0 B14R1.158 C#CCCCC(=O)Nc1ccccc1 WXVL_AG00183SB2709 [0,0,0,0,0,0|2,0,2]=4 1 B14R1.158 C#CCCCC(=O)Nc1ccccc1 WXVL_AG00183SB2709 [0,0,0,0,0,0|2,0,2]=4 2 B14R1.158 C#CCCNC(=O)Cc1ccccc1 WXVL_AK3109SB0092 [0,0,0,0,0,0|1,0,2]=3 3 B14R1.158 C#CCCNC(=O)Cc1ccccc1 WXVL_AK3109SB0092 [0,0,0,0,0,0|1,0,2]=3 4 B14R1.158 C#CCCNC(=O)Cc1ccccn1 WXVL_AK3109SA0032 [0,0,0,0,0,0|2,0,2]=4 5 B14R1.158 C#CCCNC(=O)Cc1ccccn1 WXVL_AK3109SA0032 [0,0,0,0,0,0|2,0,2]=4 6 B14R1.158 C#CCCNC(=O)Cc1cccnc1 WXVL_AK3109SA0029 [0,0,0,0,0,0|2,0,2]=4 7 B14R1.158 C#CCCNC(=O)Cc1cccnc1 WXVL_AK3109SA0029 [0,0,0,0,0,0|2,0,2]=4 8 B14R1.158 C#CCCNC(=O)Cc1cccnc1 WXVL_AK3109SB00049 [0,0,0,0,0,0|2,0,2]=4 9 B14R1.158 C#CCCNC(=O)Cc1cccnc1 WXVL_AK3109SB00049 [0,0,0,0,0,0|2,0,2]=4 10 B14R1.158 C#CCCNC(=O)Cc1ccncc1 WXVL_AK3109SA00106 [0,0,0,0,0,0|2,0,2]=4 11 B14R1.158 C#CCCNC(=O)Cc1ccncc1 WXVL_AK3109SA00106 [0,0,0,0,0,0|2,0,2]=4 12 B14R1.158 C=CCCCC(=O)Nc1ccccc1 WXVL_AG00183SB2920 [0,0,0,0,0,0|2,0,2]=4 13 B14R1.158 C=CCCCC(=O)Nc1ccccc1 WXVL_AG00183SB2920 [0,0,0,0,0,0|2,0,2]=4 14 B14R1.158 C=CCCNC(=O)Cc1ccccc1 WXVL_AK00138SB0092 [0,0,0,0,0,0|1,0,2]=3 15 B14R1.158 C=CCCNC(=O)Cc1ccccc1 WXVL_AK00138SB0092 [0,0,0,0,0,0|1,0,2]=3 16 B14R1.158 C=CCCNC(=O)Cc1ccccn1 WXVL_AK00138SA0032 [0,0,0,0,0,0|2,0,2]=4 17 B14R1.158 C=CCCNC(=O)Cc1ccccn1 WXVL_AK00138SA0032 [0,0,0,0,0,0|2,0,2]=4 18 B14R1.158 C=CCCNC(=O)Cc1cccnc1 WXVL_AK00138SA0029 [0,0,0,0,0,0|2,0,2]=4 19 B14R1.158 C=CCCNC(=O)Cc1cccnc1 WXVL_AK00138SA0029 [0,0,0,0,0,0|2,0,2]=4 20 B14R1.158 C=CCCNC(=O)Cc1cccnc1 WXVL_AK00138SB00049 [0,0,0,0,0,0|2,0,2]=4 21 B14R1.158 C=CCCNC(=O)Cc1cccnc1 WXVL_AK00138SB00049 [0,0,0,0,0,0|2,0,2]=4 22 B14R1.158 C=CCCNC(=O)Cc1ccncc1 WXVL_AK00138SA00106 [0,0,0,0,0,0|2,0,2]=4 23 B14R1.158 C=CCCNC(=O)Cc1ccncc1 WXVL_AK00138SA00106 [0,0,0,0,0,0|2,0,2]=4 24 B14R1.158 CC/C=C/CC(=O)Nc1ccccc1 WXVL_AG00183SB0349 [0,0,0,0,0,0|2,0,2]=4 25 B14R1.158 CC/C=C/CC(=O)Nc1ccccc1 WXVL_AG00183SB0349 [0,0,0,0,0,0|2,0,2]=4 26 B14R1.158 CCCCNC(=O)Cc1ccccc1 WXVL_AK00588SB0092 [0,0,0,0,0,0|1,0,0]=1 27 B14R1.158 CCCCNC(=O)Cc1ccccc1 WXVL_AK00588SB0092 [0,0,0,0,0,0|1,0,0]=1 28 B14R1.158 CCCCNC(=O)Cc1ccccn1 WXVL_AK00588SA0032 [0,0,0,0,0,0|2,0,0]=2 29 B14R1.158 CCCCNC(=O)Cc1ccccn1 WXVL_AK00588SA0032 [0,0,0,0,0,0|2,0,0]=2 30 B14R1.158 CCCCNC(=O)Cc1cccnc1 WXVL_AK00588SA0029 [0,0,0,0,0,0|2,0,0]=2 31 B14R1.158 CCCCNC(=O)Cc1cccnc1 WXVL_AK00588SA0029 [0,0,0,0,0,0|2,0,0]=2 32 B14R1.158 CCCCNC(=O)Cc1cccnc1 WXVL_AK00588SB00049 [0,0,0,0,0,0|2,0,0]=2 33 B14R1.158 CCCCNC(=O)Cc1cccnc1 WXVL_AK00588SB00049 [0,0,0,0,0,0|2,0,0]=2 34 B14R1.158 CCCCNC(=O)Cc1ccncc1 WXVL_AK00588SA00106 [0,0,0,0,0,0|2,0,0]=2 35 B14R1.158 CCCCNC(=O)Cc1ccncc1 WXVL_AK00588SA00106 [0,0,0,0,0,0|2,0,0]=2 36 B14R1.158 CCCCNC(=O)Cc1cncnc1 WXVL_AK00588SA0242 [0,0,0,0,0,0|3,0,0]=3 37 B14R1.158 CCCCNC(=O)Cc1cncnc1 WXVL_AK00588SA0242 [0,0,0,0,0,0|3,0,0]=3 38 B14R1.158 CCCCNC(=O)Cc1ncccn1 WXVL_AK00588SA0307 [0,0,0,0,0,0|3,0,0]=3 39 B14R1.158 CCCCNC(=O)Cc1ncccn1 WXVL_AK00588SA0307 [0,0,0,0,0,0|3,0,0]=3 40 B14R1.158 CCCCNC(=O)Nc1ccccn1 WXVL_AK00588YV0189 [0,0,0,0,0,0|3,0,0]=3 41 B14R1.158 CCCCNC(=O)Nc1ccccn1 WXVL_AK00588YV0189 [0,0,0,0,0,0|3,0,0]=3 42 B14R1.158 CCO/C=C/C(=O)Nc1ccccc1 WXVL_AG00183SB3226 [0,0,0,0,0,0|3,0,1]=4 43 B14R1.158 CCO/C=C/C(=O)Nc1ccccc1 WXVL_AG00183SB3226 [0,0,0,0,0,0|3,0,1]=4 44 B14R1.158 CSCCNC(=O)Cc1ccccc1 WXVL_AK00440SB0092 [0,0,0,0,0,0|2,0,0]=2 45 B14R1.158 CSCCNC(=O)Cc1ccccc1 WXVL_AK00440SB0092 [0,0,0,0,0,0|2,0,0]=2 46 B14R1.158 CSCCNC(=O)Cc1ccccn1 WXVL_AK00440SA0032 [0,0,0,0,0,0|3,0,0]=3 47 B14R1.158 CSCCNC(=O)Cc1ccccn1 WXVL_AK00440SA0032 [0,0,0,0,0,0|3,0,0]=3 48 B14R1.158 CSCCNC(=O)Cc1cccnc1 WXVL_AK00440SA0029 [0,0,0,0,0,0|3,0,0]=3 49 B14R1.158 CSCCNC(=O)Cc1cccnc1 WXVL_AK00440SA0029 [0,0,0,0,0,0|3,0,0]=3 50 B14R1.158 CSCCNC(=O)Cc1cccnc1 WXVL_AK00440SB00049 [0,0,0,0,0,0|3,0,0]=3 51 B14R1.158 CSCCNC(=O)Cc1cccnc1 WXVL_AK00440SB00049 [0,0,0,0,0,0|3,0,0]=3 52 B14R1.158 CSCCNC(=O)Cc1ccncc1 WXVL_AK00440SA00106 [0,0,0,0,0,0|3,0,0]=3 53 B14R1.158 CSCCNC(=O)Cc1ccncc1 WXVL_AK00440SA00106 [0,0,0,0,0,0|3,0,0]=3 54 B14R1.158 CSCCNC(=O)Cc1cncnc1 WXVL_AK00440SA0242 [0,0,0,0,0,0|4,0,0]=4 55 B14R1.158 CSCCNC(=O)Cc1cncnc1 WXVL_AK00440SA0242 [0,0,0,0,0,0|4,0,0]=4 56 B14R1.158 CSCCNC(=O)Cc1ncccn1 WXVL_AK00440SA0307 [0,0,0,0,0,0|4,0,0]=4 57 B14R1.158 CSCCNC(=O)Cc1ncccn1 WXVL_AK00440SA0307 [0,0,0,0,0,0|4,0,0]=4 58 B14R1.158 CSCCNC(=O)Nc1ccccn1 WXVL_AK00440YV0189 [0,0,0,0,0,0|4,0,0]=4 59 B14R1.158 CSCCNC(=O)Nc1ccccn1 WXVL_AK00440YV0189 [0,0,0,0,0,0|4,0,0]=4 60 B14R1.158 N#CCCNC(=O)Cc1ccccc1 WXVL_AK0087SB0092 [0,0,0,0,0,0|2,0,1]=3 61 B14R1.158 N#CCCNC(=O)Cc1ccccc1 WXVL_AK0087SB0092 [0,0,0,0,0,0|2,0,1]=3 62 B14R1.158 N#CCCNC(=O)Cc1ccccn1 WXVL_AK0087SA0032 [0,0,0,0,0,0|3,0,1]=4 63 B14R1.158 N#CCCNC(=O)Cc1ccccn1 WXVL_AK0087SA0032 [0,0,0,0,0,0|3,0,1]=4 64 B14R1.158 N#CCCNC(=O)Cc1cccnc1 WXVL_AK0087SA0029 [0,0,0,0,0,0|3,0,1]=4 65 B14R1.158 N#CCCNC(=O)Cc1cccnc1 WXVL_AK0087SA0029 [0,0,0,0,0,0|3,0,1]=4 66 B14R1.158 N#CCCNC(=O)Cc1cccnc1 WXVL_AK0087SB00049 [0,0,0,0,0,0|3,0,1]=4 67 B14R1.158 N#CCCNC(=O)Cc1cccnc1 WXVL_AK0087SB00049 [0,0,0,0,0,0|3,0,1]=4 68 B14R1.158 N#CCCNC(=O)Cc1ccncc1 WXVL_AK0087SA00106 [0,0,0,0,0,0|3,0,1]=4 69 B14R1.158 N#CCCNC(=O)Cc1ccncc1 WXVL_AK0087SA00106 [0,0,0,0,0,0|3,0,1]=4 70 B14R1.158 O=C(CCCCBr)Nc1ccccc1 WXVL_AG00183SB3153 [0,0,0,0,0,0|3,0,0]=3 71 B14R1.158 O=C(CCCCBr)Nc1ccccc1 WXVL_AG00183SB3153 [0,0,0,0,0,0|3,0,0]=3 72 B14R1.158 O=C(CCCCBr)Nc1ccccn1 WXVL_AF00298SB3153 [0,0,0,0,0,0|4,0,0]=4 73 B14R1.158 O=C(CCCCBr)Nc1ccccn1 WXVL_AF00298SB3153 [0,0,0,0,0,0|4,0,0]=4 74 B14R1.158 O=C(CCCCCl)Nc1ccccc1 WXVL_AG00183SB0379 [0,0,0,0,0,0|3,0,0]=3 75 B14R1.158 O=C(CCCCCl)Nc1ccccc1 WXVL_AG00183SB0379 [0,0,0,0,0,0|3,0,0]=3 76 B14R1.158 O=C(CCCCCl)Nc1ccccn1 WXVL_AF00298SB0379 [0,0,0,0,0,0|4,0,0]=4 77 B14R1.158 O=C(CCCCCl)Nc1ccccn1 WXVL_AF00298SB0379 [0,0,0,0,0,0|4,0,0]=4 78 B14R1.158 O=C(Cc1ccccc1)NCCCO WXVL_AK0073SB0092 [0,0,0,0,0,0|2,0,0]=2 79 B14R1.158 O=C(Cc1ccccc1)NCCCO WXVL_AK0073SB0092 [0,0,0,0,0,0|2,0,0]=2 80 B14R1.158 O=C(Cc1ccccn1)NCCCO WXVL_AK0073SA0032 [0,0,0,0,0,0|3,0,0]=3 81 B14R1.158 O=C(Cc1ccccn1)NCCCO WXVL_AK0073SA0032 [0,0,0,0,0,0|3,0,0]=3 82 B14R1.158 O=C(Cc1cccnc1)NCCCO WXVL_AK0073SA0029 [0,0,0,0,0,0|3,0,0]=3 83 B14R1.158 O=C(Cc1cccnc1)NCCCO WXVL_AK0073SA0029 [0,0,0,0,0,0|3,0,0]=3 84 B14R1.158 O=C(Cc1cccnc1)NCCCO WXVL_AK0073SB00049 [0,0,0,0,0,0|3,0,0]=3 85 B14R1.158 O=C(Cc1cccnc1)NCCCO WXVL_AK0073SB00049 [0,0,0,0,0,0|3,0,0]=3 86 B14R1.158 O=C(Cc1ccncc1)NCCCO WXVL_AK0073SA00106 [0,0,0,0,0,0|3,0,0]=3 87 B14R1.158 O=C(Cc1ccncc1)NCCCO WXVL_AK0073SA00106 [0,0,0,0,0,0|3,0,0]=3 88 B14R1.158 O=C(Cc1cncnc1)NCCCO WXVL_AK0073SA0242 [0,0,0,0,0,0|4,0,0]=4 89 B14R1.158 O=C(Cc1cncnc1)NCCCO WXVL_AK0073SA0242 [0,0,0,0,0,0|4,0,0]=4 90 B14R1.158 O=C(Cc1ncccn1)NCCCO WXVL_AK0073SA0307 [0,0,0,0,0,0|4,0,0]=4 91 B14R1.158 O=C(Cc1ncccn1)NCCCO WXVL_AK0073SA0307 [0,0,0,0,0,0|4,0,0]=4 92 B14R1.158 O=C(NCCCCl)Nc1ccccc1 WXVL_AG00183YV0130 [0,0,0,0,0,0|3,0,0]=3 93 B14R1.158 O=C(NCCCCl)Nc1ccccc1 WXVL_AG00183YV0130 [0,0,0,0,0,0|3,0,0]=3 94 B14R1.158 O=C(NCCCCl)Nc1ccccn1 WXVL_AF00298YV0130 [0,0,0,0,0,0|4,0,0]=4 95 B14R1.158 O=C(NCCCCl)Nc1ccccn1 WXVL_AF00298YV0130 [0,0,0,0,0,0|4,0,0]=4 96 B14R1.158 O=C(NCCCO)Nc1ccccn1 WXVL_AK0073YV0189 [0,0,0,0,0,0|4,0,0]=4 97 B14R1.158 O=C(NCCCO)Nc1ccccn1 WXVL_AK0073YV0189 [0,0,0,0,0,0|4,0,0]=4 98 B13R1.44 C#CCCC(=O)Nc1ccccc1 WXVL_AG00183SB2189 [1,0,0,0,0,0|1,0,2]=4 99 B13R1.44 C#CCCC(=O)Nc1ccccc1 WXVL_AG00183SB2189 [1,0,0,0,0,0|1,0,2]=4 100 B13R1.44 C=CCCC(=O)Nc1ccccc1 WXVL_AG00183SB1035 [1,0,0,0,0,0|1,0,2]=4 101 B13R1.44 C=CCCC(=O)Nc1ccccc1 WXVL_AG00183SB1035 [1,0,0,0,0,0|1,0,2]=4 102 B13R1.44 C=CCNC(=O)Cc1ccccc1 WXVL_AK00561SB0092 [1,0,0,0,0,0|1,0,2]=4 103 B13R1.44 C=CCNC(=O)Cc1ccccc1 WXVL_AK00561SB0092 [1,0,0,0,0,0|1,0,2]=4 104 B13R1.44 CCCNC(=O)Cc1ccccc1 WXVL_AK00504SB0092 [1,0,0,0,0,0|1,0,0]=2 105 B13R1.44 CCCNC(=O)Cc1ccccc1 WXVL_AK00504SB0092 [1,0,0,0,0,0|1,0,0]=2 106 B13R1.44 CCCNC(=O)Cc1ccccn1 WXVL_AK00504SA0032 [1,0,0,0,0,0|2,0,0]=3 107 B13R1.44 CCCNC(=O)Cc1ccccn1 WXVL_AK00504SA0032 [1,0,0,0,0,0|2,0,0]=3 108 B13R1.44 CCCNC(=O)Cc1cccnc1 WXVL_AK00504SA0029 [1,0,0,0,0,0|2,0,0]=3 109 B13R1.44 CCCNC(=O)Cc1cccnc1 WXVL_AK00504SA0029 [1,0,0,0,0,0|2,0,0]=3 110 B13R1.44 CCCNC(=O)Cc1cccnc1 WXVL_AK00504SB00049 [1,0,0,0,0,0|2,0,0]=3 111 B13R1.44 CCCNC(=O)Cc1cccnc1 WXVL_AK00504SB00049 [1,0,0,0,0,0|2,0,0]=3 112 B13R1.44 CCCNC(=O)Cc1ccncc1 WXVL_AK00504SA00106 [1,0,0,0,0,0|2,0,0]=3 113 B13R1.44 CCCNC(=O)Cc1ccncc1 WXVL_AK00504SA00106 [1,0,0,0,0,0|2,0,0]=3 114 B13R1.44 CCCNC(=O)Cc1cncnc1 WXVL_AK00504SA0242 [1,0,0,0,0,0|3,0,0]=4 115 B13R1.44 CCCNC(=O)Cc1cncnc1 WXVL_AK00504SA0242 [1,0,0,0,0,0|3,0,0]=4 116 B13R1.44 CCCNC(=O)Cc1ncccn1 WXVL_AK00504SA0307 [1,0,0,0,0,0|3,0,0]=4 117 B13R1.44 CCCNC(=O)Cc1ncccn1 WXVL_AK00504SA0307 [1,0,0,0,0,0|3,0,0]=4 118 B13R1.44 CCCNC(=O)Nc1ccccn1 WXVL_AK00504YV0189 [1,0,0,0,0,0|3,0,0]=4 119 B13R1.44 CCCNC(=O)Nc1ccccn1 WXVL_AK00504YV0189 [1,0,0,0,0,0|3,0,0]=4 120 B13R1.44 CCOCC(=O)Nc1ccccc1 WXVL_AG00183SB0091 [1,0,0,0,0,0|2,0,0]=3 121 B13R1.44 CCOCC(=O)Nc1ccccc1 WXVL_AG00183SB0091 [1,0,0,0,0,0|2,0,0]=3 122 B13R1.44 CCOCC(=O)Nc1ccccn1 WXVL_AF00298SB0091 [1,0,0,0,0,0|3,0,0]=4 123 B13R1.44 CCOCC(=O)Nc1ccccn1 WXVL_AF00298SB0091 [1,0,0,0,0,0|3,0,0]=4 124 B13R1.44 CCSCC(=O)Nc1ccccc1 WXVL_AG00183SB0002 [1,0,0,0,0,0|2,0,0]=3 125 B13R1.44 CCSCC(=O)Nc1ccccc1 WXVL_AG00183SB0002 [1,0,0,0,0,0|2,0,0]=3 126 B13R1.44 CCSCC(=O)Nc1ccccn1 WXVL_AF00298SB0002 [1,0,0,0,0,0|3,0,0]=4 127 B13R1.44 CCSCC(=O)Nc1ccccn1 WXVL_AF00298SB0002 [1,0,0,0,0,0|3,0,0]=4 128 B13R1.44 COCCC(=O)Nc1ccccc1 WXVL_AG00183SB0156 [1,0,0,0,0,0|2,0,0]=3 129 B13R1.44 COCCC(=O)Nc1ccccc1 WXVL_AG00183SB0156 [1,0,0,0,0,0|2,0,0]=3 130 B13R1.44 COCCC(=O)Nc1ccccn1 WXVL_AF00298SB0156 [1,0,0,0,0,0|3,0,0]=4 131 B13R1.44 COCCC(=O)Nc1ccccn1 WXVL_AF00298SB0156 [1,0,0,0,0,0|3,0,0]=4 132 B13R1.44 CSCCC(=O)Nc1ccccc1 WXVL_AG00183SB0361 [1,0,0,0,0,0|2,0,0]=3 133 B13R1.44 CSCCC(=O)Nc1ccccc1 WXVL_AG00183SB0361 [1,0,0,0,0,0|2,0,0]=3 134 B13R1.44 CSCCC(=O)Nc1ccccn1 WXVL_AF00298SB0361 [1,0,0,0,0,0|3,0,0]=4 135 B13R1.44 CSCCC(=O)Nc1ccccn1 WXVL_AF00298SB0361 [1,0,0,0,0,0|3,0,0]=4 136 B13R1.44 N#CCNC(=O)Cc1ccccc1 WXVL_AK0683SB0092 [1,0,0,0,0,0|2,0,1]=4 137 B13R1.44 N#CCNC(=O)Cc1ccccc1 WXVL_AK0683SB0092 [1,0,0,0,0,0|2,0,1]=4 138 B13R1.44 O=C(Cc1ccccc1)NCCF WXVL_AK00466SB0092 [1,0,0,0,0,0|2,0,0]=3 139 B13R1.44 O=C(Cc1ccccc1)NCCF WXVL_AK00466SB0092 [1,0,0,0,0,0|2,0,0]=3 140 B13R1.44 O=C(Cc1ccccn1)NCCF WXVL_AK00466SA0032 [1,0,0,0,0,0|3,0,0]=4 141 B13R1.44 O=C(Cc1ccccn1)NCCF WXVL_AK00466SA0032 [1,0,0,0,0,0|3,0,0]=4 142 B13R1.44 O=C(Cc1cccnc1)NCCF WXVL_AK00466SA0029 [1,0,0,0,0,0|3,0,0]=4 143 B13R1.44 O=C(Cc1cccnc1)NCCF WXVL_AK00466SA0029 [1,0,0,0,0,0|3,0,0]=4 144 B13R1.44 O=C(Cc1cccnc1)NCCF WXVL_AK00466SB00049 [1,0,0,0,0,0|3,0,0]=4 145 B13R1.44 O=C(Cc1cccnc1)NCCF WXVL_AK00466SB00049 [1,0,0,0,0,0|3,0,0]=4 146 B13R1.44 O=C(Cc1ccncc1)NCCF WXVL_AK00466SA00106 [1,0,0,0,0,0|3,0,0]=4 147 B13R1.44 O=C(Cc1ccncc1)NCCF WXVL_AK00466SA00106 [1,0,0,0,0,0|3,0,0]=4 148 B13R1.44 O=C(NCCCl)Nc1ccccc1 WXVL_AG00183YV0092 [1,0,0,0,0,0|3,0,0]=4 149 B13R1.44 O=C(NCCCl)Nc1ccccc1 WXVL_AG00183YV0092 [1,0,0,0,0,0|3,0,0]=4 150 B15R1.83 C#CCCCNC(=O)Cc1ccccc1 WXVL_AK00218SB0092 [0,1,0,0,0,0|1,0,1]=3 151 B15R1.83 C#CCCCNC(=O)Cc1ccccc1 WXVL_AK00218SB0092 [0,1,0,0,0,0|1,0,1]=3 152 B15R1.83 C#CCCCNC(=O)Cc1ccccn1 WXVL_AK00218SA0032 [0,1,0,0,0,0|2,0,1]=4 153 B15R1.83 C#CCCCNC(=O)Cc1ccccn1 WXVL_AK00218SA0032 [0,1,0,0,0,0|2,0,1]=4 154 B15R1.83 C#CCCCNC(=O)Cc1cccnc1 WXVL_AK00218SA0029 [0,1,0,0,0,0|2,0,1]=4 155 B15R1.83 C#CCCCNC(=O)Cc1cccnc1 WXVL_AK00218SA0029 [0,1,0,0,0,0|2,0,1]=4 156 B15R1.83 C#CCCCNC(=O)Cc1cccnc1 WXVL_AK00218SB00049 [0,1,0,0,0,0|2,0,1]=4 157 B15R1.83 C#CCCCNC(=O)Cc1cccnc1 WXVL_AK00218SB00049 [0,1,0,0,0,0|2,0,1]=4 158 B15R1.83 C#CCCCNC(=O)Cc1ccncc1 WXVL_AK00218SA00106 [0,1,0,0,0,0|2,0,1]=4 159 B15R1.83 C#CCCCNC(=O)Cc1ccncc1 WXVL_AK00218SA00106 [0,1,0,0,0,0|2,0,1]=4 160 B15R1.83 CCCCCNC(=O)Cc1ccccc1 WXVL_AK0076SB0092 [0,1,0,0,0,0|1,0,0]=2 161 B15R1.83 CCCCCNC(=O)Cc1ccccc1 WXVL_AK0076SB0092 [0,1,0,0,0,0|1,0,0]=2 162 B15R1.83 CCCCCNC(=O)Cc1ccccn1 WXVL_AK0076SA0032 [0,1,0,0,0,0|2,0,0]=3 163 B15R1.83 CCCCCNC(=O)Cc1ccccn1 WXVL_AK0076SA0032 [0,1,0,0,0,0|2,0,0]=3 164 B15R1.83 CCCCCNC(=O)Cc1cccnc1 WXVL_AK0076SA0029 [0,1,0,0,0,0|2,0,0]=3 165 B15R1.83 CCCCCNC(=O)Cc1cccnc1 WXVL_AK0076SA0029 [0,1,0,0,0,0|2,0,0]=3 166 B15R1.83 CCCCCNC(=O)Cc1cccnc1 WXVL_AK0076SB00049 [0,1,0,0,0,0|2,0,0]=3 167 B15R1.83 CCCCCNC(=O)Cc1cccnc1 WXVL_AK0076SB00049 [0,1,0,0,0,0|2,0,0]=3 168 B15R1.83 CCCCCNC(=O)Cc1ccncc1 WXVL_AK0076SA00106 [0,1,0,0,0,0|2,0,0]=3 169 B15R1.83 CCCCCNC(=O)Cc1ccncc1 WXVL_AK0076SA00106 [0,1,0,0,0,0|2,0,0]=3 170 B15R1.83 CCCCCNC(=O)Cc1cncnc1 WXVL_AK0076SA0242 [0,1,0,0,0,0|3,0,0]=4 171 B15R1.83 CCCCCNC(=O)Cc1cncnc1 WXVL_AK0076SA0242 [0,1,0,0,0,0|3,0,0]=4 172 B15R1.83 CCCCCNC(=O)Cc1ncccn1 WXVL_AK0076SA0307 [0,1,0,0,0,0|3,0,0]=4 173 B15R1.83 CCCCCNC(=O)Cc1ncccn1 WXVL_AK0076SA0307 [0,1,0,0,0,0|3,0,0]=4 174 B15R1.83 CCCCCNC(=O)Nc1ccccn1 WXVL_AK0076YV0189 [0,1,0,0,0,0|3,0,0]=4 175 B15R1.83 CCCCCNC(=O)Nc1ccccn1 WXVL_AK0076YV0189 [0,1,0,0,0,0|3,0,0]=4 176 B15R1.83 CCSCCNC(=O)Cc1ccccc1 WXVL_AK00494SB0092 [0,1,0,0,0,0|1,0,0]=2 177 B15R1.83 CCSCCNC(=O)Cc1ccccc1 WXVL_AK00494SB0092 [0,1,0,0,0,0|1,0,0]=2 178 B15R1.83 CCSCCNC(=O)Cc1ccccn1 WXVL_AK00494SA0032 [0,1,0,0,0,0|2,0,0]=3 179 B15R1.83 CCSCCNC(=O)Cc1ccccn1 WXVL_AK00494SA0032 [0,1,0,0,0,0|2,0,0]=3 180 B15R1.83 CCSCCNC(=O)Cc1cccnc1 WXVL_AK00494SA0029 [0,1,0,0,0,0|2,0,0]=3 181 B15R1.83 CCSCCNC(=O)Cc1cccnc1 WXVL_AK00494SA0029 [0,1,0,0,0,0|2,0,0]=3 182 B15R1.83 CCSCCNC(=O)Cc1cccnc1 WXVL_AK00494SB00049 [0,1,0,0,0,0|2,0,0]=3 183 B15R1.83 CCSCCNC(=O)Cc1cccnc1 WXVL_AK00494SB00049 [0,1,0,0,0,0|2,0,0]=3 184 B15R1.83 CCSCCNC(=O)Cc1ccncc1 WXVL_AK00494SA00106 [0,1,0,0,0,0|2,0,0]=3 185 B15R1.83 CCSCCNC(=O)Cc1ccncc1 WXVL_AK00494SA00106 [0,1,0,0,0,0|2,0,0]=3 186 B15R1.83 CCSCCNC(=O)Cc1cncnc1 WXVL_AK00494SA0242 [0,1,0,0,0,0|3,0,0]=4 187 B15R1.83 CCSCCNC(=O)Cc1cncnc1 WXVL_AK00494SA0242 [0,1,0,0,0,0|3,0,0]=4 188 B15R1.83 CCSCCNC(=O)Cc1ncccn1 WXVL_AK00494SA0307 [0,1,0,0,0,0|3,0,0]=4 189 B15R1.83 CCSCCNC(=O)Cc1ncccn1 WXVL_AK00494SA0307 [0,1,0,0,0,0|3,0,0]=4 190 B15R1.83 CCSCCNC(=O)Nc1ccccn1 WXVL_AK00494YV0189 [0,1,0,0,0,0|3,0,0]=4 191 B15R1.83 CCSCCNC(=O)Nc1ccccn1 WXVL_AK00494YV0189 [0,1,0,0,0,0|3,0,0]=4 192 B15R1.83 COCCCNC(=O)Cc1ccccc1 WXVL_AK00637SB0092 [0,1,0,0,0,0|1,0,0]=2 193 B15R1.83 COCCCNC(=O)Cc1ccccc1 WXVL_AK00637SB0092 [0,1,0,0,0,0|1,0,0]=2 194 B15R1.83 COCCCNC(=O)Cc1ccccn1 WXVL_AK00637SA0032 [0,1,0,0,0,0|2,0,0]=3 195 B15R1.83 COCCCNC(=O)Cc1ccccn1 WXVL_AK00637SA0032 [0,1,0,0,0,0|2,0,0]=3 196 B15R1.83 COCCCNC(=O)Cc1cccnc1 WXVL_AK00637SA0029 [0,1,0,0,0,0|2,0,0]=3 197 B15R1.83 COCCCNC(=O)Cc1cccnc1 WXVL_AK00637SA0029 [0,1,0,0,0,0|2,0,0]=3 198 B15R1.83 COCCCNC(=O)Cc1cccnc1 WXVL_AK00637SB00049 [0,1,0,0,0,0|2,0,0]=3 199 B15R1.83 COCCCNC(=O)Cc1cccnc1 WXVL_AK00637SB00049 [0,1,0,0,0,0|2,0,0]=3 200 B15R1.83 COCCCNC(=O)Cc1ccncc1 WXVL_AK00637SA00106 [0,1,0,0,0,0|2,0,0]=3 201 B15R1.83 COCCCNC(=O)Cc1ccncc1 WXVL_AK00637SA00106 [0,1,0,0,0,0|2,0,0]=3 202 B15R1.83 COCCCNC(=O)Cc1cncnc1 WXVL_AK00637SA0242 [0,1,0,0,0,0|3,0,0]=4 203 B15R1.83 COCCCNC(=O)Cc1cncnc1 WXVL_AK00637SA0242 [0,1,0,0,0,0|3,0,0]=4 204 B15R1.83 COCCCNC(=O)Cc1ncccn1 WXVL_AK00637SA0307 [0,1,0,0,0,0|3,0,0]=4 205 B15R1.83 COCCCNC(=O)Cc1ncccn1 WXVL_AK00637SA0307 [0,1,0,0,0,0|3,0,0]=4 206 B15R1.83 COCCCNC(=O)Nc1ccccn1 WXVL_AK00637YV0189 [0,1,0,0,0,0|3,0,0]=4 207 B15R1.83 COCCCNC(=O)Nc1ccccn1 WXVL_AK00637YV0189 [0,1,0,0,0,0|3,0,0]=4 208 B15R1.83 COCCOCC(=O)Nc1ccccc1 WXVL_AG00183SB0159 [0,1,0,0,0,0|2,0,0]=3 209 B15R1.83 COCCOCC(=O)Nc1ccccc1 WXVL_AG00183SB0159 [0,1,0,0,0,0|2,0,0]=3 210 B15R1.83 COCCOCC(=O)Nc1ccccn1 WXVL_AF00298SB0159 [0,1,0,0,0,0|3,0,0]=4 211 B15R1.83 COCCOCC(=O)Nc1ccccn1 WXVL_AF00298SB0159 [0,1,0,0,0,0|3,0,0]=4 212 B15R1.83 CSCCCNC(=O)Cc1ccccc1 WXVL_AK0965SB0092 [0,1,0,0,0,0|1,0,0]=2 213 B15R1.83 CSCCCNC(=O)Cc1ccccc1 WXVL_AK0965SB0092 [0,1,0,0,0,0|1,0,0]=2 214 B15R1.83 CSCCCNC(=O)Cc1ccccn1 WXVL_AK0965SA0032 [0,1,0,0,0,0|2,0,0]=3 215 B15R1.83 CSCCCNC(=O)Cc1ccccn1 WXVL_AK0965SA0032 [0,1,0,0,0,0|2,0,0]=3 216 B15R1.83 CSCCCNC(=O)Cc1cccnc1 WXVL_AK0965SA0029 [0,1,0,0,0,0|2,0,0]=3 217 B15R1.83 CSCCCNC(=O)Cc1cccnc1 WXVL_AK0965SA0029 [0,1,0,0,0,0|2,0,0]=3 218 B15R1.83 CSCCCNC(=O)Cc1cccnc1 WXVL_AK0965SB00049 [0,1,0,0,0,0|2,0,0]=3 219 B15R1.83 CSCCCNC(=O)Cc1cccnc1 WXVL_AK0965SB00049 [0,1,0,0,0,0|2,0,0]=3 220 B15R1.83 CSCCCNC(=O)Cc1ccncc1 WXVL_AK0965SA00106 [0,1,0,0,0,0|2,0,0]=3 221 B15R1.83 CSCCCNC(=O)Cc1ccncc1 WXVL_AK0965SA00106 [0,1,0,0,0,0|2,0,0]=3 222 B15R1.83 CSCCCNC(=O)Cc1cncnc1 WXVL_AK0965SA0242 [0,1,0,0,0,0|3,0,0]=4 223 B15R1.83 CSCCCNC(=O)Cc1cncnc1 WXVL_AK0965SA0242 [0,1,0,0,0,0|3,0,0]=4 224 B15R1.83 CSCCCNC(=O)Cc1ncccn1 WXVL_AK0965SA0307 [0,1,0,0,0,0|3,0,0]=4 225 B15R1.83 CSCCCNC(=O)Cc1ncccn1 WXVL_AK0965SA0307 [0,1,0,0,0,0|3,0,0]=4 226 B15R1.83 CSCCCNC(=O)Nc1ccccn1 WXVL_AK0965YV0189 [0,1,0,0,0,0|3,0,0]=4 227 B15R1.83 CSCCCNC(=O)Nc1ccccn1 WXVL_AK0965YV0189 [0,1,0,0,0,0|3,0,0]=4 228 B15R1.83 O=C(CCCCCBr)Nc1ccccc1 WXVL_AG00183SB2192 [0,1,0,0,0,0|2,0,0]=3 229 B15R1.83 O=C(CCCCCBr)Nc1ccccc1 WXVL_AG00183SB2192 [0,1,0,0,0,0|2,0,0]=3 230 B15R1.83 O=C(CCCCCBr)Nc1ccccn1 WXVL_AF00298SB2192 [0,1,0,0,0,0|3,0,0]=4 231 B15R1.83 O=C(CCCCCBr)Nc1ccccn1 WXVL_AF00298SB2192 [0,1,0,0,0,0|3,0,0]=4 232 B15R1.83 O=C(CCCCCO)Nc1ccccc1 WXVL_AG00183SB2973 [0,1,0,0,0,0|2,0,0]=3 233 B15R1.83 O=C(CCCCCO)Nc1ccccc1 WXVL_AG00183SB2973 [0,1,0,0,0,0|2,0,0]=3 234 B15R1.83 O=C(CCCCCO)Nc1ccccn1 WXVL_AF00298SB2973 [0,1,0,0,0,0|3,0,0]=4 235 B15R1.83 O=C(CCCCCO)Nc1ccccn1 WXVL_AF00298SB2973 [0,1,0,0,0,0|3,0,0]=4 236 B15R1.83 O=C(Cc1ccccc1)NCCCCO WXVL_AK0075SB0092 [0,1,0,0,0,0|1,0,0]=2 237 B15R1.83 O=C(Cc1ccccc1)NCCCCO WXVL_AK0075SB0092 [0,1,0,0,0,0|1,0,0]=2 238 B15R1.83 O=C(Cc1ccccn1)NCCCCO WXVL_AK0075SA0032 [0,1,0,0,0,0|2,0,0]=3 239 B15R1.83 O=C(Cc1ccccn1)NCCCCO WXVL_AK0075SA0032 [0,1,0,0,0,0|2,0,0]=3 240 B15R1.83 O=C(Cc1cccnc1)NCCCCO WXVL_AK0075SA0029 [0,1,0,0,0,0|2,0,0]=3 241 B15R1.83 O=C(Cc1cccnc1)NCCCCO WXVL_AK0075SA0029 [0,1,0,0,0,0|2,0,0]=3 242 B15R1.83 O=C(Cc1cccnc1)NCCCCO WXVL_AK0075SB00049 [0,1,0,0,0,0|2,0,0]=3 243 B15R1.83 O=C(Cc1cccnc1)NCCCCO WXVL_AK0075SB00049 [0,1,0,0,0,0|2,0,0]=3 244 B15R1.83 O=C(Cc1ccncc1)NCCCCO WXVL_AK0075SA00106 [0,1,0,0,0,0|2,0,0]=3 245 B15R1.83 O=C(Cc1ccncc1)NCCCCO WXVL_AK0075SA00106 [0,1,0,0,0,0|2,0,0]=3 246 B15R1.83 O=C(Cc1cncnc1)NCCCCO WXVL_AK0075SA0242 [0,1,0,0,0,0|3,0,0]=4 247 B15R1.83 O=C(Cc1cncnc1)NCCCCO WXVL_AK0075SA0242 [0,1,0,0,0,0|3,0,0]=4 248 B15R1.83 O=C(Cc1ncccn1)NCCCCO WXVL_AK0075SA0307 [0,1,0,0,0,0|3,0,0]=4 249 B15R1.83 O=C(Cc1ncccn1)NCCCCO WXVL_AK0075SA0307 [0,1,0,0,0,0|3,0,0]=4 250 B15R1.83 O=C(NCCCCO)Nc1ccccn1 WXVL_AK0075YV0189 [0,1,0,0,0,0|3,0,0]=4 251 B15R1.83 O=C(NCCCCO)Nc1ccccn1 WXVL_AK0075YV0189 [0,1,0,0,0,0|3,0,0]=4 252 B15R1.93 C#CCCNC(=O)C(C)c1ccccc1 WXVL_AK3109SB2326 [0,1,0,0,0,0|1,0,2]=4 253 B15R1.93 C#CCCNC(=O)C(C)c1ccccc1 WXVL_AK3109SB2326 [0,1,0,0,0,0|1,0,2]=4 254 B15R1.93 C#CCCNC(=O)C(O)c1ccccc1 WXVL_AK3109SB0168 [0,1,0,0,0,0|1,0,2]=4 255 B15R1.93 C#CCCNC(=O)C(O)c1ccccc1 WXVL_AK3109SB0168 [0,1,0,0,0,0|1,0,2]=4 256 B15R1.93 C=CCCNC(=O)C(C)c1ccccc1 WXVL_AK00138SB2326 [0,1,0,0,0,0|1,0,2]=4 257 B15R1.93 C=CCCNC(=O)C(C)c1ccccc1 WXVL_AK00138SB2326 [0,1,0,0,0,0|1,0,2]=4 258 B15R1.93 C=CCCNC(=O)C(O)c1ccccc1 WXVL_AK00138SB0168 [0,1,0,0,0,0|1,0,2]=4 259 B15R1.93 C=CCCNC(=O)C(O)c1ccccc1 WXVL_AK00138SB0168 [0,1,0,0,0,0|1,0,2]=4 260 B15R1.93 CC(C(=O)NCCC#N)c1ccccc1 WXVL_AK0087SB2326 [0,1,0,0,0,0|2,0,1]=4 261 B15R1.93 CC(C(=O)NCCC#N)c1ccccc1 WXVL_AK0087SB2326 [0,1,0,0,0,0|2,0,1]=4 262 B15R1.93 CC(C(=O)NCCCO)c1ccccc1 WXVL_AK0073SB2326 [0,1,0,0,0,0|2,0,0]=3 263 B15R1.93 CC(C(=O)NCCCO)c1ccccc1 WXVL_AK0073SB2326 [0,1,0,0,0,0|2,0,0]=3 264 B15R1.93 