0 B14R1.156 C=CCCC(=O)NCc1ccccc1 WXVL_AK00502SB1035 [0,0,0,0,0,0|2,0,1]=3 1 B14R1.156 C=CCCC(=O)NCc1ccccc1 WXVL_AK00502SB1035 [0,0,0,0,0,0|2,0,1]=3 2 B14R1.156 C=CCCC(=O)NCc1ccccn1 WXVL_AK0018SB1035 [0,0,0,0,0,0|3,0,1]=4 3 B14R1.156 C=CCCC(=O)NCc1ccccn1 WXVL_AK0018SB1035 [0,0,0,0,0,0|3,0,1]=4 4 B14R1.156 C=CCCC(=O)NCc1cccnc1 WXVL_AK0020SB1035 [0,0,0,0,0,0|3,0,1]=4 5 B14R1.156 C=CCCC(=O)NCc1cccnc1 WXVL_AK0020SB1035 [0,0,0,0,0,0|3,0,1]=4 6 B14R1.156 C=CCCC(=O)NCc1ccncc1 WXVL_AK0021SB1035 [0,0,0,0,0,0|3,0,1]=4 7 B14R1.156 C=CCCC(=O)NCc1ccncc1 WXVL_AK0021SB1035 [0,0,0,0,0,0|3,0,1]=4 8 B14R1.156 C=CCNC(=O)/C=C/c1ccccc1 WXVL_AK00561SB0115 [0,0,0,0,0,0|1,0,0]=1 9 B14R1.156 C=CCNC(=O)/C=C/c1ccccc1 WXVL_AK00561SB0115 [0,0,0,0,0,0|1,0,0]=1 10 B14R1.156 C=CCNC(=O)/C=C/c1cccnc1 WXVL_AK00561SA0193 [0,0,0,0,0,0|2,0,0]=2 11 B14R1.156 C=CCNC(=O)/C=C/c1cccnc1 WXVL_AK00561SA0193 [0,0,0,0,0,0|2,0,0]=2 12 B14R1.156 C=CCNC(=O)/C=C/c1cnccn1 WXVL_AK00561SA2885 [0,0,0,0,0,0|3,0,0]=3 13 B14R1.156 C=CCNC(=O)/C=C/c1cnccn1 WXVL_AK00561SA2885 [0,0,0,0,0,0|3,0,0]=3 14 B14R1.156 C=CCNC(=O)C#Cc1ccccc1 WXVL_AK00561SB0114 [0,0,0,0,0,0|1,0,2]=3 15 B14R1.156 C=CCNC(=O)C#Cc1ccccc1 WXVL_AK00561SB0114 [0,0,0,0,0,0|1,0,2]=3 16 B14R1.156 C=CCNC(=O)CCc1ccccc1 WXVL_AK00561SB0067 [0,0,0,0,0,0|1,0,2]=3 17 B14R1.156 C=CCNC(=O)CCc1ccccc1 WXVL_AK00561SB0067 [0,0,0,0,0,0|1,0,2]=3 18 B14R1.156 C=CCNC(=O)CCc1ccccn1 WXVL_AK00561SA0316 [0,0,0,0,0,0|2,0,2]=4 19 B14R1.156 C=CCNC(=O)CCc1ccccn1 WXVL_AK00561SA0316 [0,0,0,0,0,0|2,0,2]=4 20 B14R1.156 C=CCNC(=O)CCc1cccnc1 WXVL_AK00561SA0031 [0,0,0,0,0,0|2,0,2]=4 21 B14R1.156 C=CCNC(=O)CCc1cccnc1 WXVL_AK00561SA0031 [0,0,0,0,0,0|2,0,2]=4 22 B14R1.156 C=CCNC(=O)COc1ccccc1 WXVL_AK00561SB0086 [0,0,0,0,0,0|2,0,1]=3 23 B14R1.156 C=CCNC(=O)COc1ccccc1 WXVL_AK00561SB0086 [0,0,0,0,0,0|2,0,1]=3 24 B14R1.156 C=CCNC(=O)COc1cccnc1 WXVL_AK00561SA0051 [0,0,0,0,0,0|3,0,1]=4 25 B14R1.156 C=CCNC(=O)COc1cccnc1 WXVL_AK00561SA0051 [0,0,0,0,0,0|3,0,1]=4 26 B14R1.156 C=CCNC(=O)CSc1ccccc1 WXVL_AK00561SB0113 [0,0,0,0,0,0|2,0,1]=3 27 B14R1.156 C=CCNC(=O)CSc1ccccc1 WXVL_AK00561SB0113 [0,0,0,0,0,0|2,0,1]=3 28 B14R1.156 C=CCNC(=O)CSc1ccncc1 WXVL_AK00561SA0055 [0,0,0,0,0,0|3,0,1]=4 29 B14R1.156 C=CCNC(=O)CSc1ccncc1 WXVL_AK00561SA0055 [0,0,0,0,0,0|3,0,1]=4 30 B14R1.156 CCCNC(=O)/C=C/c1ccccc1 WXVL_AK00504SB0115 [0,0,0,0,0,0|1,0,2]=3 31 B14R1.156 CCCNC(=O)/C=C/c1ccccc1 WXVL_AK00504SB0115 [0,0,0,0,0,0|1,0,2]=3 32 B14R1.156 CCCNC(=O)/C=C/c1cccnc1 WXVL_AK00504SA0193 [0,0,0,0,0,0|2,0,2]=4 33 B14R1.156 CCCNC(=O)/C=C/c1cccnc1 WXVL_AK00504SA0193 [0,0,0,0,0,0|2,0,2]=4 34 B14R1.156 N#CCNC(=O)/C=C/c1ccccc1 WXVL_AK0683SB0115 [0,0,0,0,0,0|2,0,1]=3 35 B14R1.156 N#CCNC(=O)/C=C/c1ccccc1 WXVL_AK0683SB0115 [0,0,0,0,0,0|2,0,1]=3 36 B14R1.156 N#CCNC(=O)/C=C/c1cccnc1 WXVL_AK0683SA0193 [0,0,0,0,0,0|3,0,1]=4 37 B14R1.156 N#CCNC(=O)/C=C/c1cccnc1 WXVL_AK0683SA0193 [0,0,0,0,0,0|3,0,1]=4 38 B14R1.156 O=C(/C=C/c1ccccc1)NCCF WXVL_AK00466SB0115 [0,0,0,0,0,0|2,0,1]=3 39 B14R1.156 O=C(/C=C/c1ccccc1)NCCF WXVL_AK00466SB0115 [0,0,0,0,0,0|2,0,1]=3 40 B14R1.156 O=C(/C=C/c1cccnc1)NCCF WXVL_AK00466SA0193 [0,0,0,0,0,0|3,0,1]=4 41 B14R1.156 O=C(/C=C/c1cccnc1)NCCF WXVL_AK00466SA0193 [0,0,0,0,0,0|3,0,1]=4 42 B13R1.42 C=CCC(=O)NCc1ccccc1 WXVL_AK00502SB2732 [1,0,0,0,0,0|1,0,1]=3 43 B13R1.42 C=CCC(=O)NCc1ccccc1 WXVL_AK00502SB2732 [1,0,0,0,0,0|1,0,1]=3 44 B13R1.42 C=CCC(=O)NCc1ccccn1 WXVL_AK0018SB2732 [1,0,0,0,0,0|2,0,1]=4 45 B13R1.42 C=CCC(=O)NCc1ccccn1 WXVL_AK0018SB2732 [1,0,0,0,0,0|2,0,1]=4 46 B13R1.42 C=CCC(=O)NCc1cccnc1 WXVL_AK0020SB2732 [1,0,0,0,0,0|2,0,1]=4 47 B13R1.42 C=CCC(=O)NCc1cccnc1 WXVL_AK0020SB2732 [1,0,0,0,0,0|2,0,1]=4 48 B13R1.42 C=CCC(=O)NCc1ccncc1 WXVL_AK0021SB2732 [1,0,0,0,0,0|2,0,1]=4 49 B13R1.42 C=CCC(=O)NCc1ccncc1 WXVL_AK0021SB2732 [1,0,0,0,0,0|2,0,1]=4 50 B13R1.42 CCNC(=O)/C=C/c1ccccc1 WXVL_AK00476SB0115 [1,0,0,0,0,0|1,0,1]=3 51 B13R1.42 CCNC(=O)/C=C/c1ccccc1 WXVL_AK00476SB0115 [1,0,0,0,0,0|1,0,1]=3 52 B13R1.42 CCNC(=O)/C=C/c1cccnc1 WXVL_AK00476SA0193 [1,0,0,0,0,0|2,0,1]=4 53 B13R1.42 CCNC(=O)/C=C/c1cccnc1 WXVL_AK00476SA0193 [1,0,0,0,0,0|2,0,1]=4 54 B15R1.78 C#CCCNC(=O)/C=C/c1ccccc1 WXVL_AK3109SB0115 [0,1,0,0,0,0|1,0,2]=4 55 B15R1.78 C#CCCNC(=O)/C=C/c1ccccc1 WXVL_AK3109SB0115 [0,1,0,0,0,0|1,0,2]=4 56 B15R1.78 C=CCCCC(=O)NCc1ccccc1 WXVL_AK00502SB2920 [0,1,0,0,0,0|2,0,1]=4 57 B15R1.78 C=CCCCC(=O)NCc1ccccc1 WXVL_AK00502SB2920 [0,1,0,0,0,0|2,0,1]=4 58 B15R1.78 C=CCCNC(=O)/C=C/c1ccccc1 WXVL_AK00138SB0115 [0,1,0,0,0,0|1,0,0]=2 59 B15R1.78 C=CCCNC(=O)/C=C/c1ccccc1 WXVL_AK00138SB0115 [0,1,0,0,0,0|1,0,0]=2 60 B15R1.78 C=CCCNC(=O)/C=C/c1cccnc1 WXVL_AK00138SA0193 [0,1,0,0,0,0|2,0,0]=3 61 B15R1.78 C=CCCNC(=O)/C=C/c1cccnc1 WXVL_AK00138SA0193 [0,1,0,0,0,0|2,0,0]=3 62 B15R1.78 C=CCCNC(=O)/C=C/c1cnccn1 WXVL_AK00138SA2885 [0,1,0,0,0,0|3,0,0]=4 63 B15R1.78 C=CCCNC(=O)/C=C/c1cnccn1 WXVL_AK00138SA2885 [0,1,0,0,0,0|3,0,0]=4 64 B15R1.78 C=CCCNC(=O)C#Cc1ccccc1 WXVL_AK00138SB0114 [0,1,0,0,0,0|1,0,2]=4 65 B15R1.78 C=CCCNC(=O)C#Cc1ccccc1 WXVL_AK00138SB0114 [0,1,0,0,0,0|1,0,2]=4 66 B15R1.78 C=CCCNC(=O)CCc1ccccc1 WXVL_AK00138SB0067 [0,1,0,0,0,0|1,0,2]=4 67 B15R1.78 C=CCCNC(=O)CCc1ccccc1 WXVL_AK00138SB0067 [0,1,0,0,0,0|1,0,2]=4 68 B15R1.78 C=CCCNC(=O)COc1ccccc1 WXVL_AK00138SB0086 [0,1,0,0,0,0|2,0,1]=4 69 B15R1.78 C=CCCNC(=O)COc1ccccc1 WXVL_AK00138SB0086 [0,1,0,0,0,0|2,0,1]=4 70 B15R1.78 C=CCCNC(=O)CSc1ccccc1 WXVL_AK00138SB0113 [0,1,0,0,0,0|2,0,1]=4 71 B15R1.78 C=CCCNC(=O)CSc1ccccc1 WXVL_AK00138SB0113 [0,1,0,0,0,0|2,0,1]=4 72 B15R1.78 CCCCNC(=O)/C=C/c1ccccc1 WXVL_AK00588SB0115 [0,1,0,0,0,0|1,0,2]=4 73 B15R1.78 CCCCNC(=O)/C=C/c1ccccc1 WXVL_AK00588SB0115 [0,1,0,0,0,0|1,0,2]=4 74 B15R1.78 CSCCNC(=O)/C=C/c1ccccc1 WXVL_AK00440SB0115 [0,1,0,0,0,0|1,0,2]=4 75 B15R1.78 CSCCNC(=O)/C=C/c1ccccc1 WXVL_AK00440SB0115 [0,1,0,0,0,0|1,0,2]=4 76 B15R1.78 N#CCCNC(=O)/C=C/c1ccccc1 WXVL_AK0087SB0115 [0,1,0,0,0,0|1,0,2]=4 77 B15R1.78 N#CCCNC(=O)/C=C/c1ccccc1 WXVL_AK0087SB0115 [0,1,0,0,0,0|1,0,2]=4 78 B15R1.78 O=C(/C=C/c1ccccc1)NCCCO WXVL_AK0073SB0115 [0,1,0,0,0,0|1,0,2]=4 79 B15R1.78 O=C(/C=C/c1ccccc1)NCCCO WXVL_AK0073SB0115 [0,1,0,0,0,0|1,0,2]=4 80 B15R1.115 C=CCNC(=O)CC(C)c1ccccc1 WXVL_AK00561SB0419 [0,1,0,0,0,0|1,0,2]=4 81 B15R1.115 C=CCNC(=O)CC(C)c1ccccc1 WXVL_AK00561SB0419 [0,1,0,0,0,0|1,0,2]=4 82 B15R1.115 C=CCNC(=O)CC(O)c1ccccc1 WXVL_AK00561SB2325 [0,1,0,0,0,0|1,0,2]=4 83 B15R1.115 C=CCNC(=O)CC(O)c1ccccc1 WXVL_AK00561SB2325 [0,1,0,0,0,0|1,0,2]=4 84 B15R1.115 C=CCNC(=O)NC(=O)c1ccccc1 WXVL_AK00561YV0027 [0,1,0,0,0,0|2,0,0]=3 85 B15R1.115 C=CCNC(=O)NC(=O)c1ccccc1 WXVL_AK00561YV0027 [0,1,0,0,0,0|2,0,0]=3 86 B15R1.115 C=CCNC(=O)N[C@@H](C)c1ccccc1 WXVL_AK00561YV0029 [0,1,0,0,0,0|2,0,1]=4 87 B15R1.115 C=CCNC(=O)N[C@@H](C)c1ccccc1 WXVL_AK00561YV0029 [0,1,0,0,0,0|2,0,1]=4 88 B15R1.115 C=CCNC(=O)N[C@H](C)c1ccccc1 WXVL_AK00561YV0061 [0,1,0,0,0,0|2,0,1]=4 89 B15R1.115 C=CCNC(=O)N[C@H](C)c1ccccc1 WXVL_AK00561YV0061 [0,1,0,0,0,0|2,0,1]=4 90 B15R1.127 C=CCCC(=O)NCc1cccc(c1)Br WXVL_AK1177SB1035 [0,1,0,0,0,0|2,0,1]=4 91 B15R1.127 C=CCCC(=O)NCc1cccc(c1)Br WXVL_AK1177SB1035 [0,1,0,0,0,0|2,0,1]=4 