0 B14R1.158 C#CCCNC(=O)Cc1ccccc1 WXVL_AK3109SB0092 [0,0,0,0,0,0|2,0,2]=4 1 B14R1.158 C#CCCNC(=O)Cc1ccccc1 WXVL_AK3109SB0092 [0,0,0,0,0,0|2,0,2]=4 2 B14R1.158 C=CCCNC(=O)Cc1ccccc1 WXVL_AK00138SB0092 [0,0,0,0,0,0|2,0,2]=4 3 B14R1.158 C=CCCNC(=O)Cc1ccccc1 WXVL_AK00138SB0092 [0,0,0,0,0,0|2,0,2]=4 4 B14R1.158 CCCCNC(=O)Cc1ccccc1 WXVL_AK00588SB0092 [0,0,0,0,0,0|2,0,1]=3 5 B14R1.158 CCCCNC(=O)Cc1ccccc1 WXVL_AK00588SB0092 [0,0,0,0,0,0|2,0,1]=3 6 B14R1.158 CCCCNC(=O)Cc1ccccn1 WXVL_AK00588SA0032 [0,0,0,0,0,0|3,0,1]=4 7 B14R1.158 CCCCNC(=O)Cc1ccccn1 WXVL_AK00588SA0032 [0,0,0,0,0,0|3,0,1]=4 8 B14R1.158 CCCCNC(=O)Cc1cccnc1 WXVL_AK00588SA0029 [0,0,0,0,0,0|3,0,1]=4 9 B14R1.158 CCCCNC(=O)Cc1cccnc1 WXVL_AK00588SA0029 [0,0,0,0,0,0|3,0,1]=4 10 B14R1.158 CCCCNC(=O)Cc1cccnc1 WXVL_AK00588SB00049 [0,0,0,0,0,0|3,0,1]=4 11 B14R1.158 CCCCNC(=O)Cc1cccnc1 WXVL_AK00588SB00049 [0,0,0,0,0,0|3,0,1]=4 12 B14R1.158 CCCCNC(=O)Cc1ccncc1 WXVL_AK00588SA00106 [0,0,0,0,0,0|3,0,1]=4 13 B14R1.158 CCCCNC(=O)Cc1ccncc1 WXVL_AK00588SA00106 [0,0,0,0,0,0|3,0,1]=4 14 B14R1.158 CSCCNC(=O)Cc1ccccc1 WXVL_AK00440SB0092 [0,0,0,0,0,0|3,0,1]=4 15 B14R1.158 CSCCNC(=O)Cc1ccccc1 WXVL_AK00440SB0092 [0,0,0,0,0,0|3,0,1]=4 16 B14R1.158 N#CCCNC(=O)Cc1ccccc1 WXVL_AK0087SB0092 [0,0,0,0,0,0|2,0,2]=4 17 B14R1.158 N#CCCNC(=O)Cc1ccccc1 WXVL_AK0087SB0092 [0,0,0,0,0,0|2,0,2]=4 18 B14R1.158 O=C(CCCCCl)Nc1ccccc1 WXVL_AG00183SB0379 [0,0,0,0,0,0|3,0,1]=4 19 B14R1.158 O=C(CCCCCl)Nc1ccccc1 WXVL_AG00183SB0379 [0,0,0,0,0,0|3,0,1]=4 20 B14R1.158 O=C(Cc1ccccc1)NCCCO WXVL_AK0073SB0092 [0,0,0,0,0,0|2,0,1]=3 21 B14R1.158 O=C(Cc1ccccc1)NCCCO WXVL_AK0073SB0092 [0,0,0,0,0,0|2,0,1]=3 22 B14R1.158 O=C(Cc1ccccn1)NCCCO WXVL_AK0073SA0032 [0,0,0,0,0,0|3,0,1]=4 23 B14R1.158 O=C(Cc1ccccn1)NCCCO WXVL_AK0073SA0032 [0,0,0,0,0,0|3,0,1]=4 24 B14R1.158 O=C(Cc1cccnc1)NCCCO WXVL_AK0073SA0029 [0,0,0,0,0,0|3,0,1]=4 25 B14R1.158 O=C(Cc1cccnc1)NCCCO WXVL_AK0073SA0029 [0,0,0,0,0,0|3,0,1]=4 26 B14R1.158 O=C(Cc1cccnc1)NCCCO WXVL_AK0073SB00049 [0,0,0,0,0,0|3,0,1]=4 27 B14R1.158 O=C(Cc1cccnc1)NCCCO WXVL_AK0073SB00049 [0,0,0,0,0,0|3,0,1]=4 28 B14R1.158 O=C(Cc1ccncc1)NCCCO WXVL_AK0073SA00106 [0,0,0,0,0,0|3,0,1]=4 29 B14R1.158 O=C(Cc1ccncc1)NCCCO WXVL_AK0073SA00106 [0,0,0,0,0,0|3,0,1]=4 30 B14R1.158 O=C(NCCCCl)Nc1ccccc1 WXVL_AG00183YV0130 [0,0,0,0,0,0|2,0,1]=3 31 B14R1.158 O=C(NCCCCl)Nc1ccccc1 WXVL_AG00183YV0130 [0,0,0,0,0,0|2,0,1]=3 32 B14R1.158 O=C(NCCCCl)Nc1ccccn1 WXVL_AF00298YV0130 [0,0,0,0,0,0|3,0,1]=4 33 B14R1.158 O=C(NCCCCl)Nc1ccccn1 WXVL_AF00298YV0130 [0,0,0,0,0,0|3,0,1]=4 34 B13R1.44 CCCNC(=O)Cc1ccccc1 WXVL_AK00504SB0092 [1,0,0,0,0,0|1,0,1]=3 35 B13R1.44 CCCNC(=O)Cc1ccccc1 WXVL_AK00504SB0092 [1,0,0,0,0,0|1,0,1]=3 36 B13R1.44 CCCNC(=O)Cc1ccccn1 WXVL_AK00504SA0032 [1,0,0,0,0,0|2,0,1]=4 37 B13R1.44 CCCNC(=O)Cc1ccccn1 WXVL_AK00504SA0032 [1,0,0,0,0,0|2,0,1]=4 38 B13R1.44 CCCNC(=O)Cc1cccnc1 WXVL_AK00504SA0029 [1,0,0,0,0,0|2,0,1]=4 39 B13R1.44 CCCNC(=O)Cc1cccnc1 WXVL_AK00504SA0029 [1,0,0,0,0,0|2,0,1]=4 40 B13R1.44 CCCNC(=O)Cc1cccnc1 WXVL_AK00504SB00049 [1,0,0,0,0,0|2,0,1]=4 41 B13R1.44 CCCNC(=O)Cc1cccnc1 WXVL_AK00504SB00049 [1,0,0,0,0,0|2,0,1]=4 42 B13R1.44 CCCNC(=O)Cc1ccncc1 WXVL_AK00504SA00106 [1,0,0,0,0,0|2,0,1]=4 43 B13R1.44 CCCNC(=O)Cc1ccncc1 WXVL_AK00504SA00106 [1,0,0,0,0,0|2,0,1]=4 44 B13R1.44 O=C(Cc1ccccc1)NCCF WXVL_AK00466SB0092 [1,0,0,0,0,0|1,1,1]=4 45 B13R1.44 O=C(Cc1ccccc1)NCCF WXVL_AK00466SB0092 [1,0,0,0,0,0|1,1,1]=4 46 B13R1.44 O=C(NCCCl)Nc1ccccc1 WXVL_AG00183YV0092 [1,0,0,0,0,0|2,0,1]=4 47 B13R1.44 O=C(NCCCl)Nc1ccccc1 WXVL_AG00183YV0092 [1,0,0,0,0,0|2,0,1]=4 48 B15R1.83 C#CCCCNC(=O)Cc1ccccc1 WXVL_AK00218SB0092 [0,1,0,0,0,0|2,0,1]=4 49 B15R1.83 C#CCCCNC(=O)Cc1ccccc1 WXVL_AK00218SB0092 [0,1,0,0,0,0|2,0,1]=4 50 B15R1.83 CCCCCNC(=O)Cc1ccccc1 WXVL_AK0076SB0092 [0,1,0,0,0,0|2,0,1]=4 51 B15R1.83 CCCCCNC(=O)Cc1ccccc1 WXVL_AK0076SB0092 [0,1,0,0,0,0|2,0,1]=4 52 B15R1.83 CCSCCNC(=O)Cc1ccccc1 WXVL_AK00494SB0092 [0,1,0,0,0,0|2,0,1]=4 53 B15R1.83 CCSCCNC(=O)Cc1ccccc1 WXVL_AK00494SB0092 [0,1,0,0,0,0|2,0,1]=4 54 B15R1.83 COCCCNC(=O)Cc1ccccc1 WXVL_AK00637SB0092 [0,1,0,0,0,0|2,0,1]=4 55 B15R1.83 COCCCNC(=O)Cc1ccccc1 WXVL_AK00637SB0092 [0,1,0,0,0,0|2,0,1]=4 56 B15R1.83 CSCCCNC(=O)Cc1ccccc1 WXVL_AK0965SB0092 [0,1,0,0,0,0|2,0,1]=4 57 B15R1.83 CSCCCNC(=O)Cc1ccccc1 WXVL_AK0965SB0092 [0,1,0,0,0,0|2,0,1]=4 58 B15R1.83 O=C(Cc1ccccc1)NCCCCO WXVL_AK0075SB0092 [0,1,0,0,0,0|2,0,1]=4 59 B15R1.83 O=C(Cc1ccccc1)NCCCCO WXVL_AK0075SB0092 [0,1,0,0,0,0|2,0,1]=4 60 B15R1.93 CC(C(=O)NCCCO)c1ccccc1 WXVL_AK0073SB2326 [0,1,0,0,0,0|2,0,1]=4 61 B15R1.93 CC(C(=O)NCCCO)c1ccccc1 WXVL_AK0073SB2326 [0,1,0,0,0,0|2,0,1]=4 62 B15R1.93 CCCCNC(=O)C(C)c1ccccc1 WXVL_AK00588SB2326 [0,1,0,0,0,0|2,0,1]=4 63 B15R1.93 CCCCNC(=O)C(C)c1ccccc1 WXVL_AK00588SB2326 [0,1,0,0,0,0|2,0,1]=4 64 B15R1.93 CCCCNC(=O)C(O)c1ccccc1 WXVL_AK00588SB0168 [0,1,0,0,0,0|2,0,1]=4 65 B15R1.93 CCCCNC(=O)C(O)c1ccccc1 WXVL_AK00588SB0168 [0,1,0,0,0,0|2,0,1]=4 66 B15R1.93 O=C(NCCCO)C(O)c1ccccc1 WXVL_AK0073SB0168 [0,1,0,0,0,0|2,0,1]=4 67 B15R1.93 O=C(NCCCO)C(O)c1ccccc1 WXVL_AK0073SB0168 [0,1,0,0,0,0|2,0,1]=4 68 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Br WXVL_AK00588SB0926 [0,1,0,0,0,0|2,0,1]=4 69 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Br WXVL_AK00588SB0926 [0,1,0,0,0,0|2,0,1]=4 70 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)C WXVL_AK00588SB0112 [0,1,0,0,0,0|2,0,1]=4 71 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)C WXVL_AK00588SB0112 [0,1,0,0,0,0|2,0,1]=4 72 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK00588SB0107 [0,1,0,0,0,0|2,0,1]=4 73 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK00588SB0107 [0,1,0,0,0,0|2,0,1]=4 74 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)F WXVL_AK00588SB0106 [0,1,0,0,0,0|2,0,1]=4 75 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)F WXVL_AK00588SB0106 [0,1,0,0,0,0|2,0,1]=4 76 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)O