CCCCNC(=O)C(=O)c1ccccc1 WXVL_AK00588SB0050 [0,1,0,0,0,0|1,0,1]=3 265 B15R1.93 CCCCNC(=O)C(=O)c1ccccc1 WXVL_AK00588SB0050 [0,1,0,0,0,0|1,0,1]=3 266 B15R1.93 CCCCNC(=O)C(C)c1ccccc1 WXVL_AK00588SB2326 [0,1,0,0,0,0|1,0,0]=2 267 B15R1.93 CCCCNC(=O)C(C)c1ccccc1 WXVL_AK00588SB2326 [0,1,0,0,0,0|1,0,0]=2 268 B15R1.93 CCCCNC(=O)C(O)c1ccccc1 WXVL_AK00588SB0168 [0,1,0,0,0,0|1,0,0]=2 269 B15R1.93 CCCCNC(=O)C(O)c1ccccc1 WXVL_AK00588SB0168 [0,1,0,0,0,0|1,0,0]=2 270 B15R1.93 CSCCNC(=O)C(=O)c1ccccc1 WXVL_AK00440SB0050 [0,1,0,0,0,0|2,0,1]=4 271 B15R1.93 CSCCNC(=O)C(=O)c1ccccc1 WXVL_AK00440SB0050 [0,1,0,0,0,0|2,0,1]=4 272 B15R1.93 CSCCNC(=O)C(C)c1ccccc1 WXVL_AK00440SB2326 [0,1,0,0,0,0|2,0,0]=3 273 B15R1.93 CSCCNC(=O)C(C)c1ccccc1 WXVL_AK00440SB2326 [0,1,0,0,0,0|2,0,0]=3 274 B15R1.93 CSCCNC(=O)C(O)c1ccccc1 WXVL_AK00440SB0168 [0,1,0,0,0,0|2,0,0]=3 275 B15R1.93 CSCCNC(=O)C(O)c1ccccc1 WXVL_AK00440SB0168 [0,1,0,0,0,0|2,0,0]=3 276 B15R1.93 N#CCCNC(=O)C(O)c1ccccc1 WXVL_AK0087SB0168 [0,1,0,0,0,0|2,0,1]=4 277 B15R1.93 N#CCCNC(=O)C(O)c1ccccc1 WXVL_AK0087SB0168 [0,1,0,0,0,0|2,0,1]=4 278 B15R1.93 O=C(NCCCO)C(=O)c1ccccc1 WXVL_AK0073SB0050 [0,1,0,0,0,0|2,0,1]=4 279 B15R1.93 O=C(NCCCO)C(=O)c1ccccc1 WXVL_AK0073SB0050 [0,1,0,0,0,0|2,0,1]=4 280 B15R1.93 O=C(NCCCO)C(O)c1ccccc1 WXVL_AK0073SB0168 [0,1,0,0,0,0|2,0,0]=3 281 B15R1.93 O=C(NCCCO)C(O)c1ccccc1 WXVL_AK0073SB0168 [0,1,0,0,0,0|2,0,0]=3 282 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)Br WXVL_AK3109SB0926 [0,1,0,0,0,0|1,0,2]=4 283 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)Br WXVL_AK3109SB0926 [0,1,0,0,0,0|1,0,2]=4 284 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)C WXVL_AK3109SB0112 [0,1,0,0,0,0|1,0,2]=4 285 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)C WXVL_AK3109SB0112 [0,1,0,0,0,0|1,0,2]=4 286 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK3109SB0107 [0,1,0,0,0,0|1,0,2]=4 287 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK3109SB0107 [0,1,0,0,0,0|1,0,2]=4 288 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)F WXVL_AK3109SB0106 [0,1,0,0,0,0|1,0,2]=4 289 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)F WXVL_AK3109SB0106 [0,1,0,0,0,0|1,0,2]=4 290 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)O WXVL_AK3109SB0110 [0,1,0,0,0,0|1,0,2]=4 291 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)O WXVL_AK3109SB0110 [0,1,0,0,0,0|1,0,2]=4 292 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)Br WXVL_AK00138SB0926 [0,1,0,0,0,0|1,0,2]=4 293 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)Br WXVL_AK00138SB0926 [0,1,0,0,0,0|1,0,2]=4 294 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)C WXVL_AK00138SB0112 [0,1,0,0,0,0|1,0,2]=4 295 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)C WXVL_AK00138SB0112 [0,1,0,0,0,0|1,0,2]=4 296 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK00138SB0107 [0,1,0,0,0,0|1,0,2]=4 297 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK00138SB0107 [0,1,0,0,0,0|1,0,2]=4 298 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)F WXVL_AK00138SB0106 [0,1,0,0,0,0|1,0,2]=4 299 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)F WXVL_AK00138SB0106 [0,1,0,0,0,0|1,0,2]=4 300 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)O WXVL_AK00138SB0110 [0,1,0,0,0,0|1,0,2]=4 301 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)O WXVL_AK00138SB0110 [0,1,0,0,0,0|1,0,2]=4 302 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Br WXVL_AK00588SB0926 [0,1,0,0,0,0|1,0,0]=2 303 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Br WXVL_AK00588SB0926 [0,1,0,0,0,0|1,0,0]=2 304 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)C WXVL_AK00588SB0112 [0,1,0,0,0,0|1,0,0]=2 305 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)C WXVL_AK00588SB0112 [0,1,0,0,0,0|1,0,0]=2 306 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK00588SB0107 [0,1,0,0,0,0|1,0,0]=2 307 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK00588SB0107 [0,1,0,0,0,0|1,0,0]=2 308 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)F WXVL_AK00588SB0106 [0,1,0,0,0,0|1,0,0]=2 309 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)F WXVL_AK00588SB0106 [0,1,0,0,0,0|1,0,0]=2 310 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)O WXVL_AK00588SB0110 [0,1,0,0,0,0|1,0,0]=2 311 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)O WXVL_AK00588SB0110 [0,1,0,0,0,0|1,0,0]=2 312 B15R1.128 CCCCNC(=O)Cc1ccc(cn1)Br WXVL_AK00588SA0212 [0,1,0,0,0,0|2,0,0]=3 313 B15R1.128 CCCCNC(=O)Cc1ccc(cn1)Br WXVL_AK00588SA0212 [0,1,0,0,0,0|2,0,0]=3 314 B15R1.128 CCCCNC(=O)Cc1ccc(cn1)Cl WXVL_AK00588SA0537 [0,1,0,0,0,0|2,0,0]=3 315 B15R1.128 CCCCNC(=O)Cc1ccc(cn1)Cl WXVL_AK00588SA0537 [0,1,0,0,0,0|2,0,0]=3 316 B15R1.128 CCCCNC(=O)Cc1ccc(cn1)F WXVL_AK00588SA0011 [0,1,0,0,0,0|2,0,0]=3 317 B15R1.128 CCCCNC(=O)Cc1ccc(cn1)F WXVL_AK00588SA0011 [0,1,0,0,0,0|2,0,0]=3 318 B15R1.128 CCCCNC(=O)Cc1ccc(cn1)O WXVL_AK00588SA2976 [0,1,0,0,0,0|2,0,0]=3 319 B15R1.128 CCCCNC(=O)Cc1ccc(cn1)O WXVL_AK00588SA2976 [0,1,0,0,0,0|2,0,0]=3 320 B15R1.128 CCCCNC(=O)Cc1ccc(nc1)Br WXVL_AK00588SA00056 [0,1,0,0,0,0|2,0,0]=3 321 B15R1.128 CCCCNC(=O)Cc1ccc(nc1)Br WXVL_AK00588SA00056 [0,1,0,0,0,0|2,0,0]=3 322 B15R1.128 CCCCNC(=O)Cc1ccc(nc1)C WXVL_AK00588SA0250 [0,1,0,0,0,0|2,0,0]=3 323 B15R1.128 CCCCNC(=O)Cc1ccc(nc1)C WXVL_AK00588SA0250 [0,1,0,0,0,0|2,0,0]=3 324 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)C WXVL_AK00588YV0026 [0,1,0,0,0,0|2,0,0]=3 325 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)C WXVL_AK00588YV0026 [0,1,0,0,0,0|2,0,0]=3 326 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)Cl WXVL_AK00588YV0023 [0,1,0,0,0,0|2,0,0]=3 327 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)Cl WXVL_AK00588YV0023 [0,1,0,0,0,0|2,0,0]=3 328 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)Br WXVL_AK00440SB0926 [0,1,0,0,0,0|2,0,0]=3 329 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)Br WXVL_AK00440SB0926 [0,1,0,0,0,0|2,0,0]=3 330 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)C WXVL_AK00440SB0112 [0,1,0,0,0,0|2,0,0]=3 331 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)C WXVL_AK00440SB0112 [0,1,0,0,0,0|2,0,0]=3 332 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK00440SB0107 [0,1,0,0,0,0|2,0,0]=3 333 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK00440SB0107 [0,1,0,0,0,0|2,0,0]=3 334 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)F WXVL_AK00440SB0106 [0,1,0,0,0,0|2,0,0]=3 335 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)F WXVL_AK00440SB0106 [0,1,0,0,0,0|2,0,0]=3 336 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)O WXVL_AK00440SB0110 [0,1,0,0,0,0|2,0,0]=3 337 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)O WXVL_AK00440SB0110 [0,1,0,0,0,0|2,0,0]=3 338 B15R1.128 CSCCNC(=O)Cc1ccc(cn1)Br WXVL_AK00440SA0212 [0,1,0,0,0,0|3,0,0]=4 339 B15R1.128 CSCCNC(=O)Cc1ccc(cn1)Br WXVL_AK00440SA0212 [0,1,0,0,0,0|3,0,0]=4 340 B15R1.128 CSCCNC(=O)Cc1ccc(cn1)Cl WXVL_AK00440SA0537 [0,1,0,0,0,0|3,0,0]=4 341 B15R1.128 CSCCNC(=O)Cc1ccc(cn1)Cl WXVL_AK00440SA0537 [0,1,0,0,0,0|3,0,0]=4 342 B15R1.128 CSCCNC(=O)Cc1ccc(cn1)F WXVL_AK00440SA0011 [0,1,0,0,0,0|3,0,0]=4 343 B15R1.128 CSCCNC(=O)Cc1ccc(cn1)F WXVL_AK00440SA0011 [0,1,0,0,0,0|3,0,0]=4 344 B15R1.128 CSCCNC(=O)Cc1ccc(cn1)O WXVL_AK00440SA2976 [0,1,0,0,0,0|3,0,0]=4 345 B15R1.128 CSCCNC(=O)Cc1ccc(cn1)O WXVL_AK00440SA2976 [0,1,0,0,0,0|3,0,0]=4 346 B15R1.128 CSCCNC(=O)Cc1ccc(nc1)Br WXVL_AK00440SA00056 [0,1,0,0,0,0|3,0,0]=4 347 B15R1.128 CSCCNC(=O)Cc1ccc(nc1)Br WXVL_AK00440SA00056 [0,1,0,0,0,0|3,0,0]=4 348 B15R1.128 CSCCNC(=O)Cc1ccc(nc1)C WXVL_AK00440SA0250 [0,1,0,0,0,0|3,0,0]=4 349 B15R1.128 CSCCNC(=O)Cc1ccc(nc1)C WXVL_AK00440SA0250 [0,1,0,0,0,0|3,0,0]=4 350 B15R1.128 CSCCNC(=O)Nc1ccc(cc1)C WXVL_AK00440YV0026 [0,1,0,0,0,0|3,0,0]=4 351 B15R1.128 CSCCNC(=O)Nc1ccc(cc1)C WXVL_AK00440YV0026 [0,1,0,0,0,0|3,0,0]=4 352 B15R1.128 CSCCNC(=O)Nc1ccc(cc1)Cl WXVL_AK00440YV0023 [0,1,0,0,0,0|3,0,0]=4 353 B15R1.128 CSCCNC(=O)Nc1ccc(cc1)Cl WXVL_AK00440YV0023 [0,1,0,0,0,0|3,0,0]=4 354 B15R1.128 Cc1ccc(cc1)CC(=O)NCCC#N WXVL_AK0087SB0112 [0,1,0,0,0,0|2,0,1]=4 355 B15R1.128 Cc1ccc(cc1)CC(=O)NCCC#N WXVL_AK0087SB0112 [0,1,0,0,0,0|2,0,1]=4 356 B15R1.128 Cc1ccc(cc1)CC(=O)NCCCO WXVL_AK0073SB0112 [0,1,0,0,0,0|2,0,0]=3 357 B15R1.128 Cc1ccc(cc1)CC(=O)NCCCO WXVL_AK0073SB0112 [0,1,0,0,0,0|2,0,0]=3 358 B15R1.128 Cc1ccc(cc1)NC(=O)NCCCO WXVL_AK0073YV0026 [0,1,0,0,0,0|3,0,0]=4 359 B15R1.128 Cc1ccc(cc1)NC(=O)NCCCO WXVL_AK0073YV0026 [0,1,0,0,0,0|3,0,0]=4 360 B15R1.128 Cc1ccc(cn1)CC(=O)NCCCO WXVL_AK0073SA0250 [0,1,0,0,0,0|3,0,0]=4 361 B15R1.128 Cc1ccc(cn1)CC(=O)NCCCO WXVL_AK0073SA0250 [0,1,0,0,0,0|3,0,0]=4 362 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)Br WXVL_AK0087SB0926 [0,1,0,0,0,0|2,0,1]=4 363 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)Br WXVL_AK0087SB0926 [0,1,0,0,0,0|2,0,1]=4 364 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK0087SB0107 [0,1,0,0,0,0|2,0,1]=4 365 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK0087SB0107 [0,1,0,0,0,0|2,0,1]=4 366 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)F WXVL_AK0087SB0106 [0,1,0,0,0,0|2,0,1]=4 367 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)F WXVL_AK0087SB0106 [0,1,0,0,0,0|2,0,1]=4 368 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)O WXVL_AK0087SB0110 [0,1,0,0,0,0|2,0,1]=4 369 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)O WXVL_AK0087SB0110 [0,1,0,0,0,0|2,0,1]=4 370 B15R1.128 O=C(CCCCBr)Nc1ccc(cc1)Cl WXVL_AG0062SB3153 [0,1,0,0,0,0|3,0,0]=4 371 B15R1.128 O=C(CCCCBr)Nc1ccc(cc1)Cl WXVL_AG0062SB3153 [0,1,0,0,0,0|3,0,0]=4 372 B15R1.128 O=C(CCCCBr)Nc1ccc(cc1)I WXVL_AG1742SB3153 [0,1,0,0,0,0|3,0,0]=4 373 B15R1.128 O=C(CCCCBr)Nc1ccc(cc1)I WXVL_AG1742SB3153 [0,1,0,0,0,0|3,0,0]=4 374 B15R1.128 O=C(CCCCCl)Nc1ccc(cc1)Cl WXVL_AG0062SB0379 [0,1,0,0,0,0|3,0,0]=4 375 B15R1.128 O=C(CCCCCl)Nc1ccc(cc1)Cl WXVL_AG0062SB0379 [0,1,0,0,0,0|3,0,0]=4 376 B15R1.128 