92 B15R1.127 C=CCCC(=O)NCc1cccc(c1)C WXVL_AK0045SB1035 [0,1,0,0,0,0|2,0,1]=4 93 B15R1.127 C=CCCC(=O)NCc1cccc(c1)C WXVL_AK0045SB1035 [0,1,0,0,0,0|2,0,1]=4 94 B15R1.127 C=CCCC(=O)NCc1cccc(c1)Cl WXVL_AK0094SB1035 [0,1,0,0,0,0|2,0,1]=4 95 B15R1.127 C=CCCC(=O)NCc1cccc(c1)Cl WXVL_AK0094SB1035 [0,1,0,0,0,0|2,0,1]=4 96 B15R1.127 C=CCCC(=O)NCc1cccc(c1)F WXVL_AK0041SB1035 [0,1,0,0,0,0|2,0,1]=4 97 B15R1.127 C=CCCC(=O)NCc1cccc(c1)F WXVL_AK0041SB1035 [0,1,0,0,0,0|2,0,1]=4 98 B15R1.127 C=CCCC(=O)NCc1cccc(c1)I WXVL_AK1572SB1035 [0,1,0,0,0,0|2,0,1]=4 99 B15R1.127 C=CCCC(=O)NCc1cccc(c1)I WXVL_AK1572SB1035 [0,1,0,0,0,0|2,0,1]=4 100 B15R1.127 C=CCCC(=O)NCc1cccc(c1)O WXVL_AK0974SB1035 [0,1,0,0,0,0|2,0,1]=4 101 B15R1.127 C=CCCC(=O)NCc1cccc(c1)O WXVL_AK0974SB1035 [0,1,0,0,0,0|2,0,1]=4 102 B15R1.127 C=CCNC(=O)C=Cc1cccc(c1)Cl WXVL_AK00561SB1601 [0,1,0,0,0,0|1,0,0]=2 103 B15R1.127 C=CCNC(=O)C=Cc1cccc(c1)Cl WXVL_AK00561SB1601 [0,1,0,0,0,0|1,0,0]=2 104 B15R1.127 C=CCNC(=O)C=Cc1cccc(c1)O WXVL_AK00561SB0417 [0,1,0,0,0,0|1,0,0]=2 105 B15R1.127 C=CCNC(=O)C=Cc1cccc(c1)O WXVL_AK00561SB0417 [0,1,0,0,0,0|1,0,0]=2 106 B15R1.127 C=CCNC(=O)CCc1cccc(c1)Br WXVL_AK00561SB0278 [0,1,0,0,0,0|1,0,2]=4 107 B15R1.127 C=CCNC(=O)CCc1cccc(c1)Br WXVL_AK00561SB0278 [0,1,0,0,0,0|1,0,2]=4 108 B15R1.127 C=CCNC(=O)CCc1cccc(c1)C WXVL_AK00561SB1394 [0,1,0,0,0,0|1,0,2]=4 109 B15R1.127 C=CCNC(=O)CCc1cccc(c1)C WXVL_AK00561SB1394 [0,1,0,0,0,0|1,0,2]=4 110 B15R1.127 C=CCNC(=O)CCc1cccc(c1)O WXVL_AK00561SB3088 [0,1,0,0,0,0|1,0,2]=4 111 B15R1.127 C=CCNC(=O)CCc1cccc(c1)O WXVL_AK00561SB3088 [0,1,0,0,0,0|1,0,2]=4 112 B15R1.127 C=CCNC(=O)COc1cccc(c1)Cl WXVL_AK00561SB0493 [0,1,0,0,0,0|2,0,1]=4 113 B15R1.127 C=CCNC(=O)COc1cccc(c1)Cl WXVL_AK00561SB0493 [0,1,0,0,0,0|2,0,1]=4 114 B15R1.127 C=CCNC(=O)NCc1cccc(c1)C WXVL_AK00561YV0178 [0,1,0,0,0,0|2,0,1]=4 115 B15R1.127 C=CCNC(=O)NCc1cccc(c1)C WXVL_AK00561YV0178 [0,1,0,0,0,0|2,0,1]=4 116 B15R1.127 C=CCNC(=O)NCc1cccc(c1)F WXVL_AK00561YV0073 [0,1,0,0,0,0|2,0,1]=4 117 B15R1.127 C=CCNC(=O)NCc1cccc(c1)F WXVL_AK00561YV0073 [0,1,0,0,0,0|2,0,1]=4 118 B15R1.127 CCCNC(=O)C=Cc1cccc(c1)Cl WXVL_AK00504SB1601 [0,1,0,0,0,0|1,0,2]=4 119 B15R1.127 CCCNC(=O)C=Cc1cccc(c1)Cl WXVL_AK00504SB1601 [0,1,0,0,0,0|1,0,2]=4 120 B15R1.127 CCCNC(=O)C=Cc1cccc(c1)O WXVL_AK00504SB0417 [0,1,0,0,0,0|1,0,2]=4 121 B15R1.127 CCCNC(=O)C=Cc1cccc(c1)O WXVL_AK00504SB0417 [0,1,0,0,0,0|1,0,2]=4 122 B15R1.127 N#CCNC(=O)C=Cc1cccc(c1)Cl WXVL_AK0683SB1601 [0,1,0,0,0,0|2,0,1]=4 123 B15R1.127 N#CCNC(=O)C=Cc1cccc(c1)Cl WXVL_AK0683SB1601 [0,1,0,0,0,0|2,0,1]=4 124 B15R1.127 N#CCNC(=O)C=Cc1cccc(c1)O WXVL_AK0683SB0417 [0,1,0,0,0,0|2,0,1]=4 125 B15R1.127 N#CCNC(=O)C=Cc1cccc(c1)O WXVL_AK0683SB0417 [0,1,0,0,0,0|2,0,1]=4 126 B15R1.127 O=C(C=Cc1cccc(c1)Cl)NCCF WXVL_AK00466SB1601 [0,1,0,0,0,0|2,0,1]=4 127 B15R1.127 O=C(C=Cc1cccc(c1)Cl)NCCF WXVL_AK00466SB1601 [0,1,0,0,0,0|2,0,1]=4 128 B15R1.127 O=C(C=Cc1cccc(c1)O)NCCF WXVL_AK00466SB0417 [0,1,0,0,0,0|2,0,1]=4 129 B15R1.127 O=C(C=Cc1cccc(c1)O)NCCF WXVL_AK00466SB0417 [0,1,0,0,0,0|2,0,1]=4 130 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)Br WXVL_AK1474SB1035 [0,1,0,0,0,0|2,0,1]=4 131 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)Br WXVL_AK1474SB1035 [0,1,0,0,0,0|2,0,1]=4 132 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)C WXVL_AK0048SB1035 [0,1,0,0,0,0|2,0,1]=4 133 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)C WXVL_AK0048SB1035 [0,1,0,0,0,0|2,0,1]=4 134 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)Cl WXVL_AK0047SB1035 [0,1,0,0,0,0|2,0,1]=4 135 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)Cl WXVL_AK0047SB1035 [0,1,0,0,0,0|2,0,1]=4 136 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)F WXVL_AK0046SB1035 [0,1,0,0,0,0|2,0,1]=4 137 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)F WXVL_AK0046SB1035 [0,1,0,0,0,0|2,0,1]=4 138 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)I WXVL_AK1644SB1035 [0,1,0,0,0,0|2,0,1]=4 139 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)I WXVL_AK1644SB1035 [0,1,0,0,0,0|2,0,1]=4 140 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)O WXVL_AK0926SB1035 [0,1,0,0,0,0|2,0,1]=4 141 B15R1.139 C=CCCC(=O)NCc1ccc(cc1)O WXVL_AK0926SB1035 [0,1,0,0,0,0|2,0,1]=4 142 B15R1.139 C=CCNC(=O)/C=C/c1ccc(cc1)O WXVL_AK00561SB0418 [0,1,0,0,0,0|1,0,0]=2 143 B15R1.139 C=CCNC(=O)/C=C/c1ccc(cc1)O WXVL_AK00561SB0418 [0,1,0,0,0,0|1,0,0]=2 144 B15R1.139 C=CCNC(=O)C#Cc1ccc(cc1)Cl WXVL_AK00561SB3517 [0,1,0,0,0,0|1,0,2]=4 145 B15R1.139 C=CCNC(=O)C#Cc1ccc(cc1)Cl WXVL_AK00561SB3517 [0,1,0,0,0,0|1,0,2]=4 146 B15R1.139 C=CCNC(=O)C=Cc1ccc(cc1)Br WXVL_AK00561SB1122 [0,1,0,0,0,0|1,0,0]=2 147 B15R1.139 C=CCNC(=O)C=Cc1ccc(cc1)Br WXVL_AK00561SB1122 [0,1,0,0,0,0|1,0,0]=2 148 B15R1.139 C=CCNC(=O)C=Cc1ccc(cc1)C WXVL_AK00561SB0060 [0,1,0,0,0,0|1,0,0]=2 149 B15R1.139 C=CCNC(=O)C=Cc1ccc(cc1)C WXVL_AK00561SB0060 [0,1,0,0,0,0|1,0,0]=2 150 B15R1.139 C=CCNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00561SB0119 [0,1,0,0,0,0|1,0,0]=2 151 B15R1.139 C=CCNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00561SB0119 [0,1,0,0,0,0|1,0,0]=2 152 B15R1.139 C=CCNC(=O)C=Cc1ccc(cc1)F WXVL_AK00561SB1186 [0,1,0,0,0,0|1,0,0]=2 153 B15R1.139 C=CCNC(=O)C=Cc1ccc(cc1)F WXVL_AK00561SB1186 [0,1,0,0,0,0|1,0,0]=2 154 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)Br WXVL_AK00561SB1166 [0,1,0,0,0,0|1,0,2]=4 155 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)Br WXVL_AK00561SB1166 [0,1,0,0,0,0|1,0,2]=4 156 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)C WXVL_AK00561SB0421 [0,1,0,0,0,0|1,0,2]=4 157 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)C WXVL_AK00561SB0421 [0,1,0,0,0,0|1,0,2]=4 158 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)F WXVL_AK00561SB1123 [0,1,0,0,0,0|1,0,2]=4 159 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)F WXVL_AK00561SB1123 [0,1,0,0,0,0|1,0,2]=4 160 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)O WXVL_AK00561SB2324 [0,1,0,0,0,0|1,0,2]=4 161 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)O WXVL_AK00561SB2324 [0,1,0,0,0,0|1,0,2]=4 162 B15R1.139 C=CCNC(=O)COc1ccc(cc1)C WXVL_AK00561SB0138 [0,1,0,0,0,0|2,0,1]=4 163 B15R1.139 C=CCNC(=O)COc1ccc(cc1)C WXVL_AK00561SB0138 [0,1,0,0,0,0|2,0,1]=4 164 B15R1.139 C=CCNC(=O)COc1ccc(cc1)F WXVL_AK00561SB0088 [0,1,0,0,0,0|2,0,1]=4 165 B15R1.139 C=CCNC(=O)COc1ccc(cc1)F WXVL_AK00561SB0088 [0,1,0,0,0,0|2,0,1]=4 166 B15R1.139 C=CCNC(=O)COc1ccc(cc1)O WXVL_AK00561SB3388 [0,1,0,0,0,0|2,0,1]=4 167 B15R1.139 C=CCNC(=O)COc1ccc(cc1)O WXVL_AK00561SB3388 [0,1,0,0,0,0|2,0,1]=4 168 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)C WXVL_AK00561SB0830 [0,1,0,0,0,0|2,0,1]=4 169 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)C WXVL_AK00561SB0830 [0,1,0,0,0,0|2,0,1]=4 170 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)C WXVL_AK00561YV0067 [0,1,0,0,0,0|2,0,1]=4 171 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)C WXVL_AK00561YV0067 [0,1,0,0,0,0|2,0,1]=4 172 B15R1.139 CCCNC(=O)/C=C/c1ccc(cc1)O WXVL_AK00504SB0418 [0,1,0,0,0,0|1,0,2]=4 173 