WXVL_AK00588SB0110 [0,1,0,0,0,0|2,0,1]=4 77 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)O WXVL_AK00588SB0110 [0,1,0,0,0,0|2,0,1]=4 78 B15R1.128 Cc1ccc(cc1)CC(=O)NCCCO WXVL_AK0073SB0112 [0,1,0,0,0,0|2,0,1]=4 79 B15R1.128 Cc1ccc(cc1)CC(=O)NCCCO WXVL_AK0073SB0112 [0,1,0,0,0,0|2,0,1]=4 80 B15R1.128 O=C(Cc1ccc(cc1)Br)NCCCO WXVL_AK0073SB0926 [0,1,0,0,0,0|2,0,1]=4 81 B15R1.128 O=C(Cc1ccc(cc1)Br)NCCCO WXVL_AK0073SB0926 [0,1,0,0,0,0|2,0,1]=4 82 B15R1.128 O=C(Cc1ccc(cc1)Cl)NCCCO WXVL_AK0073SB0107 [0,1,0,0,0,0|2,0,1]=4 83 B15R1.128 O=C(Cc1ccc(cc1)Cl)NCCCO WXVL_AK0073SB0107 [0,1,0,0,0,0|2,0,1]=4 84 B15R1.128 O=C(Cc1ccc(cc1)F)NCCCO WXVL_AK0073SB0106 [0,1,0,0,0,0|2,0,1]=4 85 B15R1.128 O=C(Cc1ccc(cc1)F)NCCCO WXVL_AK0073SB0106 [0,1,0,0,0,0|2,0,1]=4 86 B15R1.128 O=C(Cc1ccc(cc1)O)NCCCO WXVL_AK0073SB0110 [0,1,0,0,0,0|2,0,1]=4 87 B15R1.128 O=C(Cc1ccc(cc1)O)NCCCO WXVL_AK0073SB0110 [0,1,0,0,0,0|2,0,1]=4 88 B15R1.128 O=C(NCCCCl)Nc1ccc(cc1)Cl WXVL_AG0062YV0130 [0,1,0,0,0,0|2,0,1]=4 89 B15R1.128 O=C(NCCCCl)Nc1ccc(cc1)Cl WXVL_AG0062YV0130 [0,1,0,0,0,0|2,0,1]=4 90 B15R1.128 O=C(NCCCCl)Nc1ccc(cc1)I WXVL_AG1742YV0130 [0,1,0,0,0,0|2,0,1]=4 91 B15R1.128 O=C(NCCCCl)Nc1ccc(cc1)I WXVL_AG1742YV0130 [0,1,0,0,0,0|2,0,1]=4 92 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Br WXVL_AK00588SB0099 [0,1,0,0,0,0|2,0,1]=4 93 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Br WXVL_AK00588SB0099 [0,1,0,0,0,0|2,0,1]=4 94 B15R1.129 CCCCNC(=O)Cc1cccc(c1)C WXVL_AK00588SB0105 [0,1,0,0,0,0|2,0,1]=4 95 B15R1.129 CCCCNC(=O)Cc1cccc(c1)C WXVL_AK00588SB0105 [0,1,0,0,0,0|2,0,1]=4 96 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Cl WXVL_AK00588SB0101 [0,1,0,0,0,0|2,0,1]=4 97 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Cl WXVL_AK00588SB0101 [0,1,0,0,0,0|2,0,1]=4 98 B15R1.129 CCCCNC(=O)Cc1cccc(c1)F WXVL_AK00588SB0100 [0,1,0,0,0,0|2,0,1]=4 99 B15R1.129 CCCCNC(=O)Cc1cccc(c1)F WXVL_AK00588SB0100 [0,1,0,0,0,0|2,0,1]=4 100 B15R1.129 CCCCNC(=O)Cc1cccc(c1)O WXVL_AK00588SB0104 [0,1,0,0,0,0|2,0,1]=4 101 B15R1.129 CCCCNC(=O)Cc1cccc(c1)O WXVL_AK00588SB0104 [0,1,0,0,0,0|2,0,1]=4 102 B15R1.129 Cc1cccc(c1)CC(=O)NCCCO WXVL_AK0073SB0105 [0,1,0,0,0,0|2,0,1]=4 103 B15R1.129 Cc1cccc(c1)CC(=O)NCCCO WXVL_AK0073SB0105 [0,1,0,0,0,0|2,0,1]=4 104 B15R1.129 Cc1cccc(c1)NC(=O)NCCCCl WXVL_AG0052YV0130 [0,1,0,0,0,0|2,0,1]=4 105 B15R1.129 Cc1cccc(c1)NC(=O)NCCCCl WXVL_AG0052YV0130 [0,1,0,0,0,0|2,0,1]=4 106 B15R1.129 O=C(Cc1cccc(c1)Br)NCCCO WXVL_AK0073SB0099 [0,1,0,0,0,0|2,0,1]=4 107 B15R1.129 O=C(Cc1cccc(c1)Br)NCCCO WXVL_AK0073SB0099 [0,1,0,0,0,0|2,0,1]=4 108 B15R1.129 O=C(Cc1cccc(c1)Cl)NCCCO WXVL_AK0073SB0101 [0,1,0,0,0,0|2,0,1]=4 109 B15R1.129 O=C(Cc1cccc(c1)Cl)NCCCO WXVL_AK0073SB0101 [0,1,0,0,0,0|2,0,1]=4 110 B15R1.129 O=C(Cc1cccc(c1)F)NCCCO WXVL_AK0073SB0100 [0,1,0,0,0,0|2,0,1]=4 111 B15R1.129 O=C(Cc1cccc(c1)F)NCCCO WXVL_AK0073SB0100 [0,1,0,0,0,0|2,0,1]=4 112 B15R1.129 O=C(Cc1cccc(c1)O)NCCCO WXVL_AK0073SB0104 [0,1,0,0,0,0|2,0,1]=4 113 