O=C(CCCCCl)Nc1ccc(cc1)I WXVL_AG1742SB0379 [0,1,0,0,0,0|3,0,0]=4 377 B15R1.128 O=C(CCCCCl)Nc1ccc(cc1)I WXVL_AG1742SB0379 [0,1,0,0,0,0|3,0,0]=4 378 B15R1.128 O=C(Cc1ccc(cc1)Br)NCCCO WXVL_AK0073SB0926 [0,1,0,0,0,0|2,0,0]=3 379 B15R1.128 O=C(Cc1ccc(cc1)Br)NCCCO WXVL_AK0073SB0926 [0,1,0,0,0,0|2,0,0]=3 380 B15R1.128 O=C(Cc1ccc(cc1)Cl)NCCCO WXVL_AK0073SB0107 [0,1,0,0,0,0|2,0,0]=3 381 B15R1.128 O=C(Cc1ccc(cc1)Cl)NCCCO WXVL_AK0073SB0107 [0,1,0,0,0,0|2,0,0]=3 382 B15R1.128 O=C(Cc1ccc(cc1)F)NCCCO WXVL_AK0073SB0106 [0,1,0,0,0,0|2,0,0]=3 383 B15R1.128 O=C(Cc1ccc(cc1)F)NCCCO WXVL_AK0073SB0106 [0,1,0,0,0,0|2,0,0]=3 384 B15R1.128 O=C(Cc1ccc(cc1)O)NCCCO WXVL_AK0073SB0110 [0,1,0,0,0,0|2,0,0]=3 385 B15R1.128 O=C(Cc1ccc(cc1)O)NCCCO WXVL_AK0073SB0110 [0,1,0,0,0,0|2,0,0]=3 386 B15R1.128 O=C(Cc1ccc(cn1)Br)NCCCO WXVL_AK0073SA0212 [0,1,0,0,0,0|3,0,0]=4 387 B15R1.128 O=C(Cc1ccc(cn1)Br)NCCCO WXVL_AK0073SA0212 [0,1,0,0,0,0|3,0,0]=4 388 B15R1.128 O=C(Cc1ccc(cn1)Cl)NCCCO WXVL_AK0073SA0537 [0,1,0,0,0,0|3,0,0]=4 389 B15R1.128 O=C(Cc1ccc(cn1)Cl)NCCCO WXVL_AK0073SA0537 [0,1,0,0,0,0|3,0,0]=4 390 B15R1.128 O=C(Cc1ccc(cn1)F)NCCCO WXVL_AK0073SA0011 [0,1,0,0,0,0|3,0,0]=4 391 B15R1.128 O=C(Cc1ccc(cn1)F)NCCCO WXVL_AK0073SA0011 [0,1,0,0,0,0|3,0,0]=4 392 B15R1.128 O=C(Cc1ccc(cn1)O)NCCCO WXVL_AK0073SA2976 [0,1,0,0,0,0|3,0,0]=4 393 B15R1.128 O=C(Cc1ccc(cn1)O)NCCCO WXVL_AK0073SA2976 [0,1,0,0,0,0|3,0,0]=4 394 B15R1.128 O=C(Cc1ccc(nc1)Br)NCCCO WXVL_AK0073SA00056 [0,1,0,0,0,0|3,0,0]=4 395 B15R1.128 O=C(Cc1ccc(nc1)Br)NCCCO WXVL_AK0073SA00056 [0,1,0,0,0,0|3,0,0]=4 396 B15R1.128 O=C(NCCCCl)Nc1ccc(cc1)Cl WXVL_AG0062YV0130 [0,1,0,0,0,0|3,0,0]=4 397 B15R1.128 O=C(NCCCCl)Nc1ccc(cc1)Cl WXVL_AG0062YV0130 [0,1,0,0,0,0|3,0,0]=4 398 B15R1.128 O=C(NCCCCl)Nc1ccc(cc1)I WXVL_AG1742YV0130 [0,1,0,0,0,0|3,0,0]=4 399 B15R1.128 O=C(NCCCCl)Nc1ccc(cc1)I WXVL_AG1742YV0130 [0,1,0,0,0,0|3,0,0]=4 400 B15R1.128 O=C(NCCCO)Nc1ccc(cc1)Cl WXVL_AK0073YV0023 [0,1,0,0,0,0|3,0,0]=4 401 B15R1.128 O=C(NCCCO)Nc1ccc(cc1)Cl WXVL_AK0073YV0023 [0,1,0,0,0,0|3,0,0]=4 402 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)Br WXVL_AK3109SB0099 [0,1,0,0,0,0|1,0,2]=4 403 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)Br WXVL_AK3109SB0099 [0,1,0,0,0,0|1,0,2]=4 404 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)C WXVL_AK3109SB0105 [0,1,0,0,0,0|1,0,2]=4 405 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)C WXVL_AK3109SB0105 [0,1,0,0,0,0|1,0,2]=4 406 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)Cl WXVL_AK3109SB0101 [0,1,0,0,0,0|1,0,2]=4 407 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)Cl WXVL_AK3109SB0101 [0,1,0,0,0,0|1,0,2]=4 408 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)F WXVL_AK3109SB0100 [0,1,0,0,0,0|1,0,2]=4 409 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)F WXVL_AK3109SB0100 [0,1,0,0,0,0|1,0,2]=4 410 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)O WXVL_AK3109SB0104 [0,1,0,0,0,0|1,0,2]=4 411 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)O WXVL_AK3109SB0104 [0,1,0,0,0,0|1,0,2]=4 412 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)Br WXVL_AK00138SB0099 [0,1,0,0,0,0|1,0,2]=4 413 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)Br WXVL_AK00138SB0099 [0,1,0,0,0,0|1,0,2]=4 414 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)C WXVL_AK00138SB0105 [0,1,0,0,0,0|1,0,2]=4 415 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)C WXVL_AK00138SB0105 [0,1,0,0,0,0|1,0,2]=4 416 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)Cl WXVL_AK00138SB0101 [0,1,0,0,0,0|1,0,2]=4 417 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)Cl WXVL_AK00138SB0101 [0,1,0,0,0,0|1,0,2]=4 418 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)F WXVL_AK00138SB0100 [0,1,0,0,0,0|1,0,2]=4 419 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)F WXVL_AK00138SB0100 [0,1,0,0,0,0|1,0,2]=4 420 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)O WXVL_AK00138SB0104 [0,1,0,0,0,0|1,0,2]=4 421 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)O WXVL_AK00138SB0104 [0,1,0,0,0,0|1,0,2]=4 422 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Br WXVL_AK00588SB0099 [0,1,0,0,0,0|1,0,0]=2 423 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Br WXVL_AK00588SB0099 [0,1,0,0,0,0|1,0,0]=2 424 B15R1.129 CCCCNC(=O)Cc1cccc(c1)C WXVL_AK00588SB0105 [0,1,0,0,0,0|1,0,0]=2 425 B15R1.129 CCCCNC(=O)Cc1cccc(c1)C WXVL_AK00588SB0105 [0,1,0,0,0,0|1,0,0]=2 426 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Cl WXVL_AK00588SB0101 [0,1,0,0,0,0|1,0,0]=2 427 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Cl WXVL_AK00588SB0101 [0,1,0,0,0,0|1,0,0]=2 428 B15R1.129 CCCCNC(=O)Cc1cccc(c1)F WXVL_AK00588SB0100 [0,1,0,0,0,0|1,0,0]=2 429 B15R1.129 CCCCNC(=O)Cc1cccc(c1)F WXVL_AK00588SB0100 [0,1,0,0,0,0|1,0,0]=2 430 B15R1.129 CCCCNC(=O)Cc1cccc(c1)O WXVL_AK00588SB0104 [0,1,0,0,0,0|1,0,0]=2 431 B15R1.129 CCCCNC(=O)Cc1cccc(c1)O WXVL_AK00588SB0104 [0,1,0,0,0,0|1,0,0]=2 432 B15R1.129 CCCCNC(=O)Cc1cccc(n1)C WXVL_AK00588SA0399 [0,1,0,0,0,0|2,0,0]=3 433 B15R1.129 CCCCNC(=O)Cc1cccc(n1)C WXVL_AK00588SA0399 [0,1,0,0,0,0|2,0,0]=3 434 B15R1.129 CCCCNC(=O)Cc1cccc(n1)Cl WXVL_AK00588SA0313 [0,1,0,0,0,0|2,0,0]=3 435 B15R1.129 CCCCNC(=O)Cc1cccc(n1)Cl WXVL_AK00588SA0313 [0,1,0,0,0,0|2,0,0]=3 436 B15R1.129 CCCCNC(=O)Cc1ccnc(c1)Br WXVL_AK00588SA0520 [0,1,0,0,0,0|2,0,0]=3 437 B15R1.129 CCCCNC(=O)Cc1ccnc(c1)Br WXVL_AK00588SA0520 [0,1,0,0,0,0|2,0,0]=3 438 B15R1.129 CCCCNC(=O)Nc1cccc(c1)Br WXVL_AK00588YV0098 [0,1,0,0,0,0|2,0,0]=3 439 B15R1.129 CCCCNC(=O)Nc1cccc(c1)Br WXVL_AK00588YV0098 [0,1,0,0,0,0|2,0,0]=3 440 B15R1.129 CCCCNC(=O)Nc1cccc(c1)C WXVL_AK00588YV0020 [0,1,0,0,0,0|2,0,0]=3 441 B15R1.129 CCCCNC(=O)Nc1cccc(c1)C WXVL_AK00588YV0020 [0,1,0,0,0,0|2,0,0]=3 442 B15R1.129 CCCCNC(=O)Nc1cccc(c1)Cl WXVL_AK00588YV0016 [0,1,0,0,0,0|2,0,0]=3 443 B15R1.129 CCCCNC(=O)Nc1cccc(c1)Cl WXVL_AK00588YV0016 [0,1,0,0,0,0|2,0,0]=3 444 B15R1.129 CSCCNC(=O)Cc1cccc(c1)Br WXVL_AK00440SB0099 [0,1,0,0,0,0|2,0,0]=3 445 B15R1.129 CSCCNC(=O)Cc1cccc(c1)Br WXVL_AK00440SB0099 [0,1,0,0,0,0|2,0,0]=3 446 B15R1.129 CSCCNC(=O)Cc1cccc(c1)C WXVL_AK00440SB0105 [0,1,0,0,0,0|2,0,0]=3 447 B15R1.129 CSCCNC(=O)Cc1cccc(c1)C WXVL_AK00440SB0105 [0,1,0,0,0,0|2,0,0]=3 448 B15R1.129 CSCCNC(=O)Cc1cccc(c1)Cl WXVL_AK00440SB0101 [0,1,0,0,0,0|2,0,0]=3 449 B15R1.129 CSCCNC(=O)Cc1cccc(c1)Cl WXVL_AK00440SB0101 [0,1,0,0,0,0|2,0,0]=3 450 B15R1.129 CSCCNC(=O)Cc1cccc(c1)F WXVL_AK00440SB0100 [0,1,0,0,0,0|2,0,0]=3 451 B15R1.129 CSCCNC(=O)Cc1cccc(c1)F WXVL_AK00440SB0100 [0,1,0,0,0,0|2,0,0]=3 452 B15R1.129 CSCCNC(=O)Cc1cccc(c1)O WXVL_AK00440SB0104 [0,1,0,0,0,0|2,0,0]=3 453 B15R1.129 CSCCNC(=O)Cc1cccc(c1)O WXVL_AK00440SB0104 [0,1,0,0,0,0|2,0,0]=3 454 B15R1.129 CSCCNC(=O)Cc1cccc(n1)C WXVL_AK00440SA0399 [0,1,0,0,0,0|3,0,0]=4 455 B15R1.129 CSCCNC(=O)Cc1cccc(n1)C WXVL_AK00440SA0399 [0,1,0,0,0,0|3,0,0]=4 456 B15R1.129 CSCCNC(=O)Cc1cccc(n1)Cl WXVL_AK00440SA0313 [0,1,0,0,0,0|3,0,0]=4 457 B15R1.129 CSCCNC(=O)Cc1cccc(n1)Cl WXVL_AK00440SA0313 [0,1,0,0,0,0|3,0,0]=4 458 B15R1.129 CSCCNC(=O)Cc1ccnc(c1)Br WXVL_AK00440SA0520 [0,1,0,0,0,0|3,0,0]=4 459 B15R1.129 CSCCNC(=O)Cc1ccnc(c1)Br WXVL_AK00440SA0520 [0,1,0,0,0,0|3,0,0]=4 460 B15R1.129 CSCCNC(=O)Nc1cccc(c1)Br WXVL_AK00440YV0098 [0,1,0,0,0,0|3,0,0]=4 461 B15R1.129 CSCCNC(=O)Nc1cccc(c1)Br WXVL_AK00440YV0098 [0,1,0,0,0,0|3,0,0]=4 462 B15R1.129 CSCCNC(=O)Nc1cccc(c1)C WXVL_AK00440YV0020 [0,1,0,0,0,0|3,0,0]=4 463 B15R1.129 CSCCNC(=O)Nc1cccc(c1)C WXVL_AK00440YV0020 [0,1,0,0,0,0|3,0,0]=4 464 B15R1.129 CSCCNC(=O)Nc1cccc(c1)Cl WXVL_AK00440YV0016 [0,1,0,0,0,0|3,0,0]=4 465 B15R1.129 CSCCNC(=O)Nc1cccc(c1)Cl WXVL_AK00440YV0016 [0,1,0,0,0,0|3,0,0]=4 466 B15R1.129 Cc1cccc(c1)CC(=O)NCCC#N WXVL_AK0087SB0105 [0,1,0,0,0,0|2,0,1]=4 467 B15R1.129 Cc1cccc(c1)CC(=O)NCCC#N WXVL_AK0087SB0105 [0,1,0,0,0,0|2,0,1]=4 468 B15R1.129 Cc1cccc(c1)CC(=O)NCCCO WXVL_AK0073SB0105 [0,1,0,0,0,0|2,0,0]=3 469 B15R1.129 Cc1cccc(c1)CC(=O)NCCCO WXVL_AK0073SB0105 [0,1,0,0,0,0|2,0,0]=3 470 B15R1.129 Cc1cccc(c1)NC(=O)CCCCBr WXVL_AG0052SB3153 [0,1,0,0,0,0|3,0,0]=4 471 B15R1.129 Cc1cccc(c1)NC(=O)CCCCBr WXVL_AG0052SB3153 [0,1,0,0,0,0|3,0,0]=4 472 B15R1.129 Cc1cccc(c1)NC(=O)CCCCCl WXVL_AG0052SB0379 [0,1,0,0,0,0|3,0,0]=4 473 B15R1.129 Cc1cccc(c1)NC(=O)CCCCCl WXVL_AG0052SB0379 [0,1,0,0,0,0|3,0,0]=4 474 B15R1.129 Cc1cccc(c1)NC(=O)NCCCCl WXVL_AG0052YV0130 [0,1,0,0,0,0|3,0,0]=4 475 B15R1.129 Cc1cccc(c1)NC(=O)NCCCCl WXVL_AG0052YV0130 [0,1,0,0,0,0|3,0,0]=4 476 B15R1.129 Cc1cccc(c1)NC(=O)NCCCO WXVL_AK0073YV0020 [0,1,0,0,0,0|3,0,0]=4 477 B15R1.129 Cc1cccc(c1)NC(=O)NCCCO WXVL_AK0073YV0020 [0,1,0,0,0,0|3,0,0]=4 478 B15R1.129 Cc1cccc(n1)CC(=O)NCCCO WXVL_AK0073SA0399 [0,1,0,0,0,0|3,0,0]=4 479 B15R1.129 Cc1cccc(n1)CC(=O)NCCCO WXVL_AK0073SA0399 [0,1,0,0,0,0|3,0,0]=4 480 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)Br WXVL_AK0087SB0099 [0,1,0,0,0,0|2,0,1]=4 481 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)Br WXVL_AK0087SB0099 [0,1,0,0,0,0|2,0,1]=4 482 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)Cl WXVL_AK0087SB0101 [0,1,0,0,0,0|2,0,1]=4 483 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)Cl WXVL_AK0087SB0101 [0,1,0,0,0,0|2,0,1]=4 484 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)F WXVL_AK0087SB0100 [0,1,0,0,0,0|2,0,1]=4 485 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)F WXVL_AK0087SB0100 [0,1,0,0,0,0|2,0,1]=4 486 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)O WXVL_AK0087SB0104 [0,1,0,0,0,0|2,0,1]=4 487 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)O WXVL_AK0087SB0104 [0,1,0,0,0,0|2,0,1]=4 488 B15R1.129 O=C(CCCCBr)Nc1cccc(c1)I WXVL_AG0649SB3153 [0,1,0,0,0,0|3,0,0]=4 489 B15R1.129 O=C(CCCCBr)Nc1cccc(c1)I WXVL_AG0649SB3153 [0,1,0,0,0,0|3,0,0]=4 490 B15R1.129 O=C(CCCCBr)Nc1cccc(c1)O WXVL_AG00200SB3153 [0,1,0,0,0,0|3,0,0]=4 491 B15R1.129 O=C(CCCCBr)Nc1cccc(c1)O WXVL_AG00200SB3153 [0,1,0,0,0,0|3,0,0]=4 492 B15R1.129 O=C(CCCCCl)Nc1cccc(c1)I WXVL_AG0649SB0379 [0,1,0,0,0,0|3,0,0]=4 493 B15R1.129 O=C(CCCCCl)Nc1cccc(c1)I WXVL_AG0649SB0379 [0,1,0,0,0,0|3,0,0]=4 494 B15R1.129 O=C(CCCCCl)Nc1cccc(c1)O WXVL_AG00200SB0379 [0,1,0,0,0,0|3,0,0]=4 495 B15R1.129 O=C(CCCCCl)Nc1cccc(c1)O WXVL_AG00200SB0379 [0,1,0,0,0,0|3,0,0]=4 496 B15R1.129 O=C(Cc1cccc(c1)Br)NCCCO WXVL_AK0073SB0099 [0,1,0,0,0,0|2,0,0]=3 497 B15R1.129 O=C(Cc1cccc(c1)Br)NCCCO WXVL_AK0073SB0099 [0,1,0,0,0,0|2,0,0]=3 498 B15R1.129 O=C(Cc1cccc(c1)Cl)NCCCO WXVL_AK0073SB0101 [0,1,0,0,0,0|2,0,0]=3 499 B15R1.129 O=C(Cc1cccc(c1)Cl)NCCCO WXVL_AK0073SB0101 [0,1,0,0,0,0|2,0,0]=3 500 B15R1.129 O=C(Cc1cccc(c1)F)NCCCO WXVL_AK0073SB0100 [0,1,0,0,0,0|2,0,0]=3 501 B15R1.129 O=C(Cc1cccc(c1)F)NCCCO WXVL_AK0073SB0100 [0,1,0,0,0,0|2,0,0]=3 502 B15R1.129 O=C(Cc1cccc(c1)O)NCCCO WXVL_AK0073SB0104 [0,1,0,0,0,0|2,0,0]=3 503 B15R1.129 O=C(Cc1cccc(c1)O)NCCCO WXVL_AK0073SB0104 [0,1,0,0,0,0|2,0,0]=3 504 B15R1.129 O=C(Cc1cccc(n1)Cl)NCCCO WXVL_AK0073SA0313 [0,1,0,0,0,0|3,0,0]=4 505 B15R1.129 O=C(Cc1cccc(n1)Cl)NCCCO WXVL_AK0073SA0313 [0,1,0,0,0,0|3,0,0]=4 506 B15R1.129 O=C(Cc1ccnc(c1)Br)NCCCO WXVL_AK0073SA0520 [0,1,0,0,0,0|3,0,0]=4 507 B15R1.129 O=C(Cc1ccnc(c1)Br)NCCCO WXVL_AK0073SA0520 [0,1,0,0,0,0|3,0,0]=4 508 B15R1.129 O=C(NCCCCl)Nc1cccc(c1)I WXVL_AG0649YV0130 [0,1,0,0,0,0|3,0,0]=4 509 B15R1.129 O=C(NCCCCl)Nc1cccc(c1)I WXVL_AG0649YV0130 [0,1,0,0,0,0|3,0,0]=4 510 B15R1.129 O=C(NCCCCl)Nc1cccc(c1)O WXVL_AG00200YV0130 [0,1,0,0,0,0|3,0,0]=4 511 B15R1.129 O=C(NCCCCl)Nc1cccc(c1)O WXVL_AG00200YV0130 [0,1,0,0,0,0|3,0,0]=4 512 B15R1.129 O=C(NCCCO)Nc1cccc(c1)Br WXVL_AK0073YV0098 [0,1,0,0,0,0|3,0,0]=4 513 B15R1.129 O=C(NCCCO)Nc1cccc(c1)Br WXVL_AK0073YV0098 [0,1,0,0,0,0|3,0,0]=4 514 B15R1.129 O=C(NCCCO)Nc1cccc(c1)Cl WXVL_AK0073YV0016 [0,1,0,0,0,0|3,0,0]=4 515 B15R1.129 O=C(NCCCO)Nc1cccc(c1)Cl WXVL_AK0073YV0016 [0,1,0,0,0,0|3,0,0]=4 516 B15R1.551 C=C(Cc1ccccc1)C(=O)NCCC WXVL_AK00504SB0413 [0,1,0,0,0,0|3,0,0]=4 517 B15R1.551 C=C(Cc1ccccc1)C(=O)NCCC WXVL_AK00504SB0413 [0,1,0,0,0,0|3,0,0]=4 518 B15R1.551 CCCCC(O)C(=O)Nc1ccccc1 WXVL_AG00183SB3429 [0,1,0,0,0,0|2,0,0]=3 519 B15R1.551 CCCCC(O)C(=O)Nc1ccccc1 WXVL_AG00183SB3429 [0,1,0,0,0,0|2,0,0]=3 520 B15R1.551 CCCCC(O)C(=O)Nc1ccccn1 WXVL_AF00298SB3429 [0,1,0,0,0,0|3,0,0]=4 521 B15R1.551 CCCCC(O)C(=O)Nc1ccccn1 WXVL_AF00298SB3429 [0,1,0,0,0,0|3,0,0]=4 522 B15R1.551 COCCN(C)C(=O)Cc1ccccc1 WXVL_AN0085SB0092 [0,1,0,0,0,0|2,0,0]=3 523 B15R1.551 COCCN(C)C(=O)Cc1ccccc1 WXVL_AN0085SB0092 [0,1,0,0,0,0|2,0,0]=3 524 B15R1.551 COCCN(C)C(=O)Cc1ccccn1 WXVL_AN0085SA0032 [0,1,0,0,0,0|3,0,0]=4 525 B15R1.551 COCCN(C)C(=O)Cc1ccccn1 WXVL_AN0085SA0032 [0,1,0,0,0,0|3,0,0]=4 526 B15R1.551 COCCN(C)C(=O)Cc1cccnc1 WXVL_AN0085SA0029 [0,1,0,0,0,0|3,0,0]=4 527 B15R1.551 COCCN(C)C(=O)Cc1cccnc1 WXVL_AN0085SA0029 [0,1,0,0,0,0|3,0,0]=4 528 B15R1.551 COCCN(C)C(=O)Cc1cccnc1 WXVL_AN0085SB00049 [0,1,0,0,0,0|3,0,0]=4 529 B15R1.551 COCCN(C)C(=O)Cc1cccnc1 WXVL_AN0085SB00049 [0,1,0,0,0,0|3,0,0]=4 530 B15R1.551 COCCN(C)C(=O)Cc1ccncc1 WXVL_AN0085SA00106 [0,1,0,0,0,0|3,0,0]=4 531 B15R1.551 COCCN(C)C(=O)Cc1ccncc1 WXVL_AN0085SA00106 [0,1,0,0,0,0|3,0,0]=4 532 B15R1.809 CC(CCO)NC(=O)Cc1ccccc1 WXVL_AK1288SB0092 [0,1,0,0,0,0|2,0,0]=3 533 B15R1.809 CC(CCO)NC(=O)Cc1ccccc1 WXVL_AK1288SB0092 [0,1,0,0,0,0|2,0,0]=3 534 B15R1.809 CC(CCO)NC(=O)Cc1ccccn1 WXVL_AK1288SA0032 [0,1,0,0,0,0|3,0,0]=4 535 B15R1.809 CC(CCO)NC(=O)Cc1ccccn1 WXVL_AK1288SA0032 [0,1,0,0,0,0|3,0,0]=4 536 B15R1.809 CC(CCO)NC(=O)Cc1cccnc1 WXVL_AK1288SA0029 [0,1,0,0,0,0|3,0,0]=4 537 B15R1.809 CC(CCO)NC(=O)Cc1cccnc1 WXVL_AK1288SA0029 [0,1,0,0,0,0|3,0,0]=4 538 B15R1.809 CC(CCO)NC(=O)Cc1cccnc1 WXVL_AK1288SB00049 [0,1,0,0,0,0|3,0,0]=4 539 B15R1.809 CC(CCO)NC(=O)Cc1cccnc1 WXVL_AK1288SB00049 [0,1,0,0,0,0|3,0,0]=4 540 B15R1.809 CC(CCO)NC(=O)Cc1ccncc1 WXVL_AK1288SA00106 [0,1,0,0,0,0|3,0,0]=4 541 B15R1.809 CC(CCO)NC(=O)Cc1ccncc1 WXVL_AK1288SA00106 [0,1,0,0,0,0|3,0,0]=4 542 B15R1.809 CCC[C@H](C)NC(=O)Cc1ccccc1 WXVL_AK00682SB0092 [0,1,0,0,0,0|1,0,0]=2 543 B15R1.809 CCC[C@H](C)NC(=O)Cc1ccccc1 WXVL_AK00682SB0092 [0,1,0,0,0,0|1,0,0]=2 544 B15R1.809 CCC[C@H](C)NC(=O)Cc1ccccn1 WXVL_AK00682SA0032 [0,1,0,0,0,0|2,0,0]=3 545 B15R1.809 CCC[C@H](C)NC(=O)Cc1ccccn1 WXVL_AK00682SA0032 [0,1,0,0,0,0|2,0,0]=3 546 B15R1.809 CCC[C@H](C)NC(=O)Cc1cccnc1 WXVL_AK00682SA0029 [0,1,0,0,0,0|2,0,0]=3 547 B15R1.809 CCC[C@H](C)NC(=O)Cc1cccnc1 WXVL_AK00682SA0029 [0,1,0,0,0,0|2,0,0]=3 548 B15R1.809 CCC[C@H](C)NC(=O)Cc1cccnc1 WXVL_AK00682SB00049 [0,1,0,0,0,0|2,0,0]=3 549 B15R1.809 CCC[C@H](C)NC(=O)Cc1cccnc1 WXVL_AK00682SB00049 [0,1,0,0,0,0|2,0,0]=3 550 B15R1.809 CCC[C@H](C)NC(=O)Cc1ccncc1 WXVL_AK00682SA00106 [0,1,0,0,0,0|2,0,0]=3 551 B15R1.809 CCC[C@H](C)NC(=O)Cc1ccncc1 WXVL_AK00682SA00106 [0,1,0,0,0,0|2,0,0]=3 552 B15R1.809 CCC[C@H](C)NC(=O)Cc1cncnc1 WXVL_AK00682SA0242 [0,1,0,0,0,0|3,0,0]=4 553 B15R1.809 CCC[C@H](C)NC(=O)Cc1cncnc1 WXVL_AK00682SA0242 [0,1,0,0,0,0|3,0,0]=4 554 B15R1.809 CCC[C@H](C)NC(=O)Cc1ncccn1 WXVL_AK00682SA0307 [0,1,0,0,0,0|3,0,0]=4 555 B15R1.809 CCC[C@H](C)NC(=O)Cc1ncccn1 WXVL_AK00682SA0307 [0,1,0,0,0,0|3,0,0]=4 556 B15R1.809 CCC[C@H](C)NC(=O)Nc1ccccn1 WXVL_AK00682YV0189 [0,1,0,0,0,0|3,0,0]=4 557 B15R1.809 CCC[C@H](C)NC(=O)Nc1ccccn1 WXVL_AK00682YV0189 [0,1,0,0,0,0|3,0,0]=4 558 B15R1.809 COC[C@@H](C)NC(=O)Cc1ccccc1 WXVL_AK00613SB0092 [0,1,0,0,0,0|2,0,0]=3 559 B15R1.809 COC[C@@H](C)NC(=O)Cc1ccccc1 WXVL_AK00613SB0092 [0,1,0,0,0,0|2,0,0]=3 560 B15R1.809 COC[C@@H](C)NC(=O)Cc1ccccn1 WXVL_AK00613SA0032 [0,1,0,0,0,0|3,0,0]=4 561 B15R1.809 COC[C@@H](C)NC(=O)Cc1ccccn1 WXVL_AK00613SA0032 [0,1,0,0,0,0|3,0,0]=4 562 B15R1.809 COC[C@@H](C)NC(=O)Cc1cccnc1 WXVL_AK00613SA0029 [0,1,0,0,0,0|3,0,0]=4 563 B15R1.809 COC[C@@H](C)NC(=O)Cc1cccnc1 WXVL_AK00613SA0029 [0,1,0,0,0,0|3,0,0]=4 564 B15R1.809 COC[C@@H](C)NC(=O)Cc1cccnc1 WXVL_AK00613SB00049 [0,1,0,0,0,0|3,0,0]=4 565 B15R1.809 COC[C@@H](C)NC(=O)Cc1cccnc1 WXVL_AK00613SB00049 [0,1,0,0,0,0|3,0,0]=4 566 B15R1.809 COC[C@@H](C)NC(=O)Cc1ccncc1 WXVL_AK00613SA00106 [0,1,0,0,0,0|3,0,0]=4 567 B15R1.809 COC[C@@H](C)NC(=O)Cc1ccncc1 WXVL_AK00613SA00106 [0,1,0,0,0,0|3,0,0]=4 568 B15R1.809 COC[C@H](C)NC(=O)Cc1ccccc1 WXVL_AK0137SB0092 [0,1,0,0,0,0|2,0,0]=3 569 B15R1.809 COC[C@H](C)NC(=O)Cc1ccccc1 WXVL_AK0137SB0092 [0,1,0,0,0,0|2,0,0]=3 570 B15R1.809 COC[C@H](C)NC(=O)Cc1ccccn1 WXVL_AK0137SA0032 [0,1,0,0,0,0|3,0,0]=4 571 B15R1.809 COC[C@H](C)NC(=O)Cc1ccccn1 WXVL_AK0137SA0032 [0,1,0,0,0,0|3,0,0]=4 572 B15R1.809 COC[C@H](C)NC(=O)Cc1cccnc1 WXVL_AK0137SA0029 [0,1,0,0,0,0|3,0,0]=4 573 B15R1.809 COC[C@H](C)NC(=O)Cc1cccnc1 WXVL_AK0137SA0029 [0,1,0,0,0,0|3,0,0]=4 574 B15R1.809 COC[C@H](C)NC(=O)Cc1cccnc1 WXVL_AK0137SB00049 [0,1,0,0,0,0|3,0,0]=4 575 B15R1.809 COC[C@H](C)NC(=O)Cc1cccnc1 WXVL_AK0137SB00049 [0,1,0,0,0,0|3,0,0]=4 576 B15R1.809 COC[C@H](C)NC(=O)Cc1ccncc1 WXVL_AK0137SA00106 [0,1,0,0,0,0|3,0,0]=4 577 B15R1.809 COC[C@H](C)NC(=O)Cc1ccncc1 WXVL_AK0137SA00106 [0,1,0,0,0,0|3,0,0]=4 578 B15R1.809 C[C@@H](CC#N)NC(=O)Cc1ccccc1 WXVL_AK00595SB0092 [0,1,0,0,0,0|2,0,1]=4 579 B15R1.809 C[C@@H](CC#N)NC(=O)Cc1ccccc1 WXVL_AK00595SB0092 [0,1,0,0,0,0|2,0,1]=4 580 B15R1.964 CNC(=O)CNC(=O)Cc1ccccc1 WXVL_AK00442SB2135 [0,1,0,0,0,0|2,0,1]=4 581 B15R1.964 CNC(=O)CNC(=O)Cc1ccccc1 WXVL_AK00442SB2135 [0,1,0,0,0,0|2,0,1]=4 582 B15R1.964 CNC(=O)CNC(=O)Cc1ccccc1 WXVL_AK1222SB0092 [0,1,0,0,0,0|2,0,1]=4 583 B15R1.964 CNC(=O)CNC(=O)Cc1ccccc1 WXVL_AK1222SB0092 [0,1,0,0,0,0|2,0,1]=4 584 B15R1.964 CO[C@H](C)CNC(=O)Cc1ccccc1 WXVL_AK00704SB0092 [0,1,0,0,0,0|2,0,0]=3 585 B15R1.964 CO[C@H](C)CNC(=O)Cc1ccccc1 WXVL_AK00704SB0092 [0,1,0,0,0,0|2,0,0]=3 586 B15R1.964 CO[C@H](C)CNC(=O)Cc1ccccn1 WXVL_AK00704SA0032 [0,1,0,0,0,0|3,0,0]=4 587 B15R1.964 CO[C@H](C)CNC(=O)Cc1ccccn1 WXVL_AK00704SA0032 [0,1,0,0,0,0|3,0,0]=4 588 B15R1.964 CO[C@H](C)CNC(=O)Cc1cccnc1 WXVL_AK00704SA0029 [0,1,0,0,0,0|3,0,0]=4 589 B15R1.964 CO[C@H](C)CNC(=O)Cc1cccnc1 WXVL_AK00704SA0029 [0,1,0,0,0,0|3,0,0]=4 590 B15R1.964 CO[C@H](C)CNC(=O)Cc1cccnc1 WXVL_AK00704SB00049 [0,1,0,0,0,0|3,0,0]=4 591 B15R1.964 CO[C@H](C)CNC(=O)Cc1cccnc1 WXVL_AK00704SB00049 [0,1,0,0,0,0|3,0,0]=4 592 B15R1.964 CO[C@H](C)CNC(=O)Cc1ccncc1 WXVL_AK00704SA00106 [0,1,0,0,0,0|3,0,0]=4 593 B15R1.964 CO[C@H](C)CNC(=O)Cc1ccncc1 WXVL_AK00704SA00106 [0,1,0,0,0,0|3,0,0]=4 594 B15R1.964 O=C(Cc1ccccc1)NC[C@@H](F)CO WXVL_AK00590SB0092 [0,1,0,0,0,0|2,0,0]=3 595 B15R1.964 O=C(Cc1ccccc1)NC[C@@H](F)CO WXVL_AK00590SB0092 [0,1,0,0,0,0|2,0,0]=3 596 B15R1.964 O=C(Cc1ccccc1)NC[C@H](O)CO WXVL_AK00483SB0092 [0,1,0,0,0,0|2,0,0]=3 597 B15R1.964 O=C(Cc1ccccc1)NC[C@H](O)CO WXVL_AK00483SB0092 [0,1,0,0,0,0|2,0,0]=3 598 B15R1.964 O=C(Cc1ccccn1)NC[C@@H](F)CO WXVL_AK00590SA0032 [0,1,0,0,0,0|3,0,0]=4 599 B15R1.964 O=C(Cc1ccccn1)NC[C@@H](F)CO WXVL_AK00590SA0032 [0,1,0,0,0,0|3,0,0]=4 600 B15R1.964 O=C(Cc1ccccn1)NC[C@H](O)CO WXVL_AK00483SA0032 [0,1,0,0,0,0|3,0,0]=4 601 B15R1.964 O=C(Cc1ccccn1)NC[C@H](O)CO WXVL_AK00483SA0032 [0,1,0,0,0,0|3,0,0]=4 602 B15R1.964 O=C(Cc1cccnc1)NC[C@@H](F)CO WXVL_AK00590SA0029 [0,1,0,0,0,0|3,0,0]=4 603 B15R1.964 O=C(Cc1cccnc1)NC[C@@H](F)CO WXVL_AK00590SA0029 [0,1,0,0,0,0|3,0,0]=4 604 B15R1.964 O=C(Cc1cccnc1)NC[C@@H](F)CO WXVL_AK00590SB00049 [0,1,0,0,0,0|3,0,0]=4 605 B15R1.964 O=C(Cc1cccnc1)NC[C@@H](F)CO WXVL_AK00590SB00049 [0,1,0,0,0,0|3,0,0]=4 606 B15R1.964 O=C(Cc1cccnc1)NC[C@H](O)CO WXVL_AK00483SA0029 [0,1,0,0,0,0|3,0,0]=4 607 B15R1.964 O=C(Cc1cccnc1)NC[C@H](O)CO WXVL_AK00483SA0029 [0,1,0,0,0,0|3,0,0]=4 608 B15R1.964 O=C(Cc1cccnc1)NC[C@H](O)CO WXVL_AK00483SB00049 [0,1,0,0,0,0|3,0,0]=4 609 B15R1.964 O=C(Cc1cccnc1)NC[C@H](O)CO WXVL_AK00483SB00049 [0,1,0,0,0,0|3,0,0]=4 610 B15R1.964 O=C(Cc1ccncc1)NC[C@@H](F)CO WXVL_AK00590SA00106 [0,1,0,0,0,0|3,0,0]=4 611 B15R1.964 O=C(Cc1ccncc1)NC[C@@H](F)CO WXVL_AK00590SA00106 [0,1,0,0,0,0|3,0,0]=4 612 B15R1.964 O=C(Cc1ccncc1)NC[C@H](O)CO WXVL_AK00483SA00106 [0,1,0,0,0,0|3,0,0]=4 613 B15R1.964 O=C(Cc1ccncc1)NC[C@H](O)CO WXVL_AK00483SA00106 [0,1,0,0,0,0|3,0,0]=4 614 B15R1.1081 CC(C)CCCC(=O)Nc1ccccc1 WXVL_AG00183SB1301 [0,1,0,0,0,0|2,0,0]=3 615 