B15R1.139 CCCNC(=O)/C=C/c1ccc(cc1)O WXVL_AK00504SB0418 [0,1,0,0,0,0|1,0,2]=4 174 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)Br WXVL_AK00504SB1122 [0,1,0,0,0,0|1,0,2]=4 175 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)Br WXVL_AK00504SB1122 [0,1,0,0,0,0|1,0,2]=4 176 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)C WXVL_AK00504SB0060 [0,1,0,0,0,0|1,0,2]=4 177 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)C WXVL_AK00504SB0060 [0,1,0,0,0,0|1,0,2]=4 178 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00504SB0119 [0,1,0,0,0,0|1,0,2]=4 179 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00504SB0119 [0,1,0,0,0,0|1,0,2]=4 180 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)F WXVL_AK00504SB1186 [0,1,0,0,0,0|1,0,2]=4 181 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)F WXVL_AK00504SB1186 [0,1,0,0,0,0|1,0,2]=4 182 B15R1.139 Cc1ccc(cc1)C=CC(=O)NCC#N WXVL_AK0683SB0060 [0,1,0,0,0,0|2,0,1]=4 183 B15R1.139 Cc1ccc(cc1)C=CC(=O)NCC#N WXVL_AK0683SB0060 [0,1,0,0,0,0|2,0,1]=4 184 B15R1.139 Cc1ccc(cc1)C=CC(=O)NCCF WXVL_AK00466SB0060 [0,1,0,0,0,0|2,0,1]=4 185 B15R1.139 Cc1ccc(cc1)C=CC(=O)NCCF WXVL_AK00466SB0060 [0,1,0,0,0,0|2,0,1]=4 186 B15R1.139 N#CCNC(=O)/C=C/c1ccc(cc1)O WXVL_AK0683SB0418 [0,1,0,0,0,0|2,0,1]=4 187 B15R1.139 N#CCNC(=O)/C=C/c1ccc(cc1)O WXVL_AK0683SB0418 [0,1,0,0,0,0|2,0,1]=4 188 B15R1.139 N#CCNC(=O)C=Cc1ccc(cc1)Br WXVL_AK0683SB1122 [0,1,0,0,0,0|2,0,1]=4 189 B15R1.139 N#CCNC(=O)C=Cc1ccc(cc1)Br WXVL_AK0683SB1122 [0,1,0,0,0,0|2,0,1]=4 190 B15R1.139 N#CCNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK0683SB0119 [0,1,0,0,0,0|2,0,1]=4 191 B15R1.139 N#CCNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK0683SB0119 [0,1,0,0,0,0|2,0,1]=4 192 B15R1.139 N#CCNC(=O)C=Cc1ccc(cc1)F WXVL_AK0683SB1186 [0,1,0,0,0,0|2,0,1]=4 193 B15R1.139 N#CCNC(=O)C=Cc1ccc(cc1)F WXVL_AK0683SB1186 [0,1,0,0,0,0|2,0,1]=4 194 B15R1.139 O=C(/C=C/c1ccc(cc1)O)NCCF WXVL_AK00466SB0418 [0,1,0,0,0,0|2,0,1]=4 195 B15R1.139 O=C(/C=C/c1ccc(cc1)O)NCCF WXVL_AK00466SB0418 [0,1,0,0,0,0|2,0,1]=4 196 B15R1.139 O=C(C=Cc1ccc(cc1)Br)NCCF WXVL_AK00466SB1122 [0,1,0,0,0,0|2,0,1]=4 197 B15R1.139 O=C(C=Cc1ccc(cc1)Br)NCCF WXVL_AK00466SB1122 [0,1,0,0,0,0|2,0,1]=4 198 B15R1.139 O=C(C=Cc1ccc(cc1)Cl)NCCF WXVL_AK00466SB0119 [0,1,0,0,0,0|2,0,1]=4 199 B15R1.139 O=C(C=Cc1ccc(cc1)Cl)NCCF WXVL_AK00466SB0119 [0,1,0,0,0,0|2,0,1]=4 200 B15R1.139 O=C(C=Cc1ccc(cc1)F)NCCF WXVL_AK00466SB1186 [0,1,0,0,0,0|2,0,1]=4 201 B15R1.139 O=C(C=Cc1ccc(cc1)F)NCCF WXVL_AK00466SB1186 [0,1,0,0,0,0|2,0,1]=4 202 B15R1.551 C=CCCC(=O)N(C)Cc1ccccc1 WXVL_AN0033SB1035 [0,1,0,0,0,0|2,0,1]=4 203 B15R1.551 C=CCCC(=O)N(C)Cc1ccccc1 WXVL_AN0033SB1035 [0,1,0,0,0,0|2,0,1]=4 204 B15R1.551 C=CCNC(=O)/C(=C/c1cccnc1)/C WXVL_AK00561SA1933 [0,1,0,0,0,0|2,0,0]=3 205 B15R1.551 C=CCNC(=O)/C(=C/c1cccnc1)/C WXVL_AK00561SA1933 [0,1,0,0,0,0|2,0,0]=3 206 B15R1.551 C=CCNC(=O)C(=C)Cc1ccccc1 WXVL_AK00561SB0413 [0,1,0,0,0,0|1,0,1]=3 207 B15R1.551 C=CCNC(=O)C(=C)Cc1ccccc1 WXVL_AK00561SB0413 [0,1,0,0,0,0|1,0,1]=3 208 B15R1.551 C=CCNC(=O)C(C)Cc1ccccc1 WXVL_AK00561SB3205 [0,1,0,0,0,0|1,0,2]=4 209 B15R1.551 C=CCNC(=O)C(C)Cc1ccccc1 WXVL_AK00561SB3205 [0,1,0,0,0,0|1,0,2]=4 210 B15R1.551 C=CCNC(=O)C(C)Oc1ccccc1 WXVL_AK00561SB0426 [0,1,0,0,0,0|2,0,1]=4 211 B15R1.551 C=CCNC(=O)C(C)Oc1ccccc1 WXVL_AK00561SB0426 [0,1,0,0,0,0|2,0,1]=4 212 B15R1.551 C=CCNC(=O)C(C)Sc1ccccc1 WXVL_AK00561SB9992 [0,1,0,0,0,0|2,0,1]=4 213 B15R1.551 C=CCNC(=O)C(C)Sc1ccccc1 WXVL_AK00561SB9992 [0,1,0,0,0,0|2,0,1]=4 214 B15R1.551 C=CCNC(=O)[C@@H](C)Oc1ccccc1 WXVL_AK00561SB5803 [0,1,0,0,0,0|2,0,1]=4 215 B15R1.551 C=CCNC(=O)[C@@H](C)Oc1ccccc1 WXVL_AK00561SB5803 [0,1,0,0,0,0|2,0,1]=4 216 B15R1.551 C=CCOC(C)C(=O)Nc1ccccc1 WXVL_AG00183SBD933 [0,1,0,0,0,0|2,0,1]=4 217 B15R1.551 C=CCOC(C)C(=O)Nc1ccccc1 WXVL_AG00183SBD933 [0,1,0,0,0,0|2,0,1]=4 218 B15R1.741 C#C[C@@H](C)NC(=O)/C=C/c1ccccc1 WXVL_AK00735SB0115 [0,1,0,0,0,0|1,0,2]=4 219 B15R1.741 C#C[C@@H](C)NC(=O)/C=C/c1ccccc1 WXVL_AK00735SB0115 [0,1,0,0,0,0|1,0,2]=4 220 B15R1.741 C=CC(C)NC(=O)/C=C/c1ccccc1 WXVL_AK00769SB0115 [0,1,0,0,0,0|1,0,0]=2 221 B15R1.741 C=CC(C)NC(=O)/C=C/c1ccccc1 WXVL_AK00769SB0115 [0,1,0,0,0,0|1,0,0]=2 222 B15R1.741 C=CC(C)NC(=O)/C=C/c1cccnc1 WXVL_AK00769SA0193 [0,1,0,0,0,0|2,0,0]=3 223 B15R1.741 C=CC(C)NC(=O)/C=C/c1cccnc1 WXVL_AK00769SA0193 [0,1,0,0,0,0|2,0,0]=3 224 B15R1.741 C=CC(C)NC(=O)/C=C/c1cnccn1 WXVL_AK00769SA2885 [0,1,0,0,0,0|3,0,0]=4 225 B15R1.741 C=CC(C)NC(=O)/C=C/c1cnccn1 WXVL_AK00769SA2885 [0,1,0,0,0,0|3,0,0]=4 226 B15R1.741 C=CC(C)NC(=O)C#Cc1ccccc1 WXVL_AK00769SB0114 [0,1,0,0,0,0|1,0,2]=4 227 B15R1.741 C=CC(C)NC(=O)C#Cc1ccccc1 WXVL_AK00769SB0114 [0,1,0,0,0,0|1,0,2]=4 228 B15R1.741 C=CC(C)NC(=O)CCc1ccccc1 WXVL_AK00769SB0067 [0,1,0,0,0,0|1,0,2]=4 229 B15R1.741 C=CC(C)NC(=O)CCc1ccccc1 WXVL_AK00769SB0067 [0,1,0,0,0,0|1,0,2]=4 230 B15R1.741 C=CC(C)NC(=O)COc1ccccc1 WXVL_AK00769SB0086 [0,1,0,0,0,0|2,0,1]=4 231 B15R1.741 C=CC(C)NC(=O)COc1ccccc1 WXVL_AK00769SB0086 [0,1,0,0,0,0|2,0,1]=4 232 B15R1.741 C=CC(C)NC(=O)CSc1ccccc1 WXVL_AK00769SB0113 [0,1,0,0,0,0|2,0,1]=4 233 B15R1.741 C=CC(C)NC(=O)CSc1ccccc1 WXVL_AK00769SB0113 [0,1,0,0,0,0|2,0,1]=4 234 B15R1.741 CC(C#N)NC(=O)/C=C/c1ccccc1 WXVL_AK00810SB0115 [0,1,0,0,0,0|2,0,1]=4 235 B15R1.741 CC(C#N)NC(=O)/C=C/c1ccccc1 WXVL_AK00810SB0115 [0,1,0,0,0,0|2,0,1]=4 236 B15R1.741 CC[C@H](C)NC(=O)/C=C/c1ccccc1 WXVL_AK00678SB0115 [0,1,0,0,0,0|1,0,2]=4 237 B15R1.741 CC[C@H](C)NC(=O)/C=C/c1ccccc1 WXVL_AK00678SB0115 [0,1,0,0,0,0|1,0,2]=4 238 B15R1.741 C[C@@H](CF)NC(=O)/C=C/c1ccccc1 WXVL_AK00558SB0115 [0,1,0,0,0,0|2,0,1]=4 239 B15R1.741 C[C@@H](CF)NC(=O)/C=C/c1ccccc1 WXVL_AK00558SB0115 [0,1,0,0,0,0|2,0,1]=4 240 B15R1.741 C[C@@H](CO)NC(=O)/C=C/c1ccccc1 WXVL_AK0109SB0115 [0,1,0,0,0,0|2,0,1]=4 241 B15R1.741 C[C@@H](CO)NC(=O)/C=C/c1ccccc1 WXVL_AK0109SB0115 [0,1,0,0,0,0|2,0,1]=4 242 B15R1.826 CN(CC#N)C(=O)/C=C/c1ccccc1 WXVL_AN2942SB0115 [0,1,0,0,0,0|2,0,1]=4 243 B15R1.826 CN(CC#N)C(=O)/C=C/c1ccccc1 WXVL_AN2942SB0115 [0,1,0,0,0,0|2,0,1]=4 244 B15R1.826 CN(CCO)C(=O)/C=C/c1ccccc1 WXVL_AN2670SB0115 [0,1,0,0,0,0|2,0,1]=4 245 B15R1.826 CN(CCO)C(=O)/C=C/c1ccccc1 WXVL_AN2670SB0115 [0,1,0,0,0,0|2,0,1]=4 246 B15R1.1208 C=CCCC(=O)NCc1ccccc1Br WXVL_AK1632SB1035 [0,1,0,0,0,0|2,0,1]=4 247 B15R1.1208 C=CCCC(=O)NCc1ccccc1Br WXVL_AK1632SB1035 [0,1,0,0,0,0|2,0,1]=4 248 B15R1.1208 C=CCCC(=O)NCc1ccccc1C WXVL_AK0040SB1035 [0,1,0,0,0,0|2,0,1]=4 249 B15R1.1208 C=CCCC(=O)NCc1ccccc1C WXVL_AK0040SB1035 [0,1,0,0,0,0|2,0,1]=4 250 B15R1.1208 C=CCCC(=O)NCc1ccccc1Cl WXVL_AK0038SB1035 [0,1,0,0,0,0|2,0,1]=4 251 B15R1.1208 C=CCCC(=O)NCc1ccccc1Cl WXVL_AK0038SB1035 [0,1,0,0,0,0|2,0,1]=4 252 B15R1.1208 C=CCCC(=O)NCc1ccccc1F WXVL_AK0037SB1035 [0,1,0,0,0,0|2,0,1]=4 253 B15R1.1208 C=CCCC(=O)NCc1ccccc1F WXVL_AK0037SB1035 [0,1,0,0,0,0|2,0,1]=4 254 B15R1.1208 C=CCCC(=O)NCc1ccccc1I WXVL_AK3923SB1035 [0,1,0,0,0,0|2,0,1]=4 255 B15R1.1208 C=CCCC(=O)NCc1ccccc1I WXVL_AK3923SB1035 [0,1,0,0,0,0|2,0,1]=4 256 B15R1.1208 C=CCCC(=O)NCc1ccccc1O WXVL_AK0963SB1035 [0,1,0,0,0,0|2,0,1]=4 257 B15R1.1208 C=CCCC(=O)NCc1ccccc1O