B15R1.129 O=C(Cc1cccc(c1)O)NCCCO WXVL_AK0073SB0104 [0,1,0,0,0,0|2,0,1]=4 114 B15R1.129 O=C(NCCCCl)Nc1cccc(c1)I WXVL_AG0649YV0130 [0,1,0,0,0,0|2,0,1]=4 115 B15R1.129 O=C(NCCCCl)Nc1cccc(c1)I WXVL_AG0649YV0130 [0,1,0,0,0,0|2,0,1]=4 116 B15R1.129 O=C(NCCCCl)Nc1cccc(c1)O WXVL_AG00200YV0130 [0,1,0,0,0,0|2,0,1]=4 117 B15R1.129 O=C(NCCCCl)Nc1cccc(c1)O WXVL_AG00200YV0130 [0,1,0,0,0,0|2,0,1]=4 118 B15R1.551 CC(Cc1ccccc1)C(=O)NCCF WXVL_AK00466SB3205 [0,1,0,0,0,0|2,1,0]=4 119 B15R1.551 CC(Cc1ccccc1)C(=O)NCCF WXVL_AK00466SB3205 [0,1,0,0,0,0|2,1,0]=4 120 B15R1.551 CCCNC(=O)C(C)Cc1ccccc1 WXVL_AK00504SB3205 [0,1,0,0,0,0|3,0,0]=4 121 B15R1.551 CCCNC(=O)C(C)Cc1ccccc1 WXVL_AK00504SB3205 [0,1,0,0,0,0|3,0,0]=4 122 B15R1.551 CN(Cc1ccccc1)C(=O)NCCCl WXVL_AN0033YV0092 [0,1,0,0,0,0|3,0,0]=4 123 B15R1.551 CN(Cc1ccccc1)C(=O)NCCCl WXVL_AN0033YV0092 [0,1,0,0,0,0|3,0,0]=4 124 B15R1.809 CC(CCO)NC(=O)Cc1ccccc1 WXVL_AK1288SB0092 [0,1,0,0,0,0|2,0,1]=4 125 B15R1.809 CC(CCO)NC(=O)Cc1ccccc1 WXVL_AK1288SB0092 [0,1,0,0,0,0|2,0,1]=4 126 B15R1.809 CCC[C@H](C)NC(=O)Cc1ccccc1 WXVL_AK00682SB0092 [0,1,0,0,0,0|2,0,1]=4 127 B15R1.809 CCC[C@H](C)NC(=O)Cc1ccccc1 WXVL_AK00682SB0092 [0,1,0,0,0,0|2,0,1]=4 128 B15R1.964 O=C(Cc1ccccc1)NC[C@@H](F)CO WXVL_AK00590SB0092 [0,1,0,0,0,0|2,0,1]=4 129 B15R1.964 O=C(Cc1ccccc1)NC[C@@H](F)CO WXVL_AK00590SB0092 [0,1,0,0,0,0|2,0,1]=4 130 B15R1.964 O=C(Cc1ccccc1)NC[C@H](O)CO WXVL_AK00483SB0092 [0,1,0,0,0,0|2,0,1]=4 131 B15R1.964 O=C(Cc1ccccc1)NC[C@H](O)CO WXVL_AK00483SB0092 [0,1,0,0,0,0|2,0,1]=4 132 B15R1.1081 CC(C)CCNC(=O)Cc1ccccc1 WXVL_AK0068SB0092 [0,1,0,0,0,0|2,0,1]=4 133 B15R1.1081 CC(C)CCNC(=O)Cc1ccccc1 WXVL_AK0068SB0092 [0,1,0,0,0,0|2,0,1]=4 134 B15R1.1409 CCCCNC(=O)Cc1ccccc1Br WXVL_AK00588SB0093 [0,1,0,0,0,0|2,0,1]=4 135 B15R1.1409 CCCCNC(=O)Cc1ccccc1Br WXVL_AK00588SB0093 [0,1,0,0,0,0|2,0,1]=4 136 B15R1.1409 CCCCNC(=O)Cc1ccccc1C WXVL_AK00588SB0098 [0,1,0,0,0,0|2,0,1]=4 137 B15R1.1409 CCCCNC(=O)Cc1ccccc1C WXVL_AK00588SB0098 [0,1,0,0,0,0|2,0,1]=4 138 B15R1.1409 CCCCNC(=O)Cc1ccccc1Cl WXVL_AK00588SB0095 [0,1,0,0,0,0|2,0,1]=4 139 B15R1.1409 CCCCNC(=O)Cc1ccccc1Cl WXVL_AK00588SB0095 [0,1,0,0,0,0|2,0,1]=4 140 B15R1.1409 CCCCNC(=O)Cc1ccccc1F WXVL_AK00588SB0094 [0,1,0,0,0,0|2,0,1]=4 141 B15R1.1409 CCCCNC(=O)Cc1ccccc1F WXVL_AK00588SB0094 [0,1,0,0,0,0|2,0,1]=4 142 B15R1.1409 CCCCNC(=O)Cc1ccccc1I WXVL_AK00588SB1145 [0,1,0,0,0,0|2,0,1]=4 143 B15R1.1409 CCCCNC(=O)Cc1ccccc1I WXVL_AK00588SB1145 [0,1,0,0,0,0|2,0,1]=4 144 B15R1.1409 CCCCNC(=O)Cc1ccccc1O WXVL_AK00588SB0400 [0,1,0,0,0,0|2,0,1]=4 145 B15R1.1409 CCCCNC(=O)Cc1ccccc1O WXVL_AK00588SB0400 [0,1,0,0,0,0|2,0,1]=4 146 B15R1.1409 Cc1ccccc1CC(=O)NCCCO WXVL_AK0073SB0098 [0,1,0,0,0,0|2,0,1]=4 147 B15R1.1409 Cc1ccccc1CC(=O)NCCCO WXVL_AK0073SB0098 [0,1,0,0,0,0|2,0,1]=4 148 B15R1.1409 Cc1ccccc1NC(=O)NCCCCl WXVL_AG0027YV0130 [0,1,0,0,0,0|2,0,1]=4 149 B15R1.1409 Cc1ccccc1NC(=O)NCCCCl WXVL_AG0027YV0130 [0,1,0,0,0,0|2,0,1]=4 150 B15R1.1409 O=C(Cc1ccccc1Br)NCCCO