B15R1.1081 CC(C)CCCC(=O)Nc1ccccc1 WXVL_AG00183SB1301 [0,1,0,0,0,0|2,0,0]=3 616 B15R1.1081 CC(C)CCCC(=O)Nc1ccccn1 WXVL_AF00298SB1301 [0,1,0,0,0,0|3,0,0]=4 617 B15R1.1081 CC(C)CCCC(=O)Nc1ccccn1 WXVL_AF00298SB1301 [0,1,0,0,0,0|3,0,0]=4 618 B15R1.1081 CC(C)CCNC(=O)Cc1ccccc1 WXVL_AK0068SB0092 [0,1,0,0,0,0|1,0,0]=2 619 B15R1.1081 CC(C)CCNC(=O)Cc1ccccc1 WXVL_AK0068SB0092 [0,1,0,0,0,0|1,0,0]=2 620 B15R1.1081 CC(C)CCNC(=O)Cc1ccccn1 WXVL_AK0068SA0032 [0,1,0,0,0,0|2,0,0]=3 621 B15R1.1081 CC(C)CCNC(=O)Cc1ccccn1 WXVL_AK0068SA0032 [0,1,0,0,0,0|2,0,0]=3 622 B15R1.1081 CC(C)CCNC(=O)Cc1cccnc1 WXVL_AK0068SA0029 [0,1,0,0,0,0|2,0,0]=3 623 B15R1.1081 CC(C)CCNC(=O)Cc1cccnc1 WXVL_AK0068SA0029 [0,1,0,0,0,0|2,0,0]=3 624 B15R1.1081 CC(C)CCNC(=O)Cc1cccnc1 WXVL_AK0068SB00049 [0,1,0,0,0,0|2,0,0]=3 625 B15R1.1081 CC(C)CCNC(=O)Cc1cccnc1 WXVL_AK0068SB00049 [0,1,0,0,0,0|2,0,0]=3 626 B15R1.1081 CC(C)CCNC(=O)Cc1ccncc1 WXVL_AK0068SA00106 [0,1,0,0,0,0|2,0,0]=3 627 B15R1.1081 CC(C)CCNC(=O)Cc1ccncc1 WXVL_AK0068SA00106 [0,1,0,0,0,0|2,0,0]=3 628 B15R1.1081 CC(C)CCNC(=O)Cc1cncnc1 WXVL_AK0068SA0242 [0,1,0,0,0,0|3,0,0]=4 629 B15R1.1081 CC(C)CCNC(=O)Cc1cncnc1 WXVL_AK0068SA0242 [0,1,0,0,0,0|3,0,0]=4 630 B15R1.1081 CC(C)CCNC(=O)Cc1ncccn1 WXVL_AK0068SA0307 [0,1,0,0,0,0|3,0,0]=4 631 B15R1.1081 CC(C)CCNC(=O)Cc1ncccn1 WXVL_AK0068SA0307 [0,1,0,0,0,0|3,0,0]=4 632 B15R1.1081 CC(C)CCNC(=O)Nc1ccccn1 WXVL_AK0068YV0189 [0,1,0,0,0,0|3,0,0]=4 633 B15R1.1081 CC(C)CCNC(=O)Nc1ccccn1 WXVL_AK0068YV0189 [0,1,0,0,0,0|3,0,0]=4 634 B15R1.1081 CN(C)CCCC(=O)Nc1ccccc1 WXVL_AG00183SB00055 [0,1,0,0,0,0|3,0,0]=4 635 B15R1.1081 CN(C)CCCC(=O)Nc1ccccc1 WXVL_AG00183SB00055 [0,1,0,0,0,0|3,0,0]=4 636 B15R1.1081 CN(C)CCNC(=O)Cc1ccccc1 WXVL_AK0058SB0092 [0,1,0,0,0,0|2,0,0]=3 637 B15R1.1081 CN(C)CCNC(=O)Cc1ccccc1 WXVL_AK0058SB0092 [0,1,0,0,0,0|2,0,0]=3 638 B15R1.1081 CN(C)CCNC(=O)Cc1ccccn1 WXVL_AK0058SA0032 [0,1,0,0,0,0|3,0,0]=4 639 B15R1.1081 CN(C)CCNC(=O)Cc1ccccn1 WXVL_AK0058SA0032 [0,1,0,0,0,0|3,0,0]=4 640 B15R1.1081 CN(C)CCNC(=O)Cc1cccnc1 WXVL_AK0058SA0029 [0,1,0,0,0,0|3,0,0]=4 641 B15R1.1081 CN(C)CCNC(=O)Cc1cccnc1 WXVL_AK0058SA0029 [0,1,0,0,0,0|3,0,0]=4 642 B15R1.1081 CN(C)CCNC(=O)Cc1cccnc1 WXVL_AK0058SB00049 [0,1,0,0,0,0|3,0,0]=4 643 B15R1.1081 CN(C)CCNC(=O)Cc1cccnc1 WXVL_AK0058SB00049 [0,1,0,0,0,0|3,0,0]=4 644 B15R1.1081 CN(C)CCNC(=O)Cc1ccncc1 WXVL_AK0058SA00106 [0,1,0,0,0,0|3,0,0]=4 645 B15R1.1081 CN(C)CCNC(=O)Cc1ccncc1 WXVL_AK0058SA00106 [0,1,0,0,0,0|3,0,0]=4 646 B15R1.1081 NC(=O)CCNC(=O)Cc1ccccc1 WXVL_AK00443SB0092 [0,1,0,0,0,0|2,0,1]=4 647 B15R1.1081 NC(=O)CCNC(=O)Cc1ccccc1 WXVL_AK00443SB0092 [0,1,0,0,0,0|2,0,1]=4 648 B15R1.1409 C#CCCNC(=O)Cc1ccccc1Br WXVL_AK3109SB0093 [0,1,0,0,0,0|1,0,2]=4 649 B15R1.1409 C#CCCNC(=O)Cc1ccccc1Br WXVL_AK3109SB0093 [0,1,0,0,0,0|1,0,2]=4 650 B15R1.1409 C#CCCNC(=O)Cc1ccccc1C WXVL_AK3109SB0098 [0,1,0,0,0,0|1,0,2]=4 651 B15R1.1409 C#CCCNC(=O)Cc1ccccc1C WXVL_AK3109SB0098 [0,1,0,0,0,0|1,0,2]=4 652 B15R1.1409 C#CCCNC(=O)Cc1ccccc1Cl WXVL_AK3109SB0095 [0,1,0,0,0,0|1,0,2]=4 653 B15R1.1409 C#CCCNC(=O)Cc1ccccc1Cl WXVL_AK3109SB0095 [0,1,0,0,0,0|1,0,2]=4 654 B15R1.1409 C#CCCNC(=O)Cc1ccccc1F WXVL_AK3109SB0094 [0,1,0,0,0,0|1,0,2]=4 655 B15R1.1409 C#CCCNC(=O)Cc1ccccc1F WXVL_AK3109SB0094 [0,1,0,0,0,0|1,0,2]=4 656 B15R1.1409 C#CCCNC(=O)Cc1ccccc1I WXVL_AK3109SB1145 [0,1,0,0,0,0|1,0,2]=4 657 B15R1.1409 C#CCCNC(=O)Cc1ccccc1I WXVL_AK3109SB1145 [0,1,0,0,0,0|1,0,2]=4 658 B15R1.1409 C#CCCNC(=O)Cc1ccccc1O WXVL_AK3109SB0400 [0,1,0,0,0,0|1,0,2]=4 659 B15R1.1409 C#CCCNC(=O)Cc1ccccc1O WXVL_AK3109SB0400 [0,1,0,0,0,0|1,0,2]=4 660 B15R1.1409 C=CCCNC(=O)Cc1ccccc1Br WXVL_AK00138SB0093 [0,1,0,0,0,0|1,0,2]=4 661 B15R1.1409 C=CCCNC(=O)Cc1ccccc1Br WXVL_AK00138SB0093 [0,1,0,0,0,0|1,0,2]=4 662 B15R1.1409 C=CCCNC(=O)Cc1ccccc1C WXVL_AK00138SB0098 [0,1,0,0,0,0|1,0,2]=4 663 B15R1.1409 C=CCCNC(=O)Cc1ccccc1C WXVL_AK00138SB0098 [0,1,0,0,0,0|1,0,2]=4 664 B15R1.1409 C=CCCNC(=O)Cc1ccccc1Cl WXVL_AK00138SB0095 [0,1,0,0,0,0|1,0,2]=4 665 B15R1.1409 C=CCCNC(=O)Cc1ccccc1Cl WXVL_AK00138SB0095 [0,1,0,0,0,0|1,0,2]=4 666 B15R1.1409 C=CCCNC(=O)Cc1ccccc1F WXVL_AK00138SB0094 [0,1,0,0,0,0|1,0,2]=4 667 B15R1.1409 C=CCCNC(=O)Cc1ccccc1F WXVL_AK00138SB0094 [0,1,0,0,0,0|1,0,2]=4 668 B15R1.1409 C=CCCNC(=O)Cc1ccccc1I WXVL_AK00138SB1145 [0,1,0,0,0,0|1,0,2]=4 669 B15R1.1409 C=CCCNC(=O)Cc1ccccc1I WXVL_AK00138SB1145 [0,1,0,0,0,0|1,0,2]=4 670 B15R1.1409 C=CCCNC(=O)Cc1ccccc1O WXVL_AK00138SB0400 [0,1,0,0,0,0|1,0,2]=4 671 B15R1.1409 C=CCCNC(=O)Cc1ccccc1O WXVL_AK00138SB0400 [0,1,0,0,0,0|1,0,2]=4 672 B15R1.1409 CCCCNC(=O)Cc1ccccc1Br WXVL_AK00588SB0093 [0,1,0,0,0,0|1,0,0]=2 673 B15R1.1409 CCCCNC(=O)Cc1ccccc1Br WXVL_AK00588SB0093 [0,1,0,0,0,0|1,0,0]=2 674 B15R1.1409 CCCCNC(=O)Cc1ccccc1C WXVL_AK00588SB0098 [0,1,0,0,0,0|1,0,0]=2 675 B15R1.1409 CCCCNC(=O)Cc1ccccc1C WXVL_AK00588SB0098 [0,1,0,0,0,0|1,0,0]=2 676 B15R1.1409 CCCCNC(=O)Cc1ccccc1Cl WXVL_AK00588SB0095 [0,1,0,0,0,0|1,0,0]=2 677 B15R1.1409 CCCCNC(=O)Cc1ccccc1Cl WXVL_AK00588SB0095 [0,1,0,0,0,0|1,0,0]=2 678 B15R1.1409 CCCCNC(=O)Cc1ccccc1F WXVL_AK00588SB0094 [0,1,0,0,0,0|1,0,0]=2 679 B15R1.1409 CCCCNC(=O)Cc1ccccc1F WXVL_AK00588SB0094 [0,1,0,0,0,0|1,0,0]=2 680 B15R1.1409 CCCCNC(=O)Cc1ccccc1I WXVL_AK00588SB1145 [0,1,0,0,0,0|1,0,0]=2 681 B15R1.1409 CCCCNC(=O)Cc1ccccc1I WXVL_AK00588SB1145 [0,1,0,0,0,0|1,0,0]=2 682 B15R1.1409 CCCCNC(=O)Cc1ccccc1O WXVL_AK00588SB0400 [0,1,0,0,0,0|1,0,0]=2 683 B15R1.1409 CCCCNC(=O)Cc1ccccc1O WXVL_AK00588SB0400 [0,1,0,0,0,0|1,0,0]=2 684 B15R1.1409 CCCCNC(=O)Cc1cccnc1Cl WXVL_AK00588SA0056 [0,1,0,0,0,0|2,0,0]=3 685 B15R1.1409 CCCCNC(=O)Cc1cccnc1Cl WXVL_AK00588SA0056 [0,1,0,0,0,0|2,0,0]=3 686 B15R1.1409 CCCCNC(=O)Nc1ccccc1Br WXVL_AK00588YV0003 [0,1,0,0,0,0|2,0,0]=3 687 B15R1.1409 CCCCNC(=O)Nc1ccccc1Br WXVL_AK00588YV0003 [0,1,0,0,0,0|2,0,0]=3 688 B15R1.1409 CCCCNC(=O)Nc1ccccc1C WXVL_AK00588YV0013 [0,1,0,0,0,0|2,0,0]=3 689 B15R1.1409 CCCCNC(=O)Nc1ccccc1C WXVL_AK00588YV0013 [0,1,0,0,0,0|2,0,0]=3 690 B15R1.1409 CCCCNC(=O)Nc1ccccc1Cl WXVL_AK00588YV0007 [0,1,0,0,0,0|2,0,0]=3 691 B15R1.1409 CCCCNC(=O)Nc1ccccc1Cl WXVL_AK00588YV0007 [0,1,0,0,0,0|2,0,0]=3 692 B15R1.1409 CSCCNC(=O)Cc1ccccc1Br WXVL_AK00440SB0093 [0,1,0,0,0,0|2,0,0]=3 693 B15R1.1409 CSCCNC(=O)Cc1ccccc1Br WXVL_AK00440SB0093 [0,1,0,0,0,0|2,0,0]=3 694 B15R1.1409 CSCCNC(=O)Cc1ccccc1C WXVL_AK00440SB0098 [0,1,0,0,0,0|2,0,0]=3 695 B15R1.1409 CSCCNC(=O)Cc1ccccc1C WXVL_AK00440SB0098 [0,1,0,0,0,0|2,0,0]=3 696 B15R1.1409 CSCCNC(=O)Cc1ccccc1Cl WXVL_AK00440SB0095 [0,1,0,0,0,0|2,0,0]=3 697 B15R1.1409 CSCCNC(=O)Cc1ccccc1Cl WXVL_AK00440SB0095 [0,1,0,0,0,0|2,0,0]=3 698 B15R1.1409 CSCCNC(=O)Cc1ccccc1F WXVL_AK00440SB0094 [0,1,0,0,0,0|2,0,0]=3 699 B15R1.1409 CSCCNC(=O)Cc1ccccc1F WXVL_AK00440SB0094 [0,1,0,0,0,0|2,0,0]=3 700 B15R1.1409 CSCCNC(=O)Cc1ccccc1I WXVL_AK00440SB1145 [0,1,0,0,0,0|2,0,0]=3 701 B15R1.1409 CSCCNC(=O)Cc1ccccc1I WXVL_AK00440SB1145 [0,1,0,0,0,0|2,0,0]=3 702 B15R1.1409 CSCCNC(=O)Cc1ccccc1O WXVL_AK00440SB0400 [0,1,0,0,0,0|2,0,0]=3 703 B15R1.1409 CSCCNC(=O)Cc1ccccc1O WXVL_AK00440SB0400 [0,1,0,0,0,0|2,0,0]=3 704 B15R1.1409 CSCCNC(=O)Cc1cccnc1Cl WXVL_AK00440SA0056 [0,1,0,0,0,0|3,0,0]=4 705 B15R1.1409 CSCCNC(=O)Cc1cccnc1Cl WXVL_AK00440SA0056 [0,1,0,0,0,0|3,0,0]=4 706 B15R1.1409 CSCCNC(=O)Nc1ccccc1Br WXVL_AK00440YV0003 [0,1,0,0,0,0|3,0,0]=4 707 B15R1.1409 CSCCNC(=O)Nc1ccccc1Br WXVL_AK00440YV0003 [0,1,0,0,0,0|3,0,0]=4 708 B15R1.1409 CSCCNC(=O)Nc1ccccc1C WXVL_AK00440YV0013 [0,1,0,0,0,0|3,0,0]=4 709 B15R1.1409 CSCCNC(=O)Nc1ccccc1C WXVL_AK00440YV0013 [0,1,0,0,0,0|3,0,0]=4 710 B15R1.1409 CSCCNC(=O)Nc1ccccc1Cl WXVL_AK00440YV0007 [0,1,0,0,0,0|3,0,0]=4 711 B15R1.1409 CSCCNC(=O)Nc1ccccc1Cl WXVL_AK00440YV0007 [0,1,0,0,0,0|3,0,0]=4 712 B15R1.1409 Cc1ccccc1CC(=O)NCCC#N WXVL_AK0087SB0098 [0,1,0,0,0,0|2,0,1]=4 713 B15R1.1409 Cc1ccccc1CC(=O)NCCC#N WXVL_AK0087SB0098 [0,1,0,0,0,0|2,0,1]=4 714 B15R1.1409 Cc1ccccc1CC(=O)NCCCO WXVL_AK0073SB0098 [0,1,0,0,0,0|2,0,0]=3 715 B15R1.1409 Cc1ccccc1CC(=O)NCCCO WXVL_AK0073SB0098 [0,1,0,0,0,0|2,0,0]=3 716 B15R1.1409 Cc1ccccc1NC(=O)CCCCBr WXVL_AG0027SB3153 [0,1,0,0,0,0|3,0,0]=4 717 B15R1.1409 Cc1ccccc1NC(=O)CCCCBr WXVL_AG0027SB3153 [0,1,0,0,0,0|3,0,0]=4 718 B15R1.1409 Cc1ccccc1NC(=O)CCCCCl WXVL_AG0027SB0379 [0,1,0,0,0,0|3,0,0]=4 719 B15R1.1409 Cc1ccccc1NC(=O)CCCCCl WXVL_AG0027SB0379 [0,1,0,0,0,0|3,0,0]=4 720 B15R1.1409 Cc1ccccc1NC(=O)NCCCCl WXVL_AG0027YV0130 [0,1,0,0,0,0|3,0,0]=4 721 B15R1.1409 Cc1ccccc1NC(=O)NCCCCl WXVL_AG0027YV0130 [0,1,0,0,0,0|3,0,0]=4 722 B15R1.1409 Cc1ccccc1NC(=O)NCCCO WXVL_AK0073YV0013 [0,1,0,0,0,0|3,0,0]=4 723 B15R1.1409 Cc1ccccc1NC(=O)NCCCO WXVL_AK0073YV0013 [0,1,0,0,0,0|3,0,0]=4 724 B15R1.1409 N#CCCNC(=O)Cc1ccccc1Br WXVL_AK0087SB0093 [0,1,0,0,0,0|2,0,1]=4 725 B15R1.1409 N#CCCNC(=O)Cc1ccccc1Br WXVL_AK0087SB0093 [0,1,0,0,0,0|2,0,1]=4 726 B15R1.1409 N#CCCNC(=O)Cc1ccccc1Cl WXVL_AK0087SB0095 [0,1,0,0,0,0|2,0,1]=4 727 B15R1.1409 N#CCCNC(=O)Cc1ccccc1Cl WXVL_AK0087SB0095 [0,1,0,0,0,0|2,0,1]=4 728 B15R1.1409 N#CCCNC(=O)Cc1ccccc1F WXVL_AK0087SB0094 [0,1,0,0,0,0|2,0,1]=4 729 B15R1.1409 N#CCCNC(=O)Cc1ccccc1F WXVL_AK0087SB0094 [0,1,0,0,0,0|2,0,1]=4 730 B15R1.1409 N#CCCNC(=O)Cc1ccccc1I WXVL_AK0087SB1145 [0,1,0,0,0,0|2,0,1]=4 731 B15R1.1409 N#CCCNC(=O)Cc1ccccc1I WXVL_AK0087SB1145 [0,1,0,0,0,0|2,0,1]=4 732 B15R1.1409 N#CCCNC(=O)Cc1ccccc1O WXVL_AK0087SB0400 [0,1,0,0,0,0|2,0,1]=4 733 B15R1.1409 N#CCCNC(=O)Cc1ccccc1O WXVL_AK0087SB0400 [0,1,0,0,0,0|2,0,1]=4 734 B15R1.1409 O=C(CCCCBr)Nc1ccccc1Br WXVL_AG00180SB3153 [0,1,0,0,0,0|3,0,0]=4 735 B15R1.1409 O=C(CCCCBr)Nc1ccccc1Br WXVL_AG00180SB3153 [0,1,0,0,0,0|3,0,0]=4 736 B15R1.1409 O=C(CCCCBr)Nc1ccccc1Cl WXVL_AG00129SB3153 [0,1,0,0,0,0|3,0,0]=4 737 B15R1.1409 O=C(CCCCBr)Nc1ccccc1Cl WXVL_AG00129SB3153 [0,1,0,0,0,0|3,0,0]=4 738 B15R1.1409 O=C(CCCCBr)Nc1ccccc1I WXVL_AG0385SB3153 [0,1,0,0,0,0|3,0,0]=4 739 B15R1.1409 O=C(CCCCBr)Nc1ccccc1I WXVL_AG0385SB3153 [0,1,0,0,0,0|3,0,0]=4 740 B15R1.1409 O=C(CCCCCl)Nc1ccccc1Br WXVL_AG00180SB0379 [0,1,0,0,0,0|3,0,0]=4 741 B15R1.1409 O=C(CCCCCl)Nc1ccccc1Br