WXVL_AK0963SB1035 [0,1,0,0,0,0|2,0,1]=4 258 B15R1.1208 C=CCNC(=O)C=Cc1ccccc1Br WXVL_AK00561SB3065 [0,1,0,0,0,0|1,0,0]=2 259 B15R1.1208 C=CCNC(=O)C=Cc1ccccc1Br WXVL_AK00561SB3065 [0,1,0,0,0,0|1,0,0]=2 260 B15R1.1208 C=CCNC(=O)CCc1ccccc1Br WXVL_AK00561SB1278 [0,1,0,0,0,0|1,0,2]=4 261 B15R1.1208 C=CCNC(=O)CCc1ccccc1Br WXVL_AK00561SB1278 [0,1,0,0,0,0|1,0,2]=4 262 B15R1.1208 C=CCNC(=O)CCc1ccccc1C WXVL_AK00561SB0422 [0,1,0,0,0,0|1,0,2]=4 263 B15R1.1208 C=CCNC(=O)CCc1ccccc1C WXVL_AK00561SB0422 [0,1,0,0,0,0|1,0,2]=4 264 B15R1.1208 C=CCNC(=O)CCc1ccccc1Cl WXVL_AK00561SB0140 [0,1,0,0,0,0|1,0,2]=4 265 B15R1.1208 C=CCNC(=O)CCc1ccccc1Cl WXVL_AK00561SB0140 [0,1,0,0,0,0|1,0,2]=4 266 B15R1.1208 C=CCNC(=O)CCc1ccccc1F WXVL_AK00561SB0008 [0,1,0,0,0,0|1,0,2]=4 267 B15R1.1208 C=CCNC(=O)CCc1ccccc1F WXVL_AK00561SB0008 [0,1,0,0,0,0|1,0,2]=4 268 B15R1.1208 C=CCNC(=O)COc1ccccc1C WXVL_AK00561SB0136 [0,1,0,0,0,0|2,0,1]=4 269 B15R1.1208 C=CCNC(=O)COc1ccccc1C WXVL_AK00561SB0136 [0,1,0,0,0,0|2,0,1]=4 270 B15R1.1208 C=CCNC(=O)COc1ccccc1F WXVL_AK00561SB0441 [0,1,0,0,0,0|2,0,1]=4 271 B15R1.1208 C=CCNC(=O)COc1ccccc1F WXVL_AK00561SB0441 [0,1,0,0,0,0|2,0,1]=4 272 B15R1.1208 CCCNC(=O)C=Cc1ccccc1Br WXVL_AK00504SB3065 [0,1,0,0,0,0|1,0,2]=4 273 B15R1.1208 CCCNC(=O)C=Cc1ccccc1Br WXVL_AK00504SB3065 [0,1,0,0,0,0|1,0,2]=4 274 B15R1.1208 N#CCNC(=O)C=Cc1ccccc1Br WXVL_AK0683SB3065 [0,1,0,0,0,0|2,0,1]=4 275 B15R1.1208 N#CCNC(=O)C=Cc1ccccc1Br WXVL_AK0683SB3065 [0,1,0,0,0,0|2,0,1]=4 276 B15R1.1208 O=C(C=Cc1ccccc1Br)NCCF WXVL_AK00466SB3065 [0,1,0,0,0,0|2,0,1]=4 277 B15R1.1208 O=C(C=Cc1ccccc1Br)NCCF WXVL_AK00466SB3065 [0,1,0,0,0,0|2,0,1]=4 278 B15R1.5919 C=C(C)CNC(=O)/C=C/c1ccccc1 WXVL_AK0761SB0115 [0,1,0,0,0,0|1,0,0]=2 279 B15R1.5919 C=C(C)CNC(=O)/C=C/c1ccccc1 WXVL_AK0761SB0115 [0,1,0,0,0,0|1,0,0]=2 280 B15R1.5919 C=C(C)CNC(=O)/C=C/c1cccnc1 WXVL_AK0761SA0193 [0,1,0,0,0,0|2,0,0]=3 281 B15R1.5919 C=C(C)CNC(=O)/C=C/c1cccnc1 WXVL_AK0761SA0193 [0,1,0,0,0,0|2,0,0]=3 282 B15R1.5919 C=C(C)CNC(=O)/C=C/c1cnccn1 WXVL_AK0761SA2885 [0,1,0,0,0,0|3,0,0]=4 283 B15R1.5919 C=C(C)CNC(=O)/C=C/c1cnccn1 WXVL_AK0761SA2885 [0,1,0,0,0,0|3,0,0]=4 284 B15R1.5919 C=C(C)CNC(=O)C#Cc1ccccc1 WXVL_AK0761SB0114 [0,1,0,0,0,0|1,0,2]=4 285 B15R1.5919 C=C(C)CNC(=O)C#Cc1ccccc1 WXVL_AK0761SB0114 [0,1,0,0,0,0|1,0,2]=4 286 B15R1.5919 C=C(C)CNC(=O)CCc1ccccc1 WXVL_AK0761SB0067 [0,1,0,0,0,0|1,0,2]=4 287 B15R1.5919 C=C(C)CNC(=O)CCc1ccccc1 WXVL_AK0761SB0067 [0,1,0,0,0,0|1,0,2]=4 288 B15R1.5919 C=C(C)CNC(=O)COc1ccccc1 WXVL_AK0761SB0086 [0,1,0,0,0,0|2,0,1]=4 289 B15R1.5919 C=C(C)CNC(=O)COc1ccccc1 WXVL_AK0761SB0086 [0,1,0,0,0,0|2,0,1]=4 290 B15R1.5919 C=C(C)CNC(=O)CSc1ccccc1 WXVL_AK0761SB0113 [0,1,0,0,0,0|2,0,1]=4 291 B15R1.5919 C=C(C)CNC(=O)CSc1ccccc1 WXVL_AK0761SB0113 [0,1,0,0,0,0|2,0,1]=4 292 B15R1.5919 CC(C)CNC(=O)/C=C/c1ccccc1 WXVL_AK00544SB0115 [0,1,0,0,0,0|1,0,2]=4 293 B15R1.5919 CC(C)CNC(=O)/C=C/c1ccccc1 WXVL_AK00544SB0115 [0,1,0,0,0,0|1,0,2]=4 294 B15R1.5919 CC(O)CNC(=O)/C=C/c1ccccc1 WXVL_AK0052SB0115 [0,1,0,0,0,0|1,0,2]=4 295 B15R1.5919 CC(O)CNC(=O)/C=C/c1ccccc1 WXVL_AK0052SB0115 [0,1,0,0,0,0|1,0,2]=4 296 B15R1.5919 C[C@H](O)CNC(=O)/C=C/c1ccccc1 WXVL_AK0113SB0115 [0,1,0,0,0,0|1,0,2]=4 297 B15R1.5919 C[C@H](O)CNC(=O)/C=C/c1ccccc1 WXVL_AK0113SB0115 [0,1,0,0,0,0|1,0,2]=4 298 B15R1.5919 NC(=O)CNC(=O)/C=C/c1ccccc1 WXVL_AK0147SB0115 [0,1,0,0,0,0|2,0,0]=3 299 B15R1.5919 NC(=O)CNC(=O)/C=C/c1ccccc1 WXVL_AK0147SB0115 [0,1,0,0,0,0|2,0,0]=3 300 B15R1.5919 NC(=O)CNC(=O)/C=C/c1cccnc1 WXVL_AK0147SA0193 [0,1,0,0,0,0|3,0,0]=4 301 B15R1.5919 NC(=O)CNC(=O)/C=C/c1cccnc1 WXVL_AK0147SA0193 [0,1,0,0,0,0|3,0,0]=4 302 B15R1.5919 O=C(/C=C/c1ccccc1)NCC(F)F WXVL_AK0136SB0115 [0,1,0,0,0,0|2,0,1]=4 303 B15R1.5919 O=C(/C=C/c1ccccc1)NCC(F)F WXVL_AK0136SB0115 [0,1,0,0,0,0|2,0,1]=4 304 B15R1.5934 C=CCNS(=O)(=O)/C=C/c1ccccc1 WXVL_AK00561HU0026 [0,1,0,0,0,0|2,0,0]=3 305 B15R1.5934 C=CCNS(=O)(=O)/C=C/c1ccccc1 WXVL_AK00561HU0026 [0,1,0,0,0,0|2,0,0]=3 306 B15R2.352 C=CCNc1ncc2ccccc2n1 WXVL_AK00561LP0064 [0,0,0,1,0,0|3,0,0]=4 307 B15R2.352 C=CCNc1ncc2ccccc2n1 WXVL_AK00561LP0064 [0,0,0,1,0,0|3,0,0]=4 308 B15R2.24494 O=C(/C=C/c1ccccc1)NC2CC2 WXVL_AK0001SB0115 [0,0,0,1,0,0|1,0,2]=4 309 B15R2.24494 O=C(/C=C/c1ccccc1)NC2CC2 WXVL_AK0001SB0115 [0,0,0,1,0,0|1,0,2]=4 310 B13R1.44 C=CCCC(=O)Nc1ccccc1 WXVL_AG00183SB1035 [0,0,0,0,1,0|2,0,0]=3 311 B13R1.44 C=CCCC(=O)Nc1ccccc1 WXVL_AG00183SB1035 [0,0,0,0,1,0|2,0,0]=3 312 B13R1.44 C=CCCC(=O)Nc1ccccn1 WXVL_AF00298SB1035 [0,0,0,0,1,0|3,0,0]=4 313 B13R1.44 C=CCCC(=O)Nc1ccccn1 WXVL_AF00298SB1035 [0,0,0,0,1,0|3,0,0]=4 314 B13R1.44 C=CCNC(=O)Cc1ccccc1 WXVL_AK00561SB0092 [0,0,0,0,1,0|1,0,1]=3 315 B13R1.44 C=CCNC(=O)Cc1ccccc1 WXVL_AK00561SB0092 [0,0,0,0,1,0|1,0,1]=3 316 B13R1.44 C=CCNC(=O)Cc1ccccn1 WXVL_AK00561SA0032 [0,0,0,0,1,0|2,0,1]=4 317 B13R1.44 C=CCNC(=O)Cc1ccccn1 WXVL_AK00561SA0032 [0,0,0,0,1,0|2,0,1]=4 318 B13R1.44 C=CCNC(=O)Cc1cccnc1 WXVL_AK00561SA0029 [0,0,0,0,1,0|2,0,1]=4 319 B13R1.44 C=CCNC(=O)Cc1cccnc1 WXVL_AK00561SA0029 [0,0,0,0,1,0|2,0,1]=4 320 B13R1.44 C=CCNC(=O)Cc1cccnc1 WXVL_AK00561SB00049 [0,0,0,0,1,0|2,0,1]=4 321 B13R1.44 C=CCNC(=O)Cc1cccnc1 WXVL_AK00561SB00049 [0,0,0,0,1,0|2,0,1]=4 322 B13R1.44 C=CCNC(=O)Cc1ccncc1 WXVL_AK00561SA00106 [0,0,0,0,1,0|2,0,1]=4 323 B13R1.44 C=CCNC(=O)Cc1ccncc1 WXVL_AK00561SA00106 [0,0,0,0,1,0|2,0,1]=4 324 B13R1.44 C=CCNC(=O)Nc1ccccn1 WXVL_AK00561YV0189 [0,0,0,0,1,0|3,0,0]=4 325 B13R1.44 C=CCNC(=O)Nc1ccccn1 WXVL_AK00561YV0189 [0,0,0,0,1,0|3,0,0]=4 326 B13R1.153 C=CCNC(=O)/C=C/c1c[nH]cn1 WXVL_AK00561SA0730 [0,0,0,0,1,0|3,0,0]=4 327 B13R1.153 C=CCNC(=O)/C=C/c1c[nH]cn1 WXVL_AK00561SA0730 [0,0,0,0,1,0|3,0,0]=4 328 B13R1.153 C=CCNC(=O)/C=C/c1ccco1 WXVL_AK00561SA0180 [0,0,0,0,1,0|2,0,0]=3 329 B13R1.153 C=CCNC(=O)/C=C/c1ccco1 WXVL_AK00561SA0180 [0,0,0,0,1,0|2,0,0]=3 330 B13R1.153 C=CCNC(=O)/C=C/c1cccs1 WXVL_AK00561SA0001 [0,0,0,0,1,0|2,0,0]=3 331 B13R1.153 C=CCNC(=O)/C=C/c1cccs1 WXVL_AK00561SA0001 [0,0,0,0,1,0|2,0,0]=3 332 B13R1.153 C=CCNC(=O)/C=C/c1ccoc1 WXVL_AK00561SA0047 [0,0,0,0,1,0|2,0,0]=3 333 B13R1.153 C=CCNC(=O)/C=C/c1ccoc1 WXVL_AK00561SA0047 [0,0,0,0,1,0|2,0,0]=3 334 B13R1.153 C=CCNC(=O)/C=C/c1ccsc1 WXVL_AK00561SA0251 [0,0,0,0,1,0|2,0,0]=3 335 B13R1.153 C=CCNC(=O)/C=C/c1ccsc1 WXVL_AK00561SA0251 [0,0,0,0,1,0|2,0,0]=3 336 B15R1.157 C=CCCC(=O)NCCc1ccccc1 WXVL_AK00498SB1035 [0,0,0,0,0,1|1,0,2]=4 337 B15R1.157 C=CCCC(=O)NCCc1ccccc1 WXVL_AK00498SB1035 [0,0,0,0,0,1|1,0,2]=4 338 B15R1.157 C=CCNC(=O)CCCc1ccccc1 WXVL_AK00561SB0121 [0,0,0,0,0,1|1,0,2]=4 339 B15R1.157 C=CCNC(=O)CCCc1ccccc1 WXVL_AK00561SB0121 [0,0,0,0,0,1|1,0,2]=4 340 B15R1.157 C=CCNC(=O)CCOc1ccccc1 WXVL_AK00561SB0066 [0,0,0,0,0,1|1,0,2]=4 341 B15R1.157 C=CCNC(=O)CCOc1ccccc1 WXVL_AK00561SB0066 [0,0,0,0,0,1|1,0,2]=4 342 B15R1.157 C=CCNC(=O)COCc1ccccc1 WXVL_AK00561SB0185 [0,0,0,0,0,1|1,0,2]=4 343 B15R1.157 C=CCNC(=O)COCc1ccccc1 WXVL_AK00561SB0185 [0,0,0,0,0,1|1,0,2]=4 344 B12R1.27 CNC(=O)/C=C/c1ccccc1 WXVL_AK00442SB0115 [2,0,0,0,0,0|1,0,0]=3 345 B12R1.27 CNC(=O)/C=C/c1ccccc1 WXVL_AK00442SB0115 [2,0,0,0,0,0|1,0,0]=3 346 B12R1.27 CNC(=O)/C=C/c1cccnc1 WXVL_AK00442SA0193 [2,0,0,0,0,0|2,0,0]=4 347 B12R1.27 CNC(=O)/C=C/c1cccnc1 WXVL_AK00442SA0193 [2,0,0,0,0,0|2,0,0]=4 348 B14R1.32 C=CCC(=O)NCc1cccc(c1)Br WXVL_AK1177SB2732 [1,1,0,0,0,0|1,0,1]=4 349 B14R1.32 C=CCC(=O)NCc1cccc(c1)Br WXVL_AK1177SB2732 [1,1,0,0,0,0|1,0,1]=4 350 B14R1.32 C=CCC(=O)NCc1cccc(c1)C WXVL_AK0045SB2732 [1,1,0,0,0,0|1,0,1]=4 351 B14R1.32 C=CCC(=O)NCc1cccc(c1)C WXVL_AK0045SB2732 [1,1,0,0,0,0|1,0,1]=4 352 B14R1.32 C=CCC(=O)NCc1cccc(c1)Cl WXVL_AK0094SB2732 [1,1,0,0,0,0|1,0,1]=4 353 B14R1.32 C=CCC(=O)NCc1cccc(c1)Cl WXVL_AK0094SB2732 [1,1,0,0,0,0|1,0,1]=4 354 B14R1.32 C=CCC(=O)NCc1cccc(c1)F WXVL_AK0041SB2732 [1,1,0,0,0,0|1,0,1]=4 355 B14R1.32 C=CCC(=O)NCc1cccc(c1)F WXVL_AK0041SB2732 [1,1,0,0,0,0|1,0,1]=4 356 B14R1.32 C=CCC(=O)NCc1cccc(c1)I WXVL_AK1572SB2732 [1,1,0,0,0,0|1,0,1]=4 357 B14R1.32 C=CCC(=O)NCc1cccc(c1)I WXVL_AK1572SB2732 [1,1,0,0,0,0|1,0,1]=4 358 B14R1.32 C=CCC(=O)NCc1cccc(c1)O WXVL_AK0974SB2732 [1,1,0,0,0,0|1,0,1]=4 359 B14R1.32 C=CCC(=O)NCc1cccc(c1)O WXVL_AK0974SB2732 [1,1,0,0,0,0|1,0,1]=4 360 B14R1.32 CCNC(=O)C=Cc1cccc(c1)Cl WXVL_AK00476SB1601 [1,1,0,0,0,0|1,0,1]=4 361 B14R1.32 CCNC(=O)C=Cc1cccc(c1)Cl WXVL_AK00476SB1601 [1,1,0,0,0,0|1,0,1]=4 362 B14R1.32 CCNC(=O)C=Cc1cccc(c1)O WXVL_AK00476SB0417 [1,1,0,0,0,0|1,0,1]=4 363 B14R1.32 CCNC(=O)C=Cc1cccc(c1)O WXVL_AK00476SB0417 [1,1,0,0,0,0|1,0,1]=4 364 B14R1.60 C=CCC(=O)N(C)Cc1ccccc1 WXVL_AN0033SB2732 [1,1,0,0,0,0|1,0,1]=4 365 B14R1.60 C=CCC(=O)N(C)Cc1ccccc1 WXVL_AN0033SB2732 [1,1,0,0,0,0|1,0,1]=4 366 B14R1.60 CCOC(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB4144 [1,1,0,0,0,0|1,0,1]=4 367 B14R1.60 CCOC(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB4144 [1,1,0,0,0,0|1,0,1]=4 368 B14R1.502 C=CCC(=O)NCc1ccc(cc1)Br WXVL_AK1474SB2732 [1,1,0,0,0,0|1,0,1]=4 369 B14R1.502 C=CCC(=O)NCc1ccc(cc1)Br WXVL_AK1474SB2732 [1,1,0,0,0,0|1,0,1]=4 370 B14R1.502 C=CCC(=O)NCc1ccc(cc1)C WXVL_AK0048SB2732 [1,1,0,0,0,0|1,0,1]=4 371 B14R1.502 C=CCC(=O)NCc1ccc(cc1)C WXVL_AK0048SB2732 [1,1,0,0,0,0|1,0,1]=4 372 B14R1.502 C=CCC(=O)NCc1ccc(cc1)Cl WXVL_AK0047SB2732 [1,1,0,0,0,0|1,0,1]=4 373 B14R1.502 C=CCC(=O)NCc1ccc(cc1)Cl WXVL_AK0047SB2732 [1,1,0,0,0,0|1,0,1]=4 374 B14R1.502 C=CCC(=O)NCc1ccc(cc1)F WXVL_AK0046SB2732 [1,1,0,0,0,0|1,0,1]=4 375 B14R1.502 C=CCC(=O)NCc1ccc(cc1)F WXVL_AK0046SB2732 [1,1,0,0,0,0|1,0,1]=4 376 B14R1.502 C=CCC(=O)NCc1ccc(cc1)I WXVL_AK1644SB2732 [1,1,0,0,0,0|1,0,1]=4 377 B14R1.502 C=CCC(=O)NCc1ccc(cc1)I WXVL_AK1644SB2732 [1,1,0,0,0,0|1,0,1]=4 378 B14R1.502 C=CCC(=O)NCc1ccc(cc1)O WXVL_AK0926SB2732 [1,1,0,0,0,0|1,0,1]=4 379 B14R1.502 C=CCC(=O)NCc1ccc(cc1)O WXVL_AK0926SB2732 [1,1,0,0,0,0|1,0,1]=4 380 B14R1.502 CCNC(=O)/C=C/c1ccc(cc1)O WXVL_AK00476SB0418 [1,1,0,0,0,0|1,0,1]=4 381 B14R1.502 CCNC(=O)/C=C/c1ccc(cc1)O WXVL_AK00476SB0418 [1,1,0,0,0,0|1,0,1]=4 382 B14R1.502 CCNC(=O)C=Cc1ccc(cc1)Br WXVL_AK00476SB1122 [1,1,0,0,0,0|1,0,1]=4 383 B14R1.502 CCNC(=O)C=Cc1ccc(cc1)Br WXVL_AK00476SB1122 [1,1,0,0,0,0|1,0,1]=4 384 B14R1.502 CCNC(=O)C=Cc1ccc(cc1)C WXVL_AK00476SB0060 [1,1,0,0,0,0|1,0,1]=4 385 B14R1.502 CCNC(=O)C=Cc1ccc(cc1)C WXVL_AK00476SB0060 [1,1,0,0,0,0|1,0,1]=4 386 B14R1.502 CCNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00476SB0119 [1,1,0,0,0,0|1,0,1]=4 387 B14R1.502 CCNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00476SB0119 [1,1,0,0,0,0|1,0,1]=4 388 B14R1.502 CCNC(=O)C=Cc1ccc(cc1)F WXVL_AK00476SB1186 [1,1,0,0,0,0|1,0,1]=4 389 B14R1.502 CCNC(=O)C=Cc1ccc(cc1)F WXVL_AK00476SB1186 [1,1,0,0,0,0|1,0,1]=4 390 B14R1.598 C=CCC(=O)NCc1ccccc1Br WXVL_AK1632SB2732 [1,1,0,0,0,0|1,0,1]=4 391 B14R1.598 C=CCC(=O)NCc1ccccc1Br WXVL_AK1632SB2732 [1,1,0,0,0,0|1,0,1]=4 392 B14R1.598 C=CCC(=O)NCc1ccccc1C WXVL_AK0040SB2732 [1,1,0,0,0,0|1,0,1]=4 393 B14R1.598 C=CCC(=O)NCc1ccccc1C WXVL_AK0040SB2732 [1,1,0,0,0,0|1,0,1]=4 394 B14R1.598 C=CCC(=O)NCc1ccccc1Cl WXVL_AK0038SB2732 [1,1,0,0,0,0|1,0,1]=4 395 B14R1.598 C=CCC(=O)NCc1ccccc1Cl WXVL_AK0038SB2732 [1,1,0,0,0,0|1,0,1]=4 396 B14R1.598 C=CCC(=O)NCc1ccccc1F WXVL_AK0037SB2732 [1,1,0,0,0,0|1,0,1]=4 397 B14R1.598 C=CCC(=O)NCc1ccccc1F WXVL_AK0037SB2732 [1,1,0,0,0,0|1,0,1]=4 398 B14R1.598 C=CCC(=O)NCc1ccccc1I WXVL_AK3923SB2732 [1,1,0,0,0,0|1,0,1]=4 399 B14R1.598 C=CCC(=O)NCc1ccccc1I WXVL_AK3923SB2732 [1,1,0,0,0,0|1,0,1]=4 400 B14R1.598 C=CCC(=O)NCc1ccccc1O WXVL_AK0963SB2732 [1,1,0,0,0,0|1,0,1]=4 401 B14R1.598 C=CCC(=O)NCc1ccccc1O WXVL_AK0963SB2732 [1,1,0,0,0,0|1,0,1]=4 402 B14R1.598 CCNC(=O)C=Cc1ccccc1Br WXVL_AK00476SB3065 [1,1,0,0,0,0|1,0,1]=4 403 B14R1.598 CCNC(=O)C=Cc1ccccc1Br WXVL_AK00476SB3065 [1,1,0,0,0,0|1,0,1]=4 404 B14R1.818 CC(C)NC(=O)/C=C/c1ccccc1 WXVL_AK0030SB0115 [1,1,0,0,0,0|1,0,1]=4 405 B14R1.818 CC(C)NC(=O)/C=C/c1ccccc1 WXVL_AK0030SB0115 [1,1,0,0,0,0|1,0,1]=4 406 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB1035 [0,1,0,0,1,0|2,0,0]=4 407 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB1035 [0,1,0,0,1,0|2,0,0]=4 408 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)I WXVL_AG1742SB1035 [0,1,0,0,1,0|2,0,0]=4 409 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)I WXVL_AG1742SB1035 [0,1,0,0,1,0|2,0,0]=4 410 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)Br WXVL_AK00561SB0926 [0,1,0,0,1,0|1,0,1]=4 411 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)Br WXVL_AK00561SB0926 [0,1,0,0,1,0|1,0,1]=4 412 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)C WXVL_AK00561SB0112 [0,1,0,0,1,0|1,0,1]=4 413 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)C WXVL_AK00561SB0112 [0,1,0,0,1,0|1,0,1]=4 414 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)Cl WXVL_AK00561SB0107 [0,1,0,0,1,0|1,0,1]=4 415 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)Cl WXVL_AK00561SB0107 [0,1,0,0,1,0|1,0,1]=4 416 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)F WXVL_AK00561SB0106 [0,1,0,0,1,0|1,0,1]=4 417 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)F WXVL_AK00561SB0106 [0,1,0,0,1,0|1,0,1]=4 418 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)O WXVL_AK00561SB0110 [0,1,0,0,1,0|1,0,1]=4 419 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)O WXVL_AK00561SB0110 [0,1,0,0,1,0|1,0,1]=4 420 B14R1.33 C=CCNC(=O)Nc1ccc(cc1)C WXVL_AK00561YV0026 [0,1,0,0,1,0|2,0,0]=4 421 B14R1.33 C=CCNC(=O)Nc1ccc(cc1)C WXVL_AK00561YV0026 [0,1,0,0,1,0|2,0,0]=4 422 B14R1.33 C=CCNC(=O)Nc1ccc(cc1)Cl WXVL_AK00561YV0023 [0,1,0,0,1,0|2,0,0]=4 423 B14R1.33 C=CCNC(=O)Nc1ccc(cc1)Cl WXVL_AK00561YV0023 [0,1,0,0,1,0|2,0,0]=4 424 B14R1.34 C=CCCC(=O)Nc1cccc(c1)C WXVL_AG0052SB1035 [0,1,0,0,1,0|2,0,0]=4 425 B14R1.34 C=CCCC(=O)Nc1cccc(c1)C WXVL_AG0052SB1035 [0,1,0,0,1,0|2,0,0]=4 426 B14R1.34 C=CCCC(=O)Nc1cccc(c1)I WXVL_AG0649SB1035 [0,1,0,0,1,0|2,0,0]=4 427 B14R1.34 C=CCCC(=O)Nc1cccc(c1)I WXVL_AG0649SB1035 [0,1,0,0,1,0|2,0,0]=4 428 B14R1.34 C=CCCC(=O)Nc1cccc(c1)O WXVL_AG00200SB1035 [0,1,0,0,1,0|2,0,0]=4 429 B14R1.34 C=CCCC(=O)Nc1cccc(c1)O WXVL_AG00200SB1035 [0,1,0,0,1,0|2,0,0]=4 430 B14R1.34 C=CCNC(=O)Cc1cccc(c1)Br WXVL_AK00561SB0099 [0,1,0,0,1,0|1,0,1]=4 431 B14R1.34 C=CCNC(=O)Cc1cccc(c1)Br WXVL_AK00561SB0099 [0,1,0,0,1,0|1,0,1]=4 432 B14R1.34 C=CCNC(=O)Cc1cccc(c1)C