WXVL_AK0073SB0093 [0,1,0,0,0,0|2,0,1]=4 151 B15R1.1409 O=C(Cc1ccccc1Br)NCCCO WXVL_AK0073SB0093 [0,1,0,0,0,0|2,0,1]=4 152 B15R1.1409 O=C(Cc1ccccc1Cl)NCCCO WXVL_AK0073SB0095 [0,1,0,0,0,0|2,0,1]=4 153 B15R1.1409 O=C(Cc1ccccc1Cl)NCCCO WXVL_AK0073SB0095 [0,1,0,0,0,0|2,0,1]=4 154 B15R1.1409 O=C(Cc1ccccc1F)NCCCO WXVL_AK0073SB0094 [0,1,0,0,0,0|2,0,1]=4 155 B15R1.1409 O=C(Cc1ccccc1F)NCCCO WXVL_AK0073SB0094 [0,1,0,0,0,0|2,0,1]=4 156 B15R1.1409 O=C(Cc1ccccc1I)NCCCO WXVL_AK0073SB1145 [0,1,0,0,0,0|2,0,1]=4 157 B15R1.1409 O=C(Cc1ccccc1I)NCCCO WXVL_AK0073SB1145 [0,1,0,0,0,0|2,0,1]=4 158 B15R1.1409 O=C(Cc1ccccc1O)NCCCO WXVL_AK0073SB0400 [0,1,0,0,0,0|2,0,1]=4 159 B15R1.1409 O=C(Cc1ccccc1O)NCCCO WXVL_AK0073SB0400 [0,1,0,0,0,0|2,0,1]=4 160 B15R1.1409 O=C(NCCCCl)Nc1ccccc1Br WXVL_AG00180YV0130 [0,1,0,0,0,0|2,0,1]=4 161 B15R1.1409 O=C(NCCCCl)Nc1ccccc1Br WXVL_AG00180YV0130 [0,1,0,0,0,0|2,0,1]=4 162 B15R1.1409 O=C(NCCCCl)Nc1ccccc1Cl WXVL_AG00129YV0130 [0,1,0,0,0,0|2,0,1]=4 163 B15R1.1409 O=C(NCCCCl)Nc1ccccc1Cl WXVL_AG00129YV0130 [0,1,0,0,0,0|2,0,1]=4 164 B15R1.1409 O=C(NCCCCl)Nc1ccccc1I WXVL_AG0385YV0130 [0,1,0,0,0,0|2,0,1]=4 165 B15R1.1409 O=C(NCCCCl)Nc1ccccc1I WXVL_AG0385YV0130 [0,1,0,0,0,0|2,0,1]=4 166 B15R1.2074 CCCCNS(=O)(=O)Cc1ccccc1 WXVL_AK00588HU0025 [0,1,0,0,0,0|3,0,0]=4 167 B15R1.2074 CCCCNS(=O)(=O)Cc1ccccc1 WXVL_AK00588HU0025 [0,1,0,0,0,0|3,0,0]=4 168 B15R1.2074 O=S(=O)(Cc1ccccc1)NCCCO WXVL_AK0073HU0025 [0,1,0,0,0,0|3,0,0]=4 169 B15R1.2074 O=S(=O)(Cc1ccccc1)NCCCO WXVL_AK0073HU0025 [0,1,0,0,0,0|3,0,0]=4 170 B15R2.64 O=C(Cc1ccccc1)N2CCCC2 WXVL_AN0008SB0092 [0,0,0,1,0,0|2,0,1]=4 171 B15R2.64 O=C(Cc1ccccc1)N2CCCC2 WXVL_AN0008SB0092 [0,0,0,1,0,0|2,0,1]=4 172 B13R1.24 CCCCNC(=O)c1ccccc1 WXVL_AK00588SD0001 [0,0,0,0,1,0|2,0,1]=4 173 B13R1.24 CCCCNC(=O)c1ccccc1 WXVL_AK00588SD0001 [0,0,0,0,1,0|2,0,1]=4 174 B13R1.24 O=C(NCCCO)c1ccccc1 WXVL_AK0073SD0001 [0,0,0,0,1,0|2,0,1]=4 175 B13R1.24 O=C(NCCCO)c1ccccc1 WXVL_AK0073SD0001 [0,0,0,0,1,0|2,0,1]=4 176 B15R1.78 CCCCNC(=O)CCc1ccccc1 WXVL_AK00588SB0067 [0,0,0,0,0,1|2,0,1]=4 177 B15R1.78 CCCCNC(=O)CCc1ccccc1 WXVL_AK00588SB0067 [0,0,0,0,0,1|2,0,1]=4 178 B15R1.78 CCCCNC(=O)COc1ccccc1 WXVL_AK00588SB0086 [0,0,0,0,0,1|2,0,1]=4 179 B15R1.78 CCCCNC(=O)COc1ccccc1 WXVL_AK00588SB0086 [0,0,0,0,0,1|2,0,1]=4 180 B15R1.78 CCCCNC(=O)CSc1ccccc1 WXVL_AK00588SB0113 [0,0,0,0,0,1|2,0,1]=4 181 B15R1.78 CCCCNC(=O)CSc1ccccc1 WXVL_AK00588SB0113 [0,0,0,0,0,1|2,0,1]=4 182 B15R1.78 O=C(CCCCCl)NCc1ccccc1 WXVL_AK00502SB0379 [0,0,0,0,0,1|2,0,1]=4 183 B15R1.78 O=C(CCCCCl)NCc1ccccc1 WXVL_AK00502SB0379 [0,0,0,0,0,1|2,0,1]=4 184 B15R1.78 O=C(CCc1ccccc1)NCCCO WXVL_AK0073SB0067 [0,0,0,0,0,1|2,0,1]=4 185 B15R1.78 O=C(CCc1ccccc1)NCCCO WXVL_AK0073SB0067 [0,0,0,0,0,1|2,0,1]=4 186 B15R1.78 O=C(COc1ccccc1)NCCCO WXVL_AK0073SB0086 [0,0,0,0,0,1|2,0,1]=4 187 B15R1.78 O=C(COc1ccccc1)NCCCO WXVL_AK0073SB0086 [0,0,0,0,0,1|2,0,1]=4 188 B15R1.78 O=C(CSc1ccccc1)NCCCO WXVL_AK0073SB0113 [0,0,0,0,0,1|2,0,1]=4 189 B15R1.78 