WXVL_AG00180SB0379 [0,1,0,0,0,0|3,0,0]=4 742 B15R1.1409 O=C(CCCCCl)Nc1ccccc1Cl WXVL_AG00129SB0379 [0,1,0,0,0,0|3,0,0]=4 743 B15R1.1409 O=C(CCCCCl)Nc1ccccc1Cl WXVL_AG00129SB0379 [0,1,0,0,0,0|3,0,0]=4 744 B15R1.1409 O=C(CCCCCl)Nc1ccccc1I WXVL_AG0385SB0379 [0,1,0,0,0,0|3,0,0]=4 745 B15R1.1409 O=C(CCCCCl)Nc1ccccc1I WXVL_AG0385SB0379 [0,1,0,0,0,0|3,0,0]=4 746 B15R1.1409 O=C(Cc1ccccc1Br)NCCCO WXVL_AK0073SB0093 [0,1,0,0,0,0|2,0,0]=3 747 B15R1.1409 O=C(Cc1ccccc1Br)NCCCO WXVL_AK0073SB0093 [0,1,0,0,0,0|2,0,0]=3 748 B15R1.1409 O=C(Cc1ccccc1Cl)NCCCO WXVL_AK0073SB0095 [0,1,0,0,0,0|2,0,0]=3 749 B15R1.1409 O=C(Cc1ccccc1Cl)NCCCO WXVL_AK0073SB0095 [0,1,0,0,0,0|2,0,0]=3 750 B15R1.1409 O=C(Cc1ccccc1F)NCCCO WXVL_AK0073SB0094 [0,1,0,0,0,0|2,0,0]=3 751 B15R1.1409 O=C(Cc1ccccc1F)NCCCO WXVL_AK0073SB0094 [0,1,0,0,0,0|2,0,0]=3 752 B15R1.1409 O=C(Cc1ccccc1I)NCCCO WXVL_AK0073SB1145 [0,1,0,0,0,0|2,0,0]=3 753 B15R1.1409 O=C(Cc1ccccc1I)NCCCO WXVL_AK0073SB1145 [0,1,0,0,0,0|2,0,0]=3 754 B15R1.1409 O=C(Cc1ccccc1O)NCCCO WXVL_AK0073SB0400 [0,1,0,0,0,0|2,0,0]=3 755 B15R1.1409 O=C(Cc1ccccc1O)NCCCO WXVL_AK0073SB0400 [0,1,0,0,0,0|2,0,0]=3 756 B15R1.1409 O=C(Cc1cccnc1Cl)NCCCO WXVL_AK0073SA0056 [0,1,0,0,0,0|3,0,0]=4 757 B15R1.1409 O=C(Cc1cccnc1Cl)NCCCO WXVL_AK0073SA0056 [0,1,0,0,0,0|3,0,0]=4 758 B15R1.1409 O=C(NCCCCl)Nc1ccccc1Br WXVL_AG00180YV0130 [0,1,0,0,0,0|3,0,0]=4 759 B15R1.1409 O=C(NCCCCl)Nc1ccccc1Br WXVL_AG00180YV0130 [0,1,0,0,0,0|3,0,0]=4 760 B15R1.1409 O=C(NCCCCl)Nc1ccccc1Cl WXVL_AG00129YV0130 [0,1,0,0,0,0|3,0,0]=4 761 B15R1.1409 O=C(NCCCCl)Nc1ccccc1Cl WXVL_AG00129YV0130 [0,1,0,0,0,0|3,0,0]=4 762 B15R1.1409 O=C(NCCCCl)Nc1ccccc1I WXVL_AG0385YV0130 [0,1,0,0,0,0|3,0,0]=4 763 B15R1.1409 O=C(NCCCCl)Nc1ccccc1I WXVL_AG0385YV0130 [0,1,0,0,0,0|3,0,0]=4 764 B15R1.1409 O=C(NCCCO)Nc1ccccc1Br WXVL_AK0073YV0003 [0,1,0,0,0,0|3,0,0]=4 765 B15R1.1409 O=C(NCCCO)Nc1ccccc1Br WXVL_AK0073YV0003 [0,1,0,0,0,0|3,0,0]=4 766 B15R1.1409 O=C(NCCCO)Nc1ccccc1Cl WXVL_AK0073YV0007 [0,1,0,0,0,0|3,0,0]=4 767 B15R1.1409 O=C(NCCCO)Nc1ccccc1Cl WXVL_AK0073YV0007 [0,1,0,0,0,0|3,0,0]=4 768 B15R1.2074 CCCCNS(=O)(=O)Cc1ccccc1 WXVL_AK00588HU0025 [0,1,0,0,0,0|2,0,0]=3 769 B15R1.2074 CCCCNS(=O)(=O)Cc1ccccc1 WXVL_AK00588HU0025 [0,1,0,0,0,0|2,0,0]=3 770 B15R1.2074 CSCCNS(=O)(=O)Cc1ccccc1 WXVL_AK00440HU0025 [0,1,0,0,0,0|3,0,0]=4 771 B15R1.2074 CSCCNS(=O)(=O)Cc1ccccc1 WXVL_AK00440HU0025 [0,1,0,0,0,0|3,0,0]=4 772 B15R1.2074 O=S(=O)(Cc1ccccc1)NCCCO WXVL_AK0073HU0025 [0,1,0,0,0,0|3,0,0]=4 773 B15R1.2074 O=S(=O)(Cc1ccccc1)NCCCO WXVL_AK0073HU0025 [0,1,0,0,0,0|3,0,0]=4 774 B15R2.64 O=C(Cc1ccccc1)N2CCCC2 WXVL_AN0008SB0092 [0,0,0,1,0,0|1,0,0]=2 775 B15R2.64 O=C(Cc1ccccc1)N2CCCC2 WXVL_AN0008SB0092 [0,0,0,1,0,0|1,0,0]=2 776 B15R2.64 O=C(Cc1ccccn1)N2CCCC2 WXVL_AN0008SA0032 [0,0,0,1,0,0|2,0,0]=3 777 B15R2.64 O=C(Cc1ccccn1)N2CCCC2 WXVL_AN0008SA0032 [0,0,0,1,0,0|2,0,0]=3 778 B15R2.64 O=C(Cc1cccnc1)N2CCCC2 WXVL_AN0008SA0029 [0,0,0,1,0,0|2,0,0]=3 779 B15R2.64 O=C(Cc1cccnc1)N2CCCC2 WXVL_AN0008SA0029 [0,0,0,1,0,0|2,0,0]=3 780 B15R2.64 O=C(Cc1cccnc1)N2CCCC2 WXVL_AN0008SB00049 [0,0,0,1,0,0|2,0,0]=3 781 B15R2.64 O=C(Cc1cccnc1)N2CCCC2 WXVL_AN0008SB00049 [0,0,0,1,0,0|2,0,0]=3 782 B15R2.64 O=C(Cc1ccncc1)N2CCCC2 WXVL_AN0008SA00106 [0,0,0,1,0,0|2,0,0]=3 783 B15R2.64 O=C(Cc1ccncc1)N2CCCC2 WXVL_AN0008SA00106 [0,0,0,1,0,0|2,0,0]=3 784 B15R2.64 O=C(Cc1cncnc1)N2CCCC2 WXVL_AN0008SA0242 [0,0,0,1,0,0|3,0,0]=4 785 B15R2.64 O=C(Cc1cncnc1)N2CCCC2 WXVL_AN0008SA0242 [0,0,0,1,0,0|3,0,0]=4 786 B15R2.64 O=C(Cc1ncccn1)N2CCCC2 WXVL_AN0008SA0307 [0,0,0,1,0,0|3,0,0]=4 787 B15R2.64 O=C(Cc1ncccn1)N2CCCC2 WXVL_AN0008SA0307 [0,0,0,1,0,0|3,0,0]=4 788 B15R2.64 O=C(Nc1ccccc1)C2CCCC2 WXVL_AG00183SB0043 [0,0,0,1,0,0|2,0,0]=3 789 B15R2.64 O=C(Nc1ccccc1)C2CCCC2 WXVL_AG00183SB0043 [0,0,0,1,0,0|2,0,0]=3 790 B15R2.64 O=C(Nc1ccccc1)C2CCCO2 WXVL_AG00183SB1033 [0,0,0,1,0,0|3,0,0]=4 791 B15R2.64 O=C(Nc1ccccc1)C2CCCO2 WXVL_AG00183SB1033 [0,0,0,1,0,0|3,0,0]=4 792 B15R2.64 O=C(Nc1ccccc1)C2CCCS2 WXVL_AG00183SB0022 [0,0,0,1,0,0|3,0,0]=4 793 B15R2.64 O=C(Nc1ccccc1)C2CCCS2 WXVL_AG00183SB0022 [0,0,0,1,0,0|3,0,0]=4 794 B15R2.64 O=C(Nc1ccccc1)[C@H]2CCCO2 WXVL_AG00183SB00043 [0,0,0,1,0,0|3,0,0]=4 795 B15R2.64 O=C(Nc1ccccc1)[C@H]2CCCO2 WXVL_AG00183SB00043 [0,0,0,1,0,0|3,0,0]=4 796 B15R2.64 O=C(Nc1ccccn1)C2CCCC2 WXVL_AF00298SB0043 [0,0,0,1,0,0|3,0,0]=4 797 B15R2.64 O=C(Nc1ccccn1)C2CCCC2 WXVL_AF00298SB0043 [0,0,0,1,0,0|3,0,0]=4 798 B15R2.64 O=C(Nc1ccccn1)N2CCCC2 WXVL_AN0008YV0189 [0,0,0,1,0,0|3,0,0]=4 799 B15R2.64 O=C(Nc1ccccn1)N2CCCC2 WXVL_AN0008YV0189 [0,0,0,1,0,0|3,0,0]=4 800 B15R2.1256 O=C(C=CC1CC1)Nc2ccccc2 WXVL_AG00183SB4216 [0,0,0,1,0,0|2,0,1]=4 801 B15R2.1256 O=C(C=CC1CC1)Nc2ccccc2 WXVL_AG00183SB4216 [0,0,0,1,0,0|2,0,1]=4 802 B15R2.1256 O=C(CCC1CC1)Nc2ccccc2 WXVL_AG00183SB5360 [0,0,0,1,0,0|2,0,0]=3 803 B15R2.1256 O=C(CCC1CC1)Nc2ccccc2 WXVL_AG00183SB5360 [0,0,0,1,0,0|2,0,0]=3 804 B15R2.1256 O=C(CCC1CC1)Nc2ccccn2 WXVL_AF00298SB5360 [0,0,0,1,0,0|3,0,0]=4 805 B15R2.1256 O=C(CCC1CC1)Nc2ccccn2 WXVL_AF00298SB5360 [0,0,0,1,0,0|3,0,0]=4 806 B15R2.16446 O=C(CC1CCC1)Nc2ccccc2 WXVL_AG00183SB2207 [0,0,0,1,0,0|2,0,0]=3 807 B15R2.16446 O=C(CC1CCC1)Nc2ccccc2 WXVL_AG00183SB2207 [0,0,0,1,0,0|2,0,0]=3 808 B15R2.16446 O=C(CC1CCC1)Nc2ccccn2 WXVL_AF00298SB2207 [0,0,0,1,0,0|3,0,0]=4 809 B15R2.16446 O=C(CC1CCC1)Nc2ccccn2 WXVL_AF00298SB2207 [0,0,0,1,0,0|3,0,0]=4 810 B15R2.16446 O=C(Cc1ccccc1)NC2CNC2 WXVL_AK1291SB0092 [0,0,0,1,0,0|2,0,0]=3 811 B15R2.16446 O=C(Cc1ccccc1)NC2CNC2 WXVL_AK1291SB0092 [0,0,0,1,0,0|2,0,0]=3 812 B15R2.16446 O=C(Cc1ccccc1)NC2CSC2 WXVL_AK2089SB0092 [0,0,0,1,0,0|2,0,0]=3 813 B15R2.16446 O=C(Cc1ccccc1)NC2CSC2 WXVL_AK2089SB0092 [0,0,0,1,0,0|2,0,0]=3 814 B15R2.16446 O=C(Cc1ccccn1)NC2CNC2 WXVL_AK1291SA0032 [0,0,0,1,0,0|3,0,0]=4 815 B15R2.16446 O=C(Cc1ccccn1)NC2CNC2 WXVL_AK1291SA0032 [0,0,0,1,0,0|3,0,0]=4 816 B15R2.16446 O=C(Cc1ccccn1)NC2CSC2 WXVL_AK2089SA0032 [0,0,0,1,0,0|3,0,0]=4 817 B15R2.16446 O=C(Cc1ccccn1)NC2CSC2 WXVL_AK2089SA0032 [0,0,0,1,0,0|3,0,0]=4 818 B15R2.16446 O=C(Cc1cccnc1)NC2CNC2 WXVL_AK1291SA0029 [0,0,0,1,0,0|3,0,0]=4 819 B15R2.16446 O=C(Cc1cccnc1)NC2CNC2 WXVL_AK1291SA0029 [0,0,0,1,0,0|3,0,0]=4 820 B15R2.16446 O=C(Cc1cccnc1)NC2CNC2 WXVL_AK1291SB00049 [0,0,0,1,0,0|3,0,0]=4 821 B15R2.16446 O=C(Cc1cccnc1)NC2CNC2 WXVL_AK1291SB00049 [0,0,0,1,0,0|3,0,0]=4 822 B15R2.16446 O=C(Cc1cccnc1)NC2CSC2 WXVL_AK2089SA0029 [0,0,0,1,0,0|3,0,0]=4 823 B15R2.16446 O=C(Cc1cccnc1)NC2CSC2 WXVL_AK2089SA0029 [0,0,0,1,0,0|3,0,0]=4 824 B15R2.16446 O=C(Cc1cccnc1)NC2CSC2 WXVL_AK2089SB00049 [0,0,0,1,0,0|3,0,0]=4 825 B15R2.16446 O=C(Cc1cccnc1)NC2CSC2 WXVL_AK2089SB00049 [0,0,0,1,0,0|3,0,0]=4 826 B15R2.16446 O=C(Cc1ccncc1)NC2CNC2 WXVL_AK1291SA00106 [0,0,0,1,0,0|3,0,0]=4 827 B15R2.16446 O=C(Cc1ccncc1)NC2CNC2 WXVL_AK1291SA00106 [0,0,0,1,0,0|3,0,0]=4 828 B15R2.16446 O=C(Cc1ccncc1)NC2CSC2 WXVL_AK2089SA00106 [0,0,0,1,0,0|3,0,0]=4 829 B15R2.16446 O=C(Cc1ccncc1)NC2CSC2 WXVL_AK2089SA00106 [0,0,0,1,0,0|3,0,0]=4 830 B13R1.24 C#CCCNC(=O)c1ccccc1 WXVL_AK3109SD0001 [0,0,0,0,1,0|1,0,2]=4 831 B13R1.24 C#CCCNC(=O)c1ccccc1 WXVL_AK3109SD0001 [0,0,0,0,1,0|1,0,2]=4 832 B13R1.24 C=CCCNC(=O)c1ccccc1 WXVL_AK00138SD0001 [0,0,0,0,1,0|1,0,2]=4 833 B13R1.24 C=CCCNC(=O)c1ccccc1 WXVL_AK00138SD0001 [0,0,0,0,1,0|1,0,2]=4 834 B13R1.24 CCCCNC(=O)c1ccccc1 WXVL_AK00588SD0001 [0,0,0,0,1,0|1,0,0]=2 835 B13R1.24 CCCCNC(=O)c1ccccc1 WXVL_AK00588SD0001 [0,0,0,0,1,0|1,0,0]=2 836 B13R1.24 CCCCNC(=O)c1ccccn1 WXVL_AK00588SC0058 [0,0,0,0,1,0|2,0,0]=3 837 B13R1.24 CCCCNC(=O)c1ccccn1 WXVL_AK00588SC0058 [0,0,0,0,1,0|2,0,0]=3 838 B13R1.24 CCCCNC(=O)c1cccnc1 WXVL_AK00588SC0061 [0,0,0,0,1,0|2,0,0]=3 839 B13R1.24 CCCCNC(=O)c1cccnc1 WXVL_AK00588SC0061 [0,0,0,0,1,0|2,0,0]=3 840 B13R1.24 CCCCNC(=O)c1cccnn1 WXVL_AK00588SC0374 [0,0,0,0,1,0|3,0,0]=4 841 B13R1.24 CCCCNC(=O)c1cccnn1 WXVL_AK00588SC0374 [0,0,0,0,1,0|3,0,0]=4 842 B13R1.24 CCCCNC(=O)c1ccncc1 WXVL_AK00588SC0062 [0,0,0,0,1,0|2,0,0]=3 843 B13R1.24 CCCCNC(=O)c1ccncc1 WXVL_AK00588SC0062 [0,0,0,0,1,0|2,0,0]=3 844 B13R1.24 CCCCNC(=O)c1ccncn1 WXVL_AK00588SC0231 [0,0,0,0,1,0|3,0,0]=4 845 B13R1.24 CCCCNC(=O)c1ccncn1 WXVL_AK00588SC0231 [0,0,0,0,1,0|3,0,0]=4 846 B13R1.24 CCCCNC(=O)c1ccnnc1 WXVL_AK00588SC0064 [0,0,0,0,1,0|3,0,0]=4 847 B13R1.24 CCCCNC(=O)c1ccnnc1 WXVL_AK00588SC0064 [0,0,0,0,1,0|3,0,0]=4 848 B13R1.24 CCCCNC(=O)c1cncnc1 WXVL_AK00588SC0097 [0,0,0,0,1,0|3,0,0]=4 849 B13R1.24 CCCCNC(=O)c1cncnc1 WXVL_AK00588SC0097 [0,0,0,0,1,0|3,0,0]=4 850 B13R1.24 CCCCNC(=O)c1ncccn1 WXVL_AK00588SC0096 [0,0,0,0,1,0|3,0,0]=4 851 B13R1.24 CCCCNC(=O)c1ncccn1 WXVL_AK00588SC0096 [0,0,0,0,1,0|3,0,0]=4 852 B13R1.24 CSCCNC(=O)c1ccccc1 WXVL_AK00440SD0001 [0,0,0,0,1,0|2,0,0]=3 853 B13R1.24 CSCCNC(=O)c1ccccc1 WXVL_AK00440SD0001 [0,0,0,0,1,0|2,0,0]=3 854 B13R1.24 CSCCNC(=O)c1ccccn1 WXVL_AK00440SC0058 [0,0,0,0,1,0|3,0,0]=4 855 B13R1.24 CSCCNC(=O)c1ccccn1 WXVL_AK00440SC0058 [0,0,0,0,1,0|3,0,0]=4 856 B13R1.24 CSCCNC(=O)c1cccnc1 WXVL_AK00440SC0061 [0,0,0,0,1,0|3,0,0]=4 857 B13R1.24 CSCCNC(=O)c1cccnc1 WXVL_AK00440SC0061 [0,0,0,0,1,0|3,0,0]=4 858 B13R1.24 CSCCNC(=O)c1ccncc1 WXVL_AK00440SC0062 [0,0,0,0,1,0|3,0,0]=4 859 B13R1.24 CSCCNC(=O)c1ccncc1 WXVL_AK00440SC0062 [0,0,0,0,1,0|3,0,0]=4 860 B13R1.24 N#CCCNC(=O)c1ccccc1 WXVL_AK0087SD0001 [0,0,0,0,1,0|2,0,1]=4 861 B13R1.24 N#CCCNC(=O)c1ccccc1 WXVL_AK0087SD0001 [0,0,0,0,1,0|2,0,1]=4 862 B13R1.24 O=C(NCCCO)c1ccccc1 WXVL_AK0073SD0001 [0,0,0,0,1,0|2,0,0]=3 863 B13R1.24 O=C(NCCCO)c1ccccc1 WXVL_AK0073SD0001 [0,0,0,0,1,0|2,0,0]=3 864 B13R1.24 O=C(NCCCO)c1ccccn1 WXVL_AK0073SC0058 [0,0,0,0,1,0|3,0,0]=4 865 B13R1.24 O=C(NCCCO)c1ccccn1 WXVL_AK0073SC0058 [0,0,0,0,1,0|3,0,0]=4 866 B13R1.24 O=C(NCCCO)c1cccnc1 WXVL_AK0073SC0061 [0,0,0,0,1,0|3,0,0]=4 867 B13R1.24 O=C(NCCCO)c1cccnc1 WXVL_AK0073SC0061 [0,0,0,0,1,0|3,0,0]=4 868 B13R1.24 O=C(NCCCO)c1ccncc1 WXVL_AK0073SC0062 [0,0,0,0,1,0|3,0,0]=4 869 B13R1.24 O=C(NCCCO)c1ccncc1 WXVL_AK0073SC0062 [0,0,0,0,1,0|3,0,0]=4 870 B13R1.156 CCCCNC(=O)Cc1cccs1 WXVL_AK00588SA0018 [0,0,0,0,1,0|2,0,0]=3 