WXVL_AK00561SB0105 [0,1,0,0,1,0|1,0,1]=4 433 B14R1.34 C=CCNC(=O)Cc1cccc(c1)C WXVL_AK00561SB0105 [0,1,0,0,1,0|1,0,1]=4 434 B14R1.34 C=CCNC(=O)Cc1cccc(c1)Cl WXVL_AK00561SB0101 [0,1,0,0,1,0|1,0,1]=4 435 B14R1.34 C=CCNC(=O)Cc1cccc(c1)Cl WXVL_AK00561SB0101 [0,1,0,0,1,0|1,0,1]=4 436 B14R1.34 C=CCNC(=O)Cc1cccc(c1)F WXVL_AK00561SB0100 [0,1,0,0,1,0|1,0,1]=4 437 B14R1.34 C=CCNC(=O)Cc1cccc(c1)F WXVL_AK00561SB0100 [0,1,0,0,1,0|1,0,1]=4 438 B14R1.34 C=CCNC(=O)Cc1cccc(c1)O WXVL_AK00561SB0104 [0,1,0,0,1,0|1,0,1]=4 439 B14R1.34 C=CCNC(=O)Cc1cccc(c1)O WXVL_AK00561SB0104 [0,1,0,0,1,0|1,0,1]=4 440 B14R1.34 C=CCNC(=O)Nc1cccc(c1)Br WXVL_AK00561YV0098 [0,1,0,0,1,0|2,0,0]=4 441 B14R1.34 C=CCNC(=O)Nc1cccc(c1)Br WXVL_AK00561YV0098 [0,1,0,0,1,0|2,0,0]=4 442 B14R1.34 C=CCNC(=O)Nc1cccc(c1)C WXVL_AK00561YV0020 [0,1,0,0,1,0|2,0,0]=4 443 B14R1.34 C=CCNC(=O)Nc1cccc(c1)C WXVL_AK00561YV0020 [0,1,0,0,1,0|2,0,0]=4 444 B14R1.34 C=CCNC(=O)Nc1cccc(c1)Cl WXVL_AK00561YV0016 [0,1,0,0,1,0|2,0,0]=4 445 B14R1.34 C=CCNC(=O)Nc1cccc(c1)Cl WXVL_AK00561YV0016 [0,1,0,0,1,0|2,0,0]=4 446 B14R1.166 C=CCNC(=O)C(=O)c1ccccc1 WXVL_AK00561SB0050 [0,1,0,0,1,0|1,0,0]=3 447 B14R1.166 C=CCNC(=O)C(=O)c1ccccc1 WXVL_AK00561SB0050 [0,1,0,0,1,0|1,0,0]=3 448 B14R1.166 C=CCNC(=O)C(C)c1ccccc1 WXVL_AK00561SB2326 [0,1,0,0,1,0|1,0,1]=4 449 B14R1.166 C=CCNC(=O)C(C)c1ccccc1 WXVL_AK00561SB2326 [0,1,0,0,1,0|1,0,1]=4 450 B14R1.166 C=CCNC(=O)C(O)c1ccccc1 WXVL_AK00561SB0168 [0,1,0,0,1,0|1,0,1]=4 451 B14R1.166 C=CCNC(=O)C(O)c1ccccc1 WXVL_AK00561SB0168 [0,1,0,0,1,0|1,0,1]=4 452 B14R1.423 C=C(C)CNC(=O)Cc1ccccc1 WXVL_AK0761SB0092 [0,1,0,0,1,0|1,0,1]=4 453 B14R1.423 C=C(C)CNC(=O)Cc1ccccc1 WXVL_AK0761SB0092 [0,1,0,0,1,0|1,0,1]=4 454 B14R1.743 C=CC(C)NC(=O)Cc1ccccc1 WXVL_AK00769SB0092 [0,1,0,0,1,0|1,0,1]=4 455 B14R1.743 C=CC(C)NC(=O)Cc1ccccc1 WXVL_AK00769SB0092 [0,1,0,0,1,0|1,0,1]=4 456 B14R1.946 C=CCCC(=O)Nc1ccccc1Br WXVL_AG00180SB1035 [0,1,0,0,1,0|2,0,0]=4 457 B14R1.946 C=CCCC(=O)Nc1ccccc1Br WXVL_AG00180SB1035 [0,1,0,0,1,0|2,0,0]=4 458 B14R1.946 C=CCCC(=O)Nc1ccccc1C WXVL_AG0027SB1035 [0,1,0,0,1,0|2,0,0]=4 459 B14R1.946 C=CCCC(=O)Nc1ccccc1C WXVL_AG0027SB1035 [0,1,0,0,1,0|2,0,0]=4 460 B14R1.946 C=CCCC(=O)Nc1ccccc1Cl WXVL_AG00129SB1035 [0,1,0,0,1,0|2,0,0]=4 461 B14R1.946 C=CCCC(=O)Nc1ccccc1Cl WXVL_AG00129SB1035 [0,1,0,0,1,0|2,0,0]=4 462 B14R1.946 C=CCCC(=O)Nc1ccccc1I WXVL_AG0385SB1035 [0,1,0,0,1,0|2,0,0]=4 463 B14R1.946 C=CCCC(=O)Nc1ccccc1I WXVL_AG0385SB1035 [0,1,0,0,1,0|2,0,0]=4 464 B14R1.946 C=CCNC(=O)Cc1ccccc1Br WXVL_AK00561SB0093 [0,1,0,0,1,0|1,0,1]=4 465 B14R1.946 C=CCNC(=O)Cc1ccccc1Br WXVL_AK00561SB0093 [0,1,0,0,1,0|1,0,1]=4 466 B14R1.946 C=CCNC(=O)Cc1ccccc1C WXVL_AK00561SB0098 [0,1,0,0,1,0|1,0,1]=4 467 B14R1.946 C=CCNC(=O)Cc1ccccc1C WXVL_AK00561SB0098 [0,1,0,0,1,0|1,0,1]=4 468 B14R1.946 C=CCNC(=O)Cc1ccccc1Cl WXVL_AK00561SB0095 [0,1,0,0,1,0|1,0,1]=4 469 B14R1.946 C=CCNC(=O)Cc1ccccc1Cl WXVL_AK00561SB0095 [0,1,0,0,1,0|1,0,1]=4 470 B14R1.946 C=CCNC(=O)Cc1ccccc1F WXVL_AK00561SB0094 [0,1,0,0,1,0|1,0,1]=4 471 B14R1.946 C=CCNC(=O)Cc1ccccc1F WXVL_AK00561SB0094 [0,1,0,0,1,0|1,0,1]=4 472 B14R1.946 C=CCNC(=O)Cc1ccccc1I WXVL_AK00561SB1145 [0,1,0,0,1,0|1,0,1]=4 473 B14R1.946 C=CCNC(=O)Cc1ccccc1I WXVL_AK00561SB1145 [0,1,0,0,1,0|1,0,1]=4 474 B14R1.946 C=CCNC(=O)Cc1ccccc1O WXVL_AK00561SB0400 [0,1,0,0,1,0|1,0,1]=4 475 B14R1.946 C=CCNC(=O)Cc1ccccc1O WXVL_AK00561SB0400 [0,1,0,0,1,0|1,0,1]=4 476 B14R1.946 C=CCNC(=O)Nc1ccccc1Br WXVL_AK00561YV0003 [0,1,0,0,1,0|2,0,0]=4 477 B14R1.946 C=CCNC(=O)Nc1ccccc1Br WXVL_AK00561YV0003 [0,1,0,0,1,0|2,0,0]=4 478 B14R1.946 C=CCNC(=O)Nc1ccccc1C WXVL_AK00561YV0013 [0,1,0,0,1,0|2,0,0]=4 479 B14R1.946 C=CCNC(=O)Nc1ccccc1C WXVL_AK00561YV0013 [0,1,0,0,1,0|2,0,0]=4 480 B14R1.946 C=CCNC(=O)Nc1ccccc1Cl WXVL_AK00561YV0007 [0,1,0,0,1,0|2,0,0]=4 481 B14R1.946 C=CCNC(=O)Nc1ccccc1Cl WXVL_AK00561YV0007 [0,1,0,0,1,0|2,0,0]=4 482 B14R1.86 C=CCCNC(=O)/C=C/c1ccco1 WXVL_AK00138SA0180 [0,1,0,0,1,0|2,0,0]=4 483 B14R1.86 C=CCCNC(=O)/C=C/c1ccco1 WXVL_AK00138SA0180 [0,1,0,0,1,0|2,0,0]=4 484 B14R1.86 C=CCCNC(=O)/C=C/c1cccs1 WXVL_AK00138SA0001 [0,1,0,0,1,0|2,0,0]=4 485 B14R1.86 C=CCCNC(=O)/C=C/c1cccs1 WXVL_AK00138SA0001 [0,1,0,0,1,0|2,0,0]=4 486 B14R1.86 C=CCCNC(=O)/C=C/c1ccoc1 WXVL_AK00138SA0047 [0,1,0,0,1,0|2,0,0]=4 487 B14R1.86 C=CCCNC(=O)/C=C/c1ccoc1 WXVL_AK00138SA0047 [0,1,0,0,1,0|2,0,0]=4 488 B14R1.86 C=CCCNC(=O)/C=C/c1ccsc1 WXVL_AK00138SA0251 [0,1,0,0,1,0|2,0,0]=4 489 B14R1.86 C=CCCNC(=O)/C=C/c1ccsc1 WXVL_AK00138SA0251 [0,1,0,0,1,0|2,0,0]=4 490 B14R1.155 C=CCNC(=O)/C=C/c1ccc(s1)C WXVL_AK00561SA1334 [0,1,0,0,1,0|2,0,0]=4 491 B14R1.155 C=CCNC(=O)/C=C/c1ccc(s1)C WXVL_AK00561SA1334 [0,1,0,0,1,0|2,0,0]=4 492 B14R1.588 C=CC(C)NC(=O)/C=C/c1ccco1 WXVL_AK00769SA0180 [0,1,0,0,1,0|2,0,0]=4 493 B14R1.588 C=CC(C)NC(=O)/C=C/c1ccco1 WXVL_AK00769SA0180 [0,1,0,0,1,0|2,0,0]=4 494 B14R1.588 C=CC(C)NC(=O)/C=C/c1cccs1 WXVL_AK00769SA0001 [0,1,0,0,1,0|2,0,0]=4 495 B14R1.588 C=CC(C)NC(=O)/C=C/c1cccs1 WXVL_AK00769SA0001 [0,1,0,0,1,0|2,0,0]=4 496 B14R1.588 C=CC(C)NC(=O)/C=C/c1ccoc1 WXVL_AK00769SA0047 [0,1,0,0,1,0|2,0,0]=4 497 B14R1.588 C=CC(C)NC(=O)/C=C/c1ccoc1 WXVL_AK00769SA0047 [0,1,0,0,1,0|2,0,0]=4 498 B14R1.588 C=CC(C)NC(=O)/C=C/c1ccsc1 WXVL_AK00769SA0251 [0,1,0,0,1,0|2,0,0]=4 499 B14R1.588 C=CC(C)NC(=O)/C=C/c1ccsc1 WXVL_AK00769SA0251 [0,1,0,0,1,0|2,0,0]=4 500 B14R1.4526 C=C(C)CNC(=O)/C=C/c1ccco1 WXVL_AK0761SA0180 [0,1,0,0,1,0|2,0,0]=4 501 B14R1.4526 C=C(C)CNC(=O)/C=C/c1ccco1 WXVL_AK0761SA0180 [0,1,0,0,1,0|2,0,0]=4 502 B14R1.4526 C=C(C)CNC(=O)/C=C/c1cccs1 WXVL_AK0761SA0001 [0,1,0,0,1,0|2,0,0]=4 503 B14R1.4526 C=C(C)CNC(=O)/C=C/c1cccs1 WXVL_AK0761SA0001 [0,1,0,0,1,0|2,0,0]=4 504 B14R1.4526 C=C(C)CNC(=O)/C=C/c1ccoc1 WXVL_AK0761SA0047 [0,1,0,0,1,0|2,0,0]=4 505 B14R1.4526 C=C(C)CNC(=O)/C=C/c1ccoc1 WXVL_AK0761SA0047 [0,1,0,0,1,0|2,0,0]=4 506 B14R1.4526 C=C(C)CNC(=O)/C=C/c1ccsc1 WXVL_AK0761SA0251 [0,1,0,0,1,0|2,0,0]=4 507 B14R1.4526 C=C(C)CNC(=O)/C=C/c1ccsc1 WXVL_AK0761SA0251 [0,1,0,0,1,0|2,0,0]=4 508 B16R1.700 C=CCNC(=O)CNC(=O)c1ccccc1 WXVL_AK00561SB0466 [0,1,0,0,0,1|1,0,1]=4 509 B16R1.700 C=CCNC(=O)CNC(=O)c1ccccc1 WXVL_AK00561SB0466 [0,1,0,0,0,1|1,0,1]=4 510 B16R1.35 C=CCCNC(=O)NC(=O)c1ccccc1 WXVL_AK00138YV0027 [0,2,0,0,0,0|2,0,0]=4 511 B16R1.35 C=CCCNC(=O)NC(=O)c1ccccc1 WXVL_AK00138YV0027 [0,2,0,0,0,0|2,0,0]=4 512 B16R1.51 C=CCCNC(=O)/C=C/c1ccc(cc1)O WXVL_AK00138SB0418 [0,2,0,0,0,0|1,0,0]=3 513 B16R1.51 C=CCCNC(=O)/C=C/c1ccc(cc1)O WXVL_AK00138SB0418 [0,2,0,0,0,0|1,0,0]=3 514 B16R1.51 C=CCCNC(=O)C=Cc1ccc(cc1)Br WXVL_AK00138SB1122 [0,2,0,0,0,0|1,0,0]=3 515 B16R1.51 C=CCCNC(=O)C=Cc1ccc(cc1)Br WXVL_AK00138SB1122 [0,2,0,0,0,0|1,0,0]=3 516 B16R1.51 C=CCCNC(=O)C=Cc1ccc(cc1)C WXVL_AK00138SB0060 [0,2,0,0,0,0|1,0,0]=3 517 B16R1.51 C=CCCNC(=O)C=Cc1ccc(cc1)C WXVL_AK00138SB0060 [0,2,0,0,0,0|1,0,0]=3 518 B16R1.51 C=CCCNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00138SB0119 [0,2,0,0,0,0|1,0,0]=3 519 B16R1.51 C=CCCNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00138SB0119 [0,2,0,0,0,0|1,0,0]=3 520 B16R1.51 C=CCCNC(=O)C=Cc1ccc(cc1)F WXVL_AK00138SB1186 [0,2,0,0,0,0|1,0,0]=3 521 B16R1.51 C=CCCNC(=O)C=Cc1ccc(cc1)F WXVL_AK00138SB1186 [0,2,0,0,0,0|1,0,0]=3 522 B16R1.52 C=CCCNC(=O)C=Cc1cccc(c1)Cl WXVL_AK00138SB1601 [0,2,0,0,0,0|1,0,0]=3 523 B16R1.52 C=CCCNC(=O)C=Cc1cccc(c1)Cl WXVL_AK00138SB1601 [0,2,0,0,0,0|1,0,0]=3 524 B16R1.52 C=CCCNC(=O)C=Cc1cccc(c1)O WXVL_AK00138SB0417 [0,2,0,0,0,0|1,0,0]=3 525 B16R1.52 C=CCCNC(=O)C=Cc1cccc(c1)O WXVL_AK00138SB0417 [0,2,0,0,0,0|1,0,0]=3 526 B16R1.608 NC(=O)CCNC(=O)/C=C/c1ccccc1 WXVL_AK00443SB0115 [0,2,0,0,0,0|1,0,1]=4 527 B16R1.608 NC(=O)CCNC(=O)/C=C/c1ccccc1 WXVL_AK00443SB0115 [0,2,0,0,0,0|1,0,1]=4 528 B16R1.1216 C=CCCNC(=O)/C(=C/c1cccnc1)/C WXVL_AK00138SA1933 [0,2,0,0,0,0|2,0,0]=4 529 B16R1.1216 C=CCCNC(=O)/C(=C/c1cccnc1)/C WXVL_AK00138SA1933 [0,2,0,0,0,0|2,0,0]=4 530 B16R1.1216 C=CCCNC(=O)C(=C)Cc1ccccc1 WXVL_AK00138SB0413 [0,2,0,0,0,0|1,0,1]=4 531 B16R1.1216 C=CCCNC(=O)C(=C)Cc1ccccc1 WXVL_AK00138SB0413 [0,2,0,0,0,0|1,0,1]=4 532 B16R1.1343 CNC(=O)CNC(=O)/C=C/c1ccccc1 WXVL_AK1222SB0115 [0,2,0,0,0,0|1,0,1]=4 533 B16R1.1343 CNC(=O)CNC(=O)/C=C/c1ccccc1 WXVL_AK1222SB0115 [0,2,0,0,0,0|1,0,1]=4 534 B16R1.1696 C=CCCNC(=O)C=Cc1ccccc1Br WXVL_AK00138SB3065 [0,2,0,0,0,0|1,0,0]=3 535 B16R1.1696 C=CCCNC(=O)C=Cc1ccccc1Br WXVL_AK00138SB3065 [0,2,0,0,0,0|1,0,0]=3 536 B16R1.20527 C=CCCNS(=O)(=O)/C=C/c1ccccc1 WXVL_AK00138HU0026 [0,2,0,0,0,0|2,0,0]=4 537 B16R1.20527 C=CCCNS(=O)(=O)/C=C/c1ccccc1 WXVL_AK00138HU0026 [0,2,0,0,0,0|2,0,0]=4 538 B16R1.847 C=CC(C)NC(=O)NC(=O)c1ccccc1 WXVL_AK00769YV0027 [0,2,0,0,0,0|2,0,0]=4 539 B16R1.847 C=CC(C)NC(=O)NC(=O)c1ccccc1 WXVL_AK00769YV0027 [0,2,0,0,0,0|2,0,0]=4 540 B16R1.7611 C=C(C)CNC(=O)NC(=O)c1ccccc1 WXVL_AK0761YV0027 [0,2,0,0,0,0|2,0,0]=4 541 B16R1.7611 C=C(C)CNC(=O)NC(=O)c1ccccc1 WXVL_AK0761YV0027 [0,2,0,0,0,0|2,0,0]=4 542 B16R1.851 C=CC(C)NC(=O)C=Cc1cccc(c1)Cl WXVL_AK00769SB1601 [0,2,0,0,0,0|1,0,0]=3 543 B16R1.851 C=CC(C)NC(=O)C=Cc1cccc(c1)Cl WXVL_AK00769SB1601 [0,2,0,0,0,0|1,0,0]=3 544 B16R1.851 C=CC(C)NC(=O)C=Cc1cccc(c1)O WXVL_AK00769SB0417 [0,2,0,0,0,0|1,0,0]=3 545 B16R1.851 C=CC(C)NC(=O)C=Cc1cccc(c1)O WXVL_AK00769SB0417 [0,2,0,0,0,0|1,0,0]=3 546 B16R1.7629 C=CCNC(=O)C=Cc1cc(cc(c1)F)F WXVL_AK00561SB1124 [0,2,0,0,0,0|1,0,0]=3 547 B16R1.7629 C=CCNC(=O)C=Cc1cc(cc(c1)F)F WXVL_AK00561SB1124 [0,2,0,0,0,0|1,0,0]=3 548 B16R1.11227 C=C(C)CNC(=O)C=Cc1cccc(c1)Cl WXVL_AK0761SB1601 [0,2,0,0,0,0|1,0,0]=3 549 B16R1.11227 C=C(C)CNC(=O)C=Cc1cccc(c1)Cl WXVL_AK0761SB1601 [0,2,0,0,0,0|1,0,0]=3 550 B16R1.11227 C=C(C)CNC(=O)C=Cc1cccc(c1)O WXVL_AK0761SB0417 [0,2,0,0,0,0|1,0,0]=3 551 B16R1.11227 C=C(C)CNC(=O)C=Cc1cccc(c1)O WXVL_AK0761SB0417 [0,2,0,0,0,0|1,0,0]=3 552 B16R1.11227 NC(=O)CNC(=O)C=Cc1cccc(c1)Cl WXVL_AK0147SB1601 [0,2,0,0,0,0|2,0,0]=4 553 B16R1.11227 NC(=O)CNC(=O)C=Cc1cccc(c1)Cl WXVL_AK0147SB1601 [0,2,0,0,0,0|2,0,0]=4 554 B16R1.11227 NC(=O)CNC(=O)C=Cc1cccc(c1)O WXVL_AK0147SB0417 [0,2,0,0,0,0|2,0,0]=4 555 B16R1.11227 NC(=O)CNC(=O)C=Cc1cccc(c1)O WXVL_AK0147SB0417 [0,2,0,0,0,0|2,0,0]=4 556 B16R1.20755 C=CCNC(=O)/C=C/c1cccc(c1)C#N WXVL_AK00561SB2454 [0,2,0,0,0,0|1,0,0]=3 557 B16R1.20755 C=CCNC(=O)/C=C/c1cccc(c1)C#N WXVL_AK00561SB2454 [0,2,0,0,0,0|1,0,0]=3 558 B16R1.20755 C=CCNC(=O)C=Cc1cccc(c1)OC WXVL_AK00561SB0458 [0,2,0,0,0,0|1,0,0]=3 559 B16R1.20755 C=CCNC(=O)C=Cc1cccc(c1)OC WXVL_AK00561SB0458 [0,2,0,0,0,0|1,0,0]=3 560 B16R1.20760 C=CCNC(=O)C=Cc1ccc(c(c1)Cl)Cl WXVL_AK00561SB0118 [0,2,0,0,0,0|1,0,0]=3 561 B16R1.20760 C=CCNC(=O)C=Cc1ccc(c(c1)Cl)Cl WXVL_AK00561SB0118 [0,2,0,0,0,0|1,0,0]=3 562 B16R1.658 C=CCNC(=O)C(=O)Cc1ccc(cc1)O WXVL_AK00561SB2710 [0,2,0,0,0,0|1,0,1]=4 563 B16R1.658 C=CCNC(=O)C(=O)Cc1ccc(cc1)O WXVL_AK00561SB2710 [0,2,0,0,0,0|1,0,1]=4 564 B16R1.850 C=CC(C)NC(=O)/C=C/c1ccc(cc1)O WXVL_AK00769SB0418 [0,2,0,0,0,0|1,0,0]=3 565 B16R1.850 C=CC(C)NC(=O)/C=C/c1ccc(cc1)O WXVL_AK00769SB0418 [0,2,0,0,0,0|1,0,0]=3 566 B16R1.850 C=CC(C)NC(=O)C=Cc1ccc(cc1)Br WXVL_AK00769SB1122 [0,2,0,0,0,0|1,0,0]=3 567 B16R1.850 C=CC(C)NC(=O)C=Cc1ccc(cc1)Br WXVL_AK00769SB1122 [0,2,0,0,0,0|1,0,0]=3 568 B16R1.850 C=CC(C)NC(=O)C=Cc1ccc(cc1)C WXVL_AK00769SB0060 [0,2,0,0,0,0|1,0,0]=3 569 B16R1.850 C=CC(C)NC(=O)C=Cc1ccc(cc1)C WXVL_AK00769SB0060 [0,2,0,0,0,0|1,0,0]=3 570 B16R1.850 C=CC(C)NC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00769SB0119 [0,2,0,0,0,0|1,0,0]=3 571 B16R1.850 C=CC(C)NC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00769SB0119 [0,2,0,0,0,0|1,0,0]=3 572 B16R1.850 C=CC(C)NC(=O)C=Cc1ccc(cc1)F WXVL_AK00769SB1186 [0,2,0,0,0,0|1,0,0]=3 573 B16R1.850 C=CC(C)NC(=O)C=Cc1ccc(cc1)F WXVL_AK00769SB1186 [0,2,0,0,0,0|1,0,0]=3 574 B16R1.1061 C=C(C)CNC(=O)/C=C/c1ccc(cc1)O WXVL_AK0761SB0418 [0,2,0,0,0,0|1,0,0]=3 575 B16R1.1061 C=C(C)CNC(=O)/C=C/c1ccc(cc1)O WXVL_AK0761SB0418 [0,2,0,0,0,0|1,0,0]=3 576 B16R1.1061 C=C(C)CNC(=O)C=Cc1ccc(cc1)Br WXVL_AK0761SB1122 [0,2,0,0,0,0|1,0,0]=3 577 B16R1.1061 C=C(C)CNC(=O)C=Cc1ccc(cc1)Br WXVL_AK0761SB1122 [0,2,0,0,0,0|1,0,0]=3 578 B16R1.1061 C=C(C)CNC(=O)C=Cc1ccc(cc1)C WXVL_AK0761SB0060 [0,2,0,0,0,0|1,0,0]=3 579 B16R1.1061 C=C(C)CNC(=O)C=Cc1ccc(cc1)C WXVL_AK0761SB0060 [0,2,0,0,0,0|1,0,0]=3 580 B16R1.1061 C=C(C)CNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK0761SB0119 [0,2,0,0,0,0|1,0,0]=3 581 B16R1.1061 C=C(C)CNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK0761SB0119 [0,2,0,0,0,0|1,0,0]=3 582 B16R1.1061 C=C(C)CNC(=O)C=Cc1ccc(cc1)F WXVL_AK0761SB1186 [0,2,0,0,0,0|1,0,0]=3 583 B16R1.1061 C=C(C)CNC(=O)C=Cc1ccc(cc1)F WXVL_AK0761SB1186 [0,2,0,0,0,0|1,0,0]=3 584 B16R1.1061 Cc1ccc(cc1)C=CC(=O)NCC(=O)N WXVL_AK0147SB0060 [0,2,0,0,0,0|2,0,0]=4 585 B16R1.1061 Cc1ccc(cc1)C=CC(=O)NCC(=O)N WXVL_AK0147SB0060 [0,2,0,0,0,0|2,0,0]=4 586 B16R1.1061 NC(=O)CNC(=O)/C=C/c1ccc(cc1)O WXVL_AK0147SB0418 [0,2,0,0,0,0|2,0,0]=4 587 B16R1.1061 NC(=O)CNC(=O)/C=C/c1ccc(cc1)O WXVL_AK0147SB0418 [0,2,0,0,0,0|2,0,0]=4 588 B16R1.1061 NC(=O)CNC(=O)C=Cc1ccc(cc1)Br WXVL_AK0147SB1122 [0,2,0,0,0,0|2,0,0]=4 589 B16R1.1061 NC(=O)CNC(=O)C=Cc1ccc(cc1)Br WXVL_AK0147SB1122 [0,2,0,0,0,0|2,0,0]=4 590 B16R1.1061 NC(=O)CNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK0147SB0119 [0,2,0,0,0,0|2,0,0]=4 591 B16R1.1061 NC(=O)CNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK0147SB0119 [0,2,0,0,0,0|2,0,0]=4 592 B16R1.1061 NC(=O)CNC(=O)C=Cc1ccc(cc1)F WXVL_AK0147SB1186 [0,2,0,0,0,0|2,0,0]=4 593 B16R1.1061 NC(=O)CNC(=O)C=Cc1ccc(cc1)F WXVL_AK0147SB1186 [0,2,0,0,0,0|2,0,0]=4 594 B16R1.1478 C=CCNC(=O)/C=C/c1ccc(cc1Cl)Br WXVL_AK00561SB5557 [0,2,0,0,0,0|1,0,0]=3 595 B16R1.1478 C=CCNC(=O)/C=C/c1ccc(cc1Cl)Br WXVL_AK00561SB5557 [0,2,0,0,0,0|1,0,0]=3 596 B16R1.1478 C=CCNC(=O)/C=C/c1ccc(cc1Cl)O WXVL_AK00561SB8094 [0,2,0,0,0,0|1,0,0]=3 597 B16R1.1478 C=CCNC(=O)/C=C/c1ccc(cc1Cl)O WXVL_AK00561SB8094 [0,2,0,0,0,0|1,0,0]=3 598 B16R1.1478 C=CCNC(=O)/C=C/c1ccc(cc1F)Br WXVL_AK00561SB1318 [0,2,0,0,0,0|1,0,0]=3 599 B16R1.1478 C=CCNC(=O)/C=C/c1ccc(cc1F)Br WXVL_AK00561SB1318 [0,2,0,0,0,0|1,0,0]=3 600 B16R1.1478 C=CCNC(=O)/C=C/c1ccc(cc1F)F WXVL_AK00561SB1257 [0,2,0,0,0,0|1,0,0]=3 601 B16R1.1478 C=CCNC(=O)/C=C/c1ccc(cc1F)F WXVL_AK00561SB1257 [0,2,0,0,0,0|1,0,0]=3 602 B16R1.1478 C=CCNC(=O)C=Cc1ccc(cc1Cl)Cl