R1.1465 O=C(/C=C/CBr)NCCCc1ccccc1 WXVL_AK0074SB0424 [1,0,0,0,0,1|1,0,1]=4 969 B16R1.1465 O=C(/C=C/CBr)NCCNc1ccccc1 WXVL_AK2478SB0424 [1,0,0,0,0,1|1,0,1]=4 970 B16R1.1465 O=C(/C=C/CBr)NCCNc1ccccc1 WXVL_AK2478SB0424 [1,0,0,0,0,1|1,0,1]=4 971 B16R1.1465 O=C(/C=C/CBr)NCCOc1ccccc1 WXVL_AK0103SB0424 [1,0,0,0,0,1|1,0,1]=4 972 B16R1.1465 O=C(/C=C/CBr)NCCOc1ccccc1 WXVL_AK0103SB0424 [1,0,0,0,0,1|1,0,1]=4 973 B18R1.5072 O=C(O)C#CC(=O)NCCCCc1ccccc1 WXVL_AK00516SB1110 [0,0,0,0,0,2|0,0,2]=4 974 B18R1.5072 O=C(O)C#CC(=O)NCCCCc1ccccc1 WXVL_AK00516SB1110 [0,0,0,0,0,2|0,0,2]=4 975 B18R1.5072 O=C(O)C#CC(=O)NCCCOc1ccccc1 WXVL_AK2366SB1110 [0,0,0,0,0,2|0,0,2]=4 976 B18R1.5072 O=C(O)C#CC(=O)NCCCOc1ccccc1 WXVL_AK2366SB1110 [0,0,0,0,0,2|0,0,2]=4 977 B18R1.5072 O=C(O)C#CC(=O)NCCOCc1ccccc1 WXVL_AK1105SB1110 [0,0,0,0,0,2|0,0,2]=4 978 B18R1.5072 O=C(O)C#CC(=O)NCCOCc1ccccc1 WXVL_AK1105SB1110 [0,0,0,0,0,2|0,0,2]=4