O=C(CSc1ccccc1)NCCCO WXVL_AK0073SB0113 [0,0,0,0,0,1|2,0,1]=4 190 B15R1.78 O=C(NCCCCl)NCc1ccccc1 WXVL_AK00502YV0130 [0,0,0,0,0,1|1,0,1]=3 191 B15R1.78 O=C(NCCCCl)NCc1ccccc1 WXVL_AK00502YV0130 [0,0,0,0,0,1|1,0,1]=3 192 B15R1.78 O=C(NCCCCl)NCc1ccccn1 WXVL_AK0018YV0130 [0,0,0,0,0,1|2,0,1]=4 193 B15R1.78 O=C(NCCCCl)NCc1ccccn1 WXVL_AK0018YV0130 [0,0,0,0,0,1|2,0,1]=4 194 B15R1.78 O=C(NCCCCl)NCc1cccnc1 WXVL_AK0020YV0130 [0,0,0,0,0,1|2,0,1]=4 195 B15R1.78 O=C(NCCCCl)NCc1cccnc1 WXVL_AK0020YV0130 [0,0,0,0,0,1|2,0,1]=4 196 B15R1.78 O=C(NCCCCl)NCc1ccncc1 WXVL_AK0021YV0130 [0,0,0,0,0,1|2,0,1]=4 197 B15R1.78 O=C(NCCCCl)NCc1ccncc1 WXVL_AK0021YV0130 [0,0,0,0,0,1|2,0,1]=4 198 B12R1.32 CCNC(=O)Cc1ccccc1 WXVL_AK00476SB0092 [2,0,0,0,0,0|1,0,1]=4 199 B12R1.32 CCNC(=O)Cc1ccccc1 WXVL_AK00476SB0092 [2,0,0,0,0,0|1,0,1]=4 200 B14R1.520 CCCC(=O)NCCc1ccccc1 WXVL_AK00498SB0073 [1,1,0,0,0,0|1,0,1]=4 201 B14R1.520 CCCC(=O)NCCc1ccccc1 WXVL_AK00498SB0073 [1,1,0,0,0,0|1,0,1]=4 202 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Br WXVL_AK00504SB0926 [1,1,0,0,0,0|1,0,1]=4 203 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Br WXVL_AK00504SB0926 [1,1,0,0,0,0|1,0,1]=4 204 B14R1.33 CCCNC(=O)Cc1ccc(cc1)C WXVL_AK00504SB0112 [1,1,0,0,0,0|1,0,1]=4 205 B14R1.33 CCCNC(=O)Cc1ccc(cc1)C WXVL_AK00504SB0112 [1,1,0,0,0,0|1,0,1]=4 206 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK00504SB0107 [1,1,0,0,0,0|1,0,1]=4 207 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK00504SB0107 [1,1,0,0,0,0|1,0,1]=4 208 B14R1.33 CCCNC(=O)Cc1ccc(cc1)F WXVL_AK00504SB0106 [1,1,0,0,0,0|1,0,1]=4 209 B14R1.33 CCCNC(=O)Cc1ccc(cc1)F WXVL_AK00504SB0106 [1,1,0,0,0,0|1,0,1]=4 210 B14R1.33 CCCNC(=O)Cc1ccc(cc1)O WXVL_AK00504SB0110 [1,1,0,0,0,0|1,0,1]=4 211 B14R1.33 CCCNC(=O)Cc1ccc(cc1)O WXVL_AK00504SB0110 [1,1,0,0,0,0|1,0,1]=4 212 B14R1.34 CCCNC(=O)Cc1cccc(c1)Br WXVL_AK00504SB0099 [1,1,0,0,0,0|1,0,1]=4 213 B14R1.34 CCCNC(=O)Cc1cccc(c1)Br WXVL_AK00504SB0099 [1,1,0,0,0,0|1,0,1]=4 214 B14R1.34 CCCNC(=O)Cc1cccc(c1)C WXVL_AK00504SB0105 [1,1,0,0,0,0|1,0,1]=4 215 B14R1.34 CCCNC(=O)Cc1cccc(c1)C WXVL_AK00504SB0105 [1,1,0,0,0,0|1,0,1]=4 216 B14R1.34 CCCNC(=O)Cc1cccc(c1)Cl WXVL_AK00504SB0101 [1,1,0,0,0,0|1,0,1]=4 217 B14R1.34 CCCNC(=O)Cc1cccc(c1)Cl WXVL_AK00504SB0101 [1,1,0,0,0,0|1,0,1]=4 218 B14R1.34 CCCNC(=O)Cc1cccc(c1)F WXVL_AK00504SB0100 [1,1,0,0,0,0|1,0,1]=4 219 B14R1.34 CCCNC(=O)Cc1cccc(c1)F WXVL_AK00504SB0100 [1,1,0,0,0,0|1,0,1]=4 220 B14R1.34 CCCNC(=O)Cc1cccc(c1)O WXVL_AK00504SB0104 [1,1,0,0,0,0|1,0,1]=4 221 B14R1.34 CCCNC(=O)Cc1cccc(c1)O WXVL_AK00504SB0104 [1,1,0,0,0,0|1,0,1]=4 222 B14R1.60 CCCC(=O)N(C)Cc1ccccc1 WXVL_AN0033SB0073 [1,1,0,0,0,0|2,0,0]=4 223 B14R1.60 CCCC(=O)N(C)Cc1ccccc1 WXVL_AN0033SB0073 [1,1,0,0,0,0|2,0,0]=4 224 B14R1.60 CCNC(=O)C(C)Cc1ccccc1 WXVL_AK00476SB3205 [1,1,0,0,0,0|2,0,0]=4 225 B14R1.60 CCNC(=O)C(C)Cc1ccccc1 WXVL_AK00476SB3205 [1,1,0,0,0,0|2,0,0]=4 226 B14R1.166 CCCNC(=O)C(C)c1ccccc1 WXVL_AK00504SB2326 [1,1,0,0,0,0|1,0,1]=4 227 B14R1.166 CCCNC(=O)C(C)c1ccccc1 WXVL_AK00504SB2326 [1,1,0,0,0,0|1,0,1]=4 228 B14R1.166 CCCNC(=O)C(O)c1ccccc1 WXVL_AK00504SB0168 [1,1,0,0,0,0|1,0,1]=4 229 B14R1.166 CCCNC(=O)C(O)c1ccccc1 WXVL_AK00504SB0168 [1,1,0,0,0,0|1,0,1]=4 230 B14R1.423 CC(C)CNC(=O)Cc1ccccc1 WXVL_AK00544SB0092 [1,1,0,0,0,0|1,0,1]=4 231 B14R1.423 CC(C)CNC(=O)Cc1ccccc1 WXVL_AK00544SB0092 [1,1,0,0,0,0|1,0,1]=4 232 B14R1.423 CC(O)CNC(=O)Cc1ccccc1 WXVL_AK0052SB0092 [1,1,0,0,0,0|1,0,1]=4 233 B14R1.423 CC(O)CNC(=O)Cc1ccccc1 WXVL_AK0052SB0092 [1,1,0,0,0,0|1,0,1]=4 234 B14R1.423 C[C@H](O)CNC(=O)Cc1ccccc1 WXVL_AK0113SB0092 [1,1,0,0,0,0|1,0,1]=4 235 B14R1.423 C[C@H](O)CNC(=O)Cc1ccccc1 WXVL_AK0113SB0092 [1,1,0,0,0,0|1,0,1]=4 236 B14R1.743 CC[C@H](C)NC(=O)Cc1ccccc1 WXVL_AK00678SB0092 [1,1,0,0,0,0|1,0,1]=4 237 B14R1.743 CC[C@H](C)NC(=O)Cc1ccccc1 WXVL_AK00678SB0092 [1,1,0,0,0,0|1,0,1]=4 238 B14R1.946 CCCNC(=O)Cc1ccccc1Br WXVL_AK00504SB0093 [1,1,0,0,0,0|1,0,1]=4 239 B14R1.946 CCCNC(=O)Cc1ccccc1Br WXVL_AK00504SB0093 [1,1,0,0,0,0|1,0,1]=4 240 B14R1.946 CCCNC(=O)Cc1ccccc1C WXVL_AK00504SB0098 [1,1,0,0,0,0|1,0,1]=4 241 B14R1.946 CCCNC(=O)Cc1ccccc1C WXVL_AK00504SB0098 [1,1,0,0,0,0|1,0,1]=4 242 B14R1.946 CCCNC(=O)Cc1ccccc1Cl WXVL_AK00504SB0095 [1,1,0,0,0,0|1,0,1]=4 243 B14R1.946 CCCNC(=O)Cc1ccccc1Cl WXVL_AK00504SB0095 [1,1,0,0,0,0|1,0,1]=4 244 B14R1.946 CCCNC(=O)Cc1ccccc1F WXVL_AK00504SB0094 [1,1,0,0,0,0|1,0,1]=4 245 B14R1.946 CCCNC(=O)Cc1ccccc1F WXVL_AK00504SB0094 [1,1,0,0,0,0|1,0,1]=4 246 B14R1.946 CCCNC(=O)Cc1ccccc1I WXVL_AK00504SB1145 [1,1,0,0,0,0|1,0,1]=4 247 B14R1.946 CCCNC(=O)Cc1ccccc1I WXVL_AK00504SB1145 [1,1,0,0,0,0|1,0,1]=4 248 B14R1.946 CCCNC(=O)Cc1ccccc1O WXVL_AK00504SB0400 [1,1,0,0,0,0|1,0,1]=4 249 B14R1.946 CCCNC(=O)Cc1ccccc1O WXVL_AK00504SB0400 [1,1,0,0,0,0|1,0,1]=4 250 B14R1.4528 CCCNS(=O)(=O)Cc1ccccc1 WXVL_AK00504HU0025 [1,1,0,0,0,0|2,0,0]=4 251 B14R1.4528 CCCNS(=O)(=O)Cc1ccccc1 WXVL_AK00504HU0025 [1,1,0,0,0,0|2,0,0]=4 252 B16R1.51 Cc1ccc(cc1)CNC(=O)NCCCCl WXVL_AK0048YV0130 [0,1,0,0,0,1|1,0,1]=4 253 B16R1.51 Cc1ccc(cc1)CNC(=O)NCCCCl WXVL_AK0048YV0130 [0,1,0,0,0,1|1,0,1]=4 254 B16R1.51 O=C(NCCCCl)NCc1ccc(cc1)Br WXVL_AK1474YV0130 [0,1,0,0,0,1|1,0,1]=4 255 B16R1.51 O=C(NCCCCl)NCc1ccc(cc1)Br WXVL_AK1474YV0130 [0,1,0,0,0,1|1,0,1]=4 256 B16R1.51 O=C(NCCCCl)NCc1ccc(cc1)Cl WXVL_AK0047YV0130 [0,1,0,0,0,1|1,0,1]=4 257 B16R1.51 O=C(NCCCCl)NCc1ccc(cc1)Cl WXVL_AK0047YV0130 [0,1,0,0,0,1|1,0,1]=4 258 B16R1.51 O=C(NCCCCl)NCc1ccc(cc1)F WXVL_AK0046YV0130 [0,1,0,0,0,1|1,0,1]=4 259 B16R1.51 O=C(NCCCCl)NCc1ccc(cc1)F WXVL_AK0046YV0130 [0,1,0,0,0,1|1,0,1]=4 260 B16R1.51 O=C(NCCCCl)NCc1ccc(cc1)I WXVL_AK1644YV0130 [0,1,0,0,0,1|1,0,1]=4 261 B16R1.51 O=C(NCCCCl)NCc1ccc(cc1)I WXVL_AK1644YV0130 [0,1,0,0,0,1|1,0,1]=4 262 B16R1.51 O=C(NCCCCl)NCc1ccc(cc1)O WXVL_AK0926YV0130 [0,1,0,0,0,1|1,0,1]=4 263 B16R1.51 O=C(NCCCCl)NCc1ccc(cc1)O WXVL_AK0926YV0130 [0,1,0,0,0,1|1,0,1]=4 264 B16R1.52 Cc1cccc(c1)CNC(=O)NCCCCl WXVL_AK0045YV0130 [0,1,0,0,0,1|1,0,1]=4 265 B16R1.52 Cc1cccc(c1)CNC(=O)NCCCCl WXVL_AK0045YV0130 [0,1,0,0,0,1|1,0,1]=4 266 B16R1.52 O=C(NCCCCl)NCc1cccc(c1)Br WXVL_AK1177YV0130 [0,1,0,0,0,1|1,0,1]=4 267 B16R1.52 O=C(NCCCCl)NCc1cccc(c1)Br WXVL_AK1177YV0130 [0,1,0,0,0,1|1,0,1]=4 268 B16R1.52 O=C(NCCCCl)NCc1cccc(c1)Cl WXVL_AK0094YV0130 [0,1,0,0,0,1|1,0,1]=4 269 B16R1.52 O=C(NCCCCl)NCc1cccc(c1)Cl WXVL_AK0094YV0130 [0,1,0,0,0,1|1,0,1]=4 270 B16R1.52 O=C(NCCCCl)NCc1cccc(c1)F WXVL_AK0041YV0130 [0,1,0,0,0,1|1,0,1]=4 271 B16R1.52 O=C(NCCCCl)NCc1cccc(c1)F WXVL_AK0041YV0130 [0,1,0,0,0,1|1,0,1]=4 272 B16R1.52 O=C(NCCCCl)NCc1cccc(c1)I WXVL_AK1572YV0130 [0,1,0,0,0,1|1,0,1]=4 273 B16R1.52 O=C(NCCCCl)NCc1cccc(c1)I WXVL_AK1572YV0130 [0,1,0,0,0,1|1,0,1]=4 274 B16R1.52 O=C(NCCCCl)NCc1cccc(c1)O WXVL_AK0974YV0130 [0,1,0,0,0,1|1,0,1]=4 275 B16R1.52 O=C(NCCCCl)NCc1cccc(c1)O WXVL_AK0974YV0130 [0,1,0,0,0,1|1,0,1]=4 276 B16R1.1216 CN(Cc1ccccc1)C(=O)NCCCCl WXVL_AN0033YV0130 [0,1,0,0,0,1|1,0,1]=4 277 B16R1.1216 CN(Cc1ccccc1)C(=O)NCCCCl WXVL_AN0033YV0130 [0,1,0,0,0,1|1,0,1]=4 278 B16R1.1696 Cc1ccccc1CNC(=O)NCCCCl WXVL_AK0040YV0130 [0,1,0,0,0,1|1,0,1]=4 279 B16R1.1696 Cc1ccccc1CNC(=O)NCCCCl WXVL_AK0040YV0130 [0,1,0,0,0,1|1,0,1]=4 280 B16R1.1696 O=C(NCCCCl)NCc1ccccc1Br WXVL_AK1632YV0130 [0,1,0,0,0,1|1,0,1]=4 281 B16R1.1696 O=C(NCCCCl)NCc1ccccc1Br WXVL_AK1632YV0130 [0,1,0,0,0,1|1,0,1]=4 282 B16R1.1696 O=C(NCCCCl)NCc1ccccc1Cl WXVL_AK0038YV0130 [0,1,0,0,0,1|1,0,1]=4 283 B16R1.1696 O=C(NCCCCl)NCc1ccccc1Cl WXVL_AK0038YV0130 [0,1,0,0,0,1|1,0,1]=4 284 B16R1.1696 O=C(NCCCCl)NCc1ccccc1F WXVL_AK0037YV0130 [0,1,0,0,0,1|1,0,1]=4 285 B16R1.1696 O=C(NCCCCl)NCc1ccccc1F WXVL_AK0037YV0130 [0,1,0,0,0,1|1,0,1]=4 286 B16R1.1696 O=C(NCCCCl)NCc1ccccc1I WXVL_AK3923YV0130 [0,1,0,0,0,1|1,0,1]=4 287 B16R1.1696 O=C(NCCCCl)NCc1ccccc1I WXVL_AK3923YV0130 [0,1,0,0,0,1|1,0,1]=4 288 B16R1.1696 O=C(NCCCCl)NCc1ccccc1O WXVL_AK0963YV0130 [0,1,0,0,0,1|1,0,1]=4 289 B16R1.1696 O=C(NCCCCl)NCc1ccccc1O WXVL_AK0963YV0130 [0,1,0,0,0,1|1,0,1]=4 290 B16R1.956 CCCC(=O)NC(C)Cc1cccc(c1)Br WXVL_AK4310SB0073 [0,2,0,0,0,0|1,0,1]=4 291 B16R1.956 CCCC(=O)NC(C)Cc1cccc(c1)Br WXVL_AK4310SB0073 [0,2,0,0,0,0|1,0,1]=4 292 B16R1.7641 CN(Cc1ccccc1)S(=O)(=O)CCCCl WXVL_AN0033HU0162 [0,2,0,0,0,0|2,0,0]=4 293 B16R1.7641 CN(Cc1ccccc1)S(=O)(=O)CCCCl WXVL_AN0033HU0162 [0,2,0,0,0,0|2,0,0]=4 294 B16R1.936 CCCC(=O)N[C@H](CO)Cc1ccccc1 WXVL_AK00517SB0073 [0,2,0,0,0,0|1,0,1]=4 295 B16R1.936 CCCC(=O)N[C@H](CO)Cc1ccccc1 WXVL_AK00517SB0073 [0,2,0,0,0,0|1,0,1]=4 296 B14R2.9593 O=C(Cc1ccccc1)NC2CC2 WXVL_AK0001SB0092 [1,0,0,1,0,0|1,0,1]=4 297 B14R2.9593 O=C(Cc1ccccc1)NC2CC2 WXVL_AK0001SB0092 [1,0,0,1,0,0|1,0,1]=4 298 B12R1.30 CCCNC(=O)c1ccccc1 WXVL_AK00504SD0001 [1,0,0,0,1,0|1,0,1]=4 299 B12R1.30 CCCNC(=O)c1ccccc1 WXVL_AK00504SD0001 [1,0,0,0,1,0|1,0,1]=4 300 B16R1.1694 O=C(NCCCCl)NCCc1ccccc1 WXVL_AK00498YV0130 [0,0,0,0,0,2|1,0,1]=4 301 B16R1.1694 O=C(NCCCCl)NCCc1ccccc1 WXVL_AK00498YV0130 [0,0,0,0,0,2|1,0,1]=4