WXVL_AK00561SB0256 [0,2,0,0,0,0|1,0,0]=3 603 B16R1.1478 C=CCNC(=O)C=Cc1ccc(cc1Cl)Cl WXVL_AK00561SB0256 [0,2,0,0,0,0|1,0,0]=3 604 B16R1.1478 C=CCNC(=O)C=Cc1ccc(cc1Cl)F WXVL_AK00561SB3115 [0,2,0,0,0,0|1,0,0]=3 605 B16R1.1478 C=CCNC(=O)C=Cc1ccc(cc1Cl)F WXVL_AK00561SB3115 [0,2,0,0,0,0|1,0,0]=3 606 B16R1.1478 C=CCNC(=O)C=Cc1ccc(cc1F)Cl WXVL_AK00561SB0235 [0,2,0,0,0,0|1,0,0]=3 607 B16R1.1478 C=CCNC(=O)C=Cc1ccc(cc1F)Cl WXVL_AK00561SB0235 [0,2,0,0,0,0|1,0,0]=3 608 B16R1.1480 C=CCNC(=O)/C=C/c1ccc(cc1)OC WXVL_AK00561SB0120 [0,2,0,0,0,0|1,0,0]=3 609 B16R1.1480 C=CCNC(=O)/C=C/c1ccc(cc1)OC WXVL_AK00561SB0120 [0,2,0,0,0,0|1,0,0]=3 610 B16R1.1127 C=CC(C)NC(=O)/C(=C/c1cccnc1)/C WXVL_AK00769SA1933 [0,2,0,0,0,0|2,0,0]=4 611 B16R1.1127 C=CC(C)NC(=O)/C(=C/c1cccnc1)/C WXVL_AK00769SA1933 [0,2,0,0,0,0|2,0,0]=4 612 B16R1.1127 C=CC(C)NC(=O)C(=C)Cc1ccccc1 WXVL_AK00769SB0413 [0,2,0,0,0,0|1,0,1]=4 613 B16R1.1127 C=CC(C)NC(=O)C(=C)Cc1ccccc1 WXVL_AK00769SB0413 [0,2,0,0,0,0|1,0,1]=4 614 B16R1.1284 C=C(C)CNC(=O)/C(=C/c1cccnc1)/C WXVL_AK0761SA1933 [0,2,0,0,0,0|2,0,0]=4 615 B16R1.1284 C=C(C)CNC(=O)/C(=C/c1cccnc1)/C WXVL_AK0761SA1933 [0,2,0,0,0,0|2,0,0]=4 616 B16R1.1284 C=C(C)CNC(=O)C(=C)Cc1ccccc1 WXVL_AK0761SB0413 [0,2,0,0,0,0|1,0,1]=4 617 B16R1.1284 C=C(C)CNC(=O)C(=C)Cc1ccccc1 WXVL_AK0761SB0413 [0,2,0,0,0,0|1,0,1]=4 618 B16R1.853 C=CC(C)NC(=O)C=Cc1ccccc1Br WXVL_AK00769SB3065 [0,2,0,0,0,0|1,0,0]=3 619 B16R1.853 C=CC(C)NC(=O)C=Cc1ccccc1Br WXVL_AK00769SB3065 [0,2,0,0,0,0|1,0,0]=3 620 B16R1.4122 C[C@@H](NC(=O)/C=C/c1ccccc1)C(=O)N WXVL_AK6986SB0115 [0,2,0,0,0,0|2,0,0]=4 621 B16R1.4122 C[C@@H](NC(=O)/C=C/c1ccccc1)C(=O)N WXVL_AK6986SB0115 [0,2,0,0,0,0|2,0,0]=4 622 B16R1.7289 C=C[C@@H](CO)NC(=O)/C=C/c1ccccc1 WXVL_AK00581SB0115 [0,2,0,0,0,0|1,0,0]=3 623 B16R1.7289 C=C[C@@H](CO)NC(=O)/C=C/c1ccccc1 WXVL_AK00581SB0115 [0,2,0,0,0,0|1,0,0]=3 624 B16R1.7289 C=C[C@@H](CO)NC(=O)/C=C/c1cccnc1 WXVL_AK00581SA0193 [0,2,0,0,0,0|2,0,0]=4 625 B16R1.7289 C=C[C@@H](CO)NC(=O)/C=C/c1cccnc1 WXVL_AK00581SA0193 [0,2,0,0,0,0|2,0,0]=4 626 B16R1.17161 C=CC(C)NS(=O)(=O)/C=C/c1ccccc1 WXVL_AK00769HU0026 [0,2,0,0,0,0|2,0,0]=4 627 B16R1.17161 C=CC(C)NS(=O)(=O)/C=C/c1ccccc1 WXVL_AK00769HU0026 [0,2,0,0,0,0|2,0,0]=4 628 B16R1.400 C=C(C)CNC(=O)C=Cc1ccccc1Br WXVL_AK0761SB3065 [0,2,0,0,0,0|1,0,0]=3 629 B16R1.400 C=C(C)CNC(=O)C=Cc1ccccc1Br WXVL_AK0761SB3065 [0,2,0,0,0,0|1,0,0]=3 630 B16R1.400 NC(=O)CNC(=O)C=Cc1ccccc1Br WXVL_AK0147SB3065 [0,2,0,0,0,0|2,0,0]=4 631 B16R1.400 NC(=O)CNC(=O)C=Cc1ccccc1Br WXVL_AK0147SB3065 [0,2,0,0,0,0|2,0,0]=4 632 B16R1.1771 C=C(C)CNS(=O)(=O)/C=C/c1ccccc1 WXVL_AK0761HU0026 [0,2,0,0,0,0|2,0,0]=4 633 B16R1.1771 C=C(C)CNS(=O)(=O)/C=C/c1ccccc1 WXVL_AK0761HU0026 [0,2,0,0,0,0|2,0,0]=4 634 B14R2.14 O=Cc1occc1c2ccccc2 WXVL_QS1403BT0919 [1,0,0,1,0,0|1,0,1]=4 635 B14R2.14 O=Cc1occc1c2ccccc2 WXVL_QS1403BT1115 [1,0,0,1,0,0|1,0,1]=4 636 B14R2.14 O=Cc1occc1c2ccccc2 WXVL_QS1403BT2957 [1,0,0,1,0,0|1,0,1]=4 637 B16R2.37 C=CCNC(=O)c1c[nH]c2c1cccn2 WXVL_AK00561SE0048 [0,0,0,1,0,1|2,0,0]=4 638 B16R2.37 C=CCNC(=O)c1c[nH]c2c1cccn2 WXVL_AK00561SE0048 [0,0,0,1,0,1|2,0,0]=4 639 B16R2.37 C=CCNC(=O)c1c[nH]c2c1ccnc2 WXVL_AK00561SE0638 [0,0,0,1,0,1|2,0,0]=4 640 B16R2.37 C=CCNC(=O)c1c[nH]c2c1ccnc2 WXVL_AK00561SE0638 [0,0,0,1,0,1|2,0,0]=4 641 B16R2.37 C=CCNC(=O)c1cnc2n1cccc2 WXVL_AK00561SE0102 [0,0,0,1,0,1|2,0,0]=4 642 B16R2.37 C=CCNC(=O)c1cnc2n1cccc2 WXVL_AK00561SE0102 [0,0,0,1,0,1|2,0,0]=4 643 B16R2.37 C=CCNC(=O)c1cnn2c1cccc2 WXVL_AK00561SE0033 [0,0,0,1,0,1|2,0,0]=4 644 B16R2.37 C=CCNC(=O)c1cnn2c1cccc2 WXVL_AK00561SE0033 [0,0,0,1,0,1|2,0,0]=4 645 B16R2.37 C=CCNC(=O)c1coc2c1cccc2 WXVL_AK00561SE0302 [0,0,0,1,0,1|1,0,0]=3 646 B16R2.37 C=CCNC(=O)c1coc2c1cccc2 WXVL_AK00561SE0302 [0,0,0,1,0,1|1,0,0]=3 647 B16R2.37 C=CCNC(=O)c1csc2c1cccc2 WXVL_AK00561SE0108 [0,0,0,1,0,1|1,0,0]=3 648 B16R2.37 C=CCNC(=O)c1csc2c1cccc2 WXVL_AK00561SE0108 [0,0,0,1,0,1|1,0,0]=3 649 B16R2.37 C=CCNC(=O)c1n[nH]c2c1cccc2 WXVL_AK00561SE0379 [0,0,0,1,0,1|2,0,0]=4 650 B16R2.37 C=CCNC(=O)c1n[nH]c2c1cccc2 WXVL_AK00561SE0379 [0,0,0,1,0,1|2,0,0]=4 651 B16R2.37 C=CCNC(=O)c1onc2c1cccc2 WXVL_AK00561SE0896 [0,0,0,1,0,1|2,0,0]=4 652 B16R2.37 C=CCNC(=O)c1onc2c1cccc2 WXVL_AK00561SE0896 [0,0,0,1,0,1|2,0,0]=4 653 B16R2.2128 C=CCNC(=O)c1cc2ccccc2[nH]1 WXVL_AK00561SE0001 [0,1,0,1,0,0|1,0,0]=3 654 B16R2.2128 C=CCNC(=O)c1cc2ccccc2[nH]1 WXVL_AK00561SE0001 [0,1,0,1,0,0|1,0,0]=3 655 B16R2.2128 C=CCNC(=O)c1cc2ccccc2o1 WXVL_AK00561SE0105 [0,1,0,1,0,0|1,0,0]=3 656 B16R2.2128 C=CCNC(=O)c1cc2ccccc2o1 WXVL_AK00561SE0105 [0,1,0,1,0,0|1,0,0]=3 657 B16R2.2128 C=CCNC(=O)c1cc2ccccc2s1 WXVL_AK00561SE0107 [0,1,0,1,0,0|1,0,0]=3 658 B16R2.2128 C=CCNC(=O)c1cc2ccccc2s1 WXVL_AK00561SE0107 [0,1,0,1,0,0|1,0,0]=3 659 B16R2.2128 C=CCNC(=O)c1cc2ccccn2n1 WXVL_AK00561SE0030 [0,1,0,1,0,0|2,0,0]=4 660 B16R2.2128 C=CCNC(=O)c1cc2ccccn2n1 WXVL_AK00561SE0030 [0,1,0,1,0,0|2,0,0]=4 661 B16R2.2128 C=CCNC(=O)c1cc2cccnc2[nH]1 WXVL_AK00561SE0450 [0,1,0,1,0,0|2,0,0]=4 662 B16R2.2128 C=CCNC(=O)c1cc2cccnc2[nH]1 WXVL_AK00561SE0450 [0,1,0,1,0,0|2,0,0]=4 663 B16R2.2128 C=CCNC(=O)c1cc2cccnc2s1 WXVL_AK00561SE0061 [0,1,0,1,0,0|2,0,0]=4 664 B16R2.2128 C=CCNC(=O)c1cc2cccnc2s1 WXVL_AK00561SE0061 [0,1,0,1,0,0|2,0,0]=4 665 B16R2.2128 C=CCNC(=O)c1cc2cnccc2[nH]1 WXVL_AK00561SE0511 [0,1,0,1,0,0|2,0,0]=4 666 B16R2.2128 C=CCNC(=O)c1cc2cnccc2[nH]1 WXVL_AK00561SE0511 [0,1,0,1,0,0|2,0,0]=4 667 B16R2.2128 C=CCNC(=O)c1cc2ncccc2[nH]1 WXVL_AK00561SE0680 [0,1,0,1,0,0|2,0,0]=4 668 B16R2.2128 C=CCNC(=O)c1cc2ncccc2[nH]1 WXVL_AK00561SE0680 [0,1,0,1,0,0|2,0,0]=4 669 B16R2.2128 C=CCNC(=O)c1nc2ccccc2[nH]1 WXVL_AK00561SE0026 [0,1,0,1,0,0|2,0,0]=4 670 B16R2.2128 C=CCNC(=O)c1nc2ccccc2[nH]1 WXVL_AK00561SE0026 [0,1,0,1,0,0|2,0,0]=4 671 B16R2.2128 C=CCNC(=O)c1nc2ccccc2o1 WXVL_AK00561SE0704 [0,1,0,1,0,0|2,0,0]=4 672 B16R2.2128 C=CCNC(=O)c1nc2ccccc2o1 WXVL_AK00561SE0704 [0,1,0,1,0,0|2,0,0]=4 673 B16R2.477 NC(=O)COc1ccc2ccccc2c1 WXVL_AK0084SB0535 [0,1,0,1,0,0|2,0,0]=4 674 B16R2.477 NC(=O)COc1ccc2ccccc2c1 WXVL_AK0084SB0535 [0,1,0,1,0,0|2,0,0]=4 675 B12R1.32 C=CCC(=O)Nc1ccccc1 WXVL_AG00183SB2732 [1,0,0,0,1,0|1,0,0]=3 676 B12R1.32 C=CCC(=O)Nc1ccccc1 WXVL_AG00183SB2732 [1,0,0,0,1,0|1,0,0]=3 677 B12R1.32 C=CCC(=O)Nc1ccccn1 WXVL_AF00298SB2732 [1,0,0,0,1,0|2,0,0]=4 678 B12R1.32 C=CCC(=O)Nc1ccccn1 WXVL_AF00298SB2732 [1,0,0,0,1,0|2,0,0]=4 679 B12R1.30 C=CCNC(=O)c1ccccc1 WXVL_AK00561SD0001 [0,0,0,0,2,0|1,0,0]=3 680 B12R1.30 C=CCNC(=O)c1ccccc1 WXVL_AK00561SD0001 [0,0,0,0,2,0|1,0,0]=3 681 B12R1.30 C=CCNC(=O)c1ccccn1 WXVL_AK00561SC0058 [0,0,0,0,2,0|2,0,0]=4 682 B12R1.30 C=CCNC(=O)c1ccccn1 WXVL_AK00561SC0058 [0,0,0,0,2,0|2,0,0]=4 683 B12R1.30 C=CCNC(=O)c1cccnc1 WXVL_AK00561SC0061 [0,0,0,0,2,0|2,0,0]=4 684 B12R1.30 C=CCNC(=O)c1cccnc1 WXVL_AK00561SC0061 [0,0,0,0,2,0|2,0,0]=4 685 B12R1.30 C=CCNC(=O)c1ccncc1 WXVL_AK00561SC0062 [0,0,0,0,2,0|2,0,0]=4 686 B12R1.30 C=CCNC(=O)c1ccncc1 WXVL_AK00561SC0062 [0,0,0,0,2,0|2,0,0]=4 687 B16R1.1465 C=CCCC(=O)NC/C=C/c1ccccc1 WXVL_AK00073SB1035 [0,0,0,0,0,2|1,0,0]=3 688 B16R1.1465 C=CCCC(=O)NC/C=C/c1ccccc1 WXVL_AK00073SB1035 [0,0,0,0,0,2|1,0,0]=3