871 B13R1.156 CCCCNC(=O)Cc1cccs1 WXVL_AK00588SA0018 [0,0,0,0,1,0|2,0,0]=3 872 B13R1.156 CCCCNC(=O)Cc1ccn[nH]1 WXVL_AK00588SA00008 [0,0,0,0,1,0|3,0,0]=4 873 B13R1.156 CCCCNC(=O)Cc1ccn[nH]1 WXVL_AK00588SA00008 [0,0,0,0,1,0|3,0,0]=4 874 B13R1.156 CCCCNC(=O)Cc1ccsc1 WXVL_AK00588SA0020 [0,0,0,0,1,0|2,0,0]=3 875 B13R1.156 CCCCNC(=O)Cc1ccsc1 WXVL_AK00588SA0020 [0,0,0,0,1,0|2,0,0]=3 876 B13R1.156 CCCCNC(=O)Cc1cscn1 WXVL_AK00588SA0012 [0,0,0,0,1,0|3,0,0]=4 877 B13R1.156 CCCCNC(=O)Cc1cscn1 WXVL_AK00588SA0012 [0,0,0,0,1,0|3,0,0]=4 878 B13R1.156 CCCCNC(=O)Cn1cccn1 WXVL_AK00588SA0030 [0,0,0,0,1,0|3,0,0]=4 879 B13R1.156 CCCCNC(=O)Cn1cccn1 WXVL_AK00588SA0030 [0,0,0,0,1,0|3,0,0]=4 880 B13R1.156 CCCCNC(=O)Cn1ccnc1 WXVL_AK00588SC0105 [0,0,0,0,1,0|3,0,0]=4 881 B13R1.156 CCCCNC(=O)Cn1ccnc1 WXVL_AK00588SC0105 [0,0,0,0,1,0|3,0,0]=4 882 B13R1.156 CSCCNC(=O)Cc1cccs1 WXVL_AK00440SA0018 [0,0,0,0,1,0|3,0,0]=4 883 B13R1.156 CSCCNC(=O)Cc1cccs1 WXVL_AK00440SA0018 [0,0,0,0,1,0|3,0,0]=4 884 B13R1.156 CSCCNC(=O)Cc1ccsc1 WXVL_AK00440SA0020 [0,0,0,0,1,0|3,0,0]=4 885 B13R1.156 CSCCNC(=O)Cc1ccsc1 WXVL_AK00440SA0020 [0,0,0,0,1,0|3,0,0]=4 886 B13R1.156 O=C(Cc1cccs1)NCCCO WXVL_AK0073SA0018 [0,0,0,0,1,0|3,0,0]=4 887 B13R1.156 O=C(Cc1cccs1)NCCCO WXVL_AK0073SA0018 [0,0,0,0,1,0|3,0,0]=4 888 B13R1.156 O=C(Cc1ccsc1)NCCCO WXVL_AK0073SA0020 [0,0,0,0,1,0|3,0,0]=4 889 B13R1.156 O=C(Cc1ccsc1)NCCCO WXVL_AK0073SA0020 [0,0,0,0,1,0|3,0,0]=4 890 B15R1.78 C#CCCCC(=O)NCc1ccccc1 WXVL_AK00502SB2709 [0,0,0,0,0,1|1,0,2]=4 891 B15R1.78 C#CCCCC(=O)NCc1ccccc1 WXVL_AK00502SB2709 [0,0,0,0,0,1|1,0,2]=4 892 B15R1.78 C#CCCNC(=O)CCc1ccccc1 WXVL_AK3109SB0067 [0,0,0,0,0,1|1,0,2]=4 893 B15R1.78 C#CCCNC(=O)CCc1ccccc1 WXVL_AK3109SB0067 [0,0,0,0,0,1|1,0,2]=4 894 B15R1.78 C#CCCNC(=O)COc1ccccc1 WXVL_AK3109SB0086 [0,0,0,0,0,1|1,0,2]=4 895 B15R1.78 C#CCCNC(=O)COc1ccccc1 WXVL_AK3109SB0086 [0,0,0,0,0,1|1,0,2]=4 896 B15R1.78 C#CCCNC(=O)CSc1ccccc1 WXVL_AK3109SB0113 [0,0,0,0,0,1|1,0,2]=4 897 B15R1.78 C#CCCNC(=O)CSc1ccccc1 WXVL_AK3109SB0113 [0,0,0,0,0,1|1,0,2]=4 898 B15R1.78 C=CCCCC(=O)NCc1ccccc1 WXVL_AK00502SB2920 [0,0,0,0,0,1|1,0,2]=4 899 B15R1.78 C=CCCCC(=O)NCc1ccccc1 WXVL_AK00502SB2920 [0,0,0,0,0,1|1,0,2]=4 900 B15R1.78 C=CCCNC(=O)CCc1ccccc1 WXVL_AK00138SB0067 [0,0,0,0,0,1|1,0,2]=4 901 B15R1.78 C=CCCNC(=O)CCc1ccccc1 WXVL_AK00138SB0067 [0,0,0,0,0,1|1,0,2]=4 902 B15R1.78 C=CCCNC(=O)COc1ccccc1 WXVL_AK00138SB0086 [0,0,0,0,0,1|1,0,2]=4 903 B15R1.78 C=CCCNC(=O)COc1ccccc1 WXVL_AK00138SB0086 [0,0,0,0,0,1|1,0,2]=4 904 B15R1.78 C=CCCNC(=O)CSc1ccccc1 WXVL_AK00138SB0113 [0,0,0,0,0,1|1,0,2]=4 905 B15R1.78 C=CCCNC(=O)CSc1ccccc1 WXVL_AK00138SB0113 [0,0,0,0,0,1|1,0,2]=4 906 B15R1.78 CC/C=C/CC(=O)NCc1ccccc1 WXVL_AK00502SB0349 [0,0,0,0,0,1|1,0,2]=4 907 B15R1.78 CC/C=C/CC(=O)NCc1ccccc1 WXVL_AK00502SB0349 [0,0,0,0,0,1|1,0,2]=4 908 B15R1.78 CCCCNC(=O)/C=C/c1ccccc1 WXVL_AK00588SB0115 [0,0,0,0,0,1|1,0,1]=3 909 B15R1.78 CCCCNC(=O)/C=C/c1ccccc1 WXVL_AK00588SB0115 [0,0,0,0,0,1|1,0,1]=3 910 B15R1.78 CCCCNC(=O)/C=C/c1cccnc1 WXVL_AK00588SA0193 [0,0,0,0,0,1|2,0,1]=4 911 B15R1.78 CCCCNC(=O)/C=C/c1cccnc1 WXVL_AK00588SA0193 [0,0,0,0,0,1|2,0,1]=4 912 B15R1.78 CCCCNC(=O)C#Cc1ccccc1 WXVL_AK00588SB0114 [0,0,0,0,0,1|1,0,1]=3 913 B15R1.78 CCCCNC(=O)C#Cc1ccccc1 WXVL_AK00588SB0114 [0,0,0,0,0,1|1,0,1]=3 914 B15R1.78 CCCCNC(=O)CCc1ccccc1 WXVL_AK00588SB0067 [0,0,0,0,0,1|1,0,0]=2 915 B15R1.78 CCCCNC(=O)CCc1ccccc1 WXVL_AK00588SB0067 [0,0,0,0,0,1|1,0,0]=2 916 B15R1.78 CCCCNC(=O)CCc1ccccn1 WXVL_AK00588SA0316 [0,0,0,0,0,1|2,0,0]=3 917 B15R1.78 CCCCNC(=O)CCc1ccccn1 WXVL_AK00588SA0316 [0,0,0,0,0,1|2,0,0]=3 918 B15R1.78 CCCCNC(=O)CCc1cccnc1 WXVL_AK00588SA0031 [0,0,0,0,0,1|2,0,0]=3 919 B15R1.78 CCCCNC(=O)CCc1cccnc1 WXVL_AK00588SA0031 [0,0,0,0,0,1|2,0,0]=3 920 B15R1.78 CCCCNC(=O)CCc1cnccn1 WXVL_AK00588SA2354 [0,0,0,0,0,1|3,0,0]=4 921 B15R1.78 CCCCNC(=O)CCc1cnccn1 WXVL_AK00588SA2354 [0,0,0,0,0,1|3,0,0]=4 922 B15R1.78 CCCCNC(=O)CCc1cncnc1 WXVL_AK00588SA0013 [0,0,0,0,0,1|3,0,0]=4 923 B15R1.78 CCCCNC(=O)CCc1cncnc1 WXVL_AK00588SA0013 [0,0,0,0,0,1|3,0,0]=4 924 B15R1.78 CCCCNC(=O)COc1ccccc1 WXVL_AK00588SB0086 [0,0,0,0,0,1|1,0,0]=2 925 B15R1.78 CCCCNC(=O)COc1ccccc1 WXVL_AK00588SB0086 [0,0,0,0,0,1|1,0,0]=2 926 B15R1.78 CCCCNC(=O)COc1cccnc1 WXVL_AK00588SA0051 [0,0,0,0,0,1|2,0,0]=3 927 B15R1.78 CCCCNC(=O)COc1cccnc1 WXVL_AK00588SA0051 [0,0,0,0,0,1|2,0,0]=3 928 B15R1.78 CCCCNC(=O)CSc1ccccc1 WXVL_AK00588SB0113 [0,0,0,0,0,1|1,0,0]=2 929 B15R1.78 CCCCNC(=O)CSc1ccccc1 WXVL_AK00588SB0113 [0,0,0,0,0,1|1,0,0]=2 930 B15R1.78 CCCCNC(=O)CSc1ccncc1 WXVL_AK00588SA0055 [0,0,0,0,0,1|2,0,0]=3 931 B15R1.78 CCCCNC(=O)CSc1ccncc1 WXVL_AK00588SA0055 [0,0,0,0,0,1|2,0,0]=3 932 B15R1.78 CCCCNC(=O)CSc1ncccn1 WXVL_AK00588SA0022 [0,0,0,0,0,1|3,0,0]=4 933 B15R1.78 CCCCNC(=O)CSc1ncccn1 WXVL_AK00588SA0022 [0,0,0,0,0,1|3,0,0]=4 934 B15R1.78 CCO/C=C/C(=O)NCc1ccccc1 WXVL_AK00502SB3226 [0,0,0,0,0,1|2,0,1]=4 935 B15R1.78 CCO/C=C/C(=O)NCc1ccccc1 WXVL_AK00502SB3226 [0,0,0,0,0,1|2,0,1]=4 936 B15R1.78 CSCCNC(=O)/C=C/c1ccccc1 WXVL_AK00440SB0115 [0,0,0,0,0,1|2,0,1]=4 937 B15R1.78 CSCCNC(=O)/C=C/c1ccccc1 WXVL_AK00440SB0115 [0,0,0,0,0,1|2,0,1]=4 938 B15R1.78 CSCCNC(=O)C#Cc1ccccc1 WXVL_AK00440SB0114 [0,0,0,0,0,1|2,0,1]=4 939 B15R1.78 CSCCNC(=O)C#Cc1ccccc1 WXVL_AK00440SB0114 [0,0,0,0,0,1|2,0,1]=4 940 B15R1.78 CSCCNC(=O)CCc1ccccc1 WXVL_AK00440SB0067 [0,0,0,0,0,1|2,0,0]=3 941 B15R1.78 CSCCNC(=O)CCc1ccccc1 WXVL_AK00440SB0067 [0,0,0,0,0,1|2,0,0]=3 942 B15R1.78 CSCCNC(=O)CCc1ccccn1 WXVL_AK00440SA0316 [0,0,0,0,0,1|3,0,0]=4 943 B15R1.78 CSCCNC(=O)CCc1ccccn1 WXVL_AK00440SA0316 [0,0,0,0,0,1|3,0,0]=4 944 B15R1.78 CSCCNC(=O)CCc1cccnc1 WXVL_AK00440SA0031 [0,0,0,0,0,1|3,0,0]=4 945 B15R1.78 CSCCNC(=O)CCc1cccnc1 WXVL_AK00440SA0031 [0,0,0,0,0,1|3,0,0]=4 946 B15R1.78 CSCCNC(=O)COc1ccccc1 WXVL_AK00440SB0086 [0,0,0,0,0,1|2,0,0]=3 947 B15R1.78 CSCCNC(=O)COc1ccccc1 WXVL_AK00440SB0086 [0,0,0,0,0,1|2,0,0]=3 948 B15R1.78 CSCCNC(=O)COc1cccnc1 WXVL_AK00440SA0051 [0,0,0,0,0,1|3,0,0]=4 949 B15R1.78 CSCCNC(=O)COc1cccnc1 WXVL_AK00440SA0051 [0,0,0,0,0,1|3,0,0]=4 950 B15R1.78 CSCCNC(=O)CSc1ccccc1 WXVL_AK00440SB0113 [0,0,0,0,0,1|2,0,0]=3 951 B15R1.78 CSCCNC(=O)CSc1ccccc1 WXVL_AK00440SB0113 [0,0,0,0,0,1|2,0,0]=3 952 B15R1.78 CSCCNC(=O)CSc1ccncc1 WXVL_AK00440SA0055 [0,0,0,0,0,1|3,0,0]=4 953 B15R1.78 CSCCNC(=O)CSc1ccncc1 WXVL_AK00440SA0055 [0,0,0,0,0,1|3,0,0]=4 954 B15R1.78 N#CCCNC(=O)CCc1ccccc1 WXVL_AK0087SB0067 [0,0,0,0,0,1|2,0,1]=4 955 B15R1.78 N#CCCNC(=O)CCc1ccccc1 WXVL_AK0087SB0067 [0,0,0,0,0,1|2,0,1]=4 956 B15R1.78 N#CCCNC(=O)COc1ccccc1 WXVL_AK0087SB0086 [0,0,0,0,0,1|2,0,1]=4 957 B15R1.78 N#CCCNC(=O)COc1ccccc1 WXVL_AK0087SB0086 [0,0,0,0,0,1|2,0,1]=4 958 B15R1.78 N#CCCNC(=O)CSc1ccccc1 WXVL_AK0087SB0113 [0,0,0,0,0,1|2,0,1]=4 959 B15R1.78 N#CCCNC(=O)CSc1ccccc1 WXVL_AK0087SB0113 [0,0,0,0,0,1|2,0,1]=4 960 B15R1.78 O=C(/C=C/c1ccccc1)NCCCO WXVL_AK0073SB0115 [0,0,0,0,0,1|2,0,1]=4 961 B15R1.78 O=C(/C=C/c1ccccc1)NCCCO WXVL_AK0073SB0115 [0,0,0,0,0,1|2,0,1]=4 962 B15R1.78 O=C(C#Cc1ccccc1)NCCCO WXVL_AK0073SB0114 [0,0,0,0,0,1|2,0,1]=4 963 B15R1.78 O=C(C#Cc1ccccc1)NCCCO WXVL_AK0073SB0114 [0,0,0,0,0,1|2,0,1]=4 964 B15R1.78 O=C(CCCCBr)NCc1ccccc1 WXVL_AK00502SB3153 [0,0,0,0,0,1|2,0,0]=3 965 B15R1.78 O=C(CCCCBr)NCc1ccccc1 WXVL_AK00502SB3153 [0,0,0,0,0,1|2,0,0]=3 966 B15R1.78 O=C(CCCCBr)NCc1ccccn1 WXVL_AK0018SB3153 [0,0,0,0,0,1|3,0,0]=4 967 B15R1.78 O=C(CCCCBr)NCc1ccccn1 WXVL_AK0018SB3153 [0,0,0,0,0,1|3,0,0]=4 968 B15R1.78 O=C(CCCCBr)NCc1cccnc1 WXVL_AK0020SB3153 [0,0,0,0,0,1|3,0,0]=4 969 B15R1.78 O=C(CCCCBr)NCc1cccnc1 WXVL_AK0020SB3153 [0,0,0,0,0,1|3,0,0]=4 970 B15R1.78 O=C(CCCCBr)NCc1ccncc1 WXVL_AK0021SB3153 [0,0,0,0,0,1|3,0,0]=4 971 B15R1.78 O=C(CCCCBr)NCc1ccncc1 WXVL_AK0021SB3153 [0,0,0,0,0,1|3,0,0]=4 972 B15R1.78 O=C(CCCCCl)NCc1ccccc1 WXVL_AK00502SB0379 [0,0,0,0,0,1|2,0,0]=3 973 B15R1.78 O=C(CCCCCl)NCc1ccccc1 WXVL_AK00502SB0379 [0,0,0,0,0,1|2,0,0]=3 974 B15R1.78 O=C(CCCCCl)NCc1ccccn1 WXVL_AK0018SB0379 [0,0,0,0,0,1|3,0,0]=4 975 B15R1.78 O=C(CCCCCl)NCc1ccccn1 WXVL_AK0018SB0379 [0,0,0,0,0,1|3,0,0]=4 976 B15R1.78 O=C(CCCCCl)NCc1cccnc1 WXVL_AK0020SB0379 [0,0,0,0,0,1|3,0,0]=4 977 B15R1.78 O=C(CCCCCl)NCc1cccnc1 WXVL_AK0020SB0379 [0,0,0,0,0,1|3,0,0]=4 978 B15R1.78 O=C(CCCCCl)NCc1ccncc1 WXVL_AK0021SB0379 [0,0,0,0,0,1|3,0,0]=4 979 B15R1.78 O=C(CCCCCl)NCc1ccncc1 WXVL_AK0021SB0379 [0,0,0,0,0,1|3,0,0]=4 980 B15R1.78 O=C(CCc1ccccc1)NCCCO WXVL_AK0073SB0067 [0,0,0,0,0,1|2,0,0]=3 981 B15R1.78 O=C(CCc1ccccc1)NCCCO WXVL_AK0073SB0067 [0,0,0,0,0,1|2,0,0]=3 982 B15R1.78 O=C(CCc1ccccn1)NCCCO WXVL_AK0073SA0316 [0,0,0,0,0,1|3,0,0]=4 983 B15R1.78 O=C(CCc1ccccn1)NCCCO WXVL_AK0073SA0316 [0,0,0,0,0,1|3,0,0]=4 984 B15R1.78 O=C(CCc1cccnc1)NCCCO WXVL_AK0073SA0031 [0,0,0,0,0,1|3,0,0]=4 985 B15R1.78 O=C(CCc1cccnc1)NCCCO WXVL_AK0073SA0031 [0,0,0,0,0,1|3,0,0]=4 986 B15R1.78 O=C(COc1ccccc1)NCCCO WXVL_AK0073SB0086 [0,0,0,0,0,1|2,0,0]=3 987 B15R1.78 O=C(COc1ccccc1)NCCCO WXVL_AK0073SB0086 [0,0,0,0,0,1|2,0,0]=3 988 B15R1.78 O=C(COc1cccnc1)NCCCO WXVL_AK0073SA0051 [0,0,0,0,0,1|3,0,0]=4 989 B15R1.78 O=C(COc1cccnc1)NCCCO WXVL_AK0073SA0051 [0,0,0,0,0,1|3,0,0]=4 990 B15R1.78 O=C(CSc1ccccc1)NCCCO WXVL_AK0073SB0113 [0,0,0,0,0,1|2,0,0]=3 991 B15R1.78 O=C(CSc1ccccc1)NCCCO WXVL_AK0073SB0113 [0,0,0,0,0,1|2,0,0]=3 992 B15R1.78 O=C(CSc1ccncc1)NCCCO WXVL_AK0073SA0055 [0,0,0,0,0,1|3,0,0]=4 993 B15R1.78 O=C(CSc1ccncc1)NCCCO WXVL_AK0073SA0055 [0,0,0,0,0,1|3,0,0]=4 994 B15R1.78 O=C(NCCCCl)NCc1ccccc1 WXVL_AK00502YV0130 [0,0,0,0,0,1|2,0,0]=3 995 B15R1.78 O=C(NCCCCl)NCc1ccccc1 WXVL_AK00502YV0130 [0,0,0,0,0,1|2,0,0]=3 996 B15R1.78 O=C(NCCCCl)NCc1ccccn1 WXVL_AK0018YV0130 [0,0,0,0,0,1|3,0,0]=4 997 B15R1.78 O=C(NCCCCl)NCc1ccccn1 WXVL_AK0018YV0130 [0,0,0,0,0,1|3,0,0]=4 998 B15R1.78 O=C(NCCCCl)NCc1cccnc1 WXVL_AK0020YV0130 [0,0,0,0,0,1|3,0,0]=4 999 B15R1.78 O=C(NCCCCl)NCc1cccnc1 WXVL_AK0020YV0130 [0,0,0,0,0,1|3,0,0]=4 1000 B15R1.78 O=C(NCCCCl)NCc1ccncc1 WXVL_AK0021YV0130 [0,0,0,0,0,1|3,0,0]=4 1001 B15R1.78 O=C(NCCCCl)NCc1ccncc1 WXVL_AK0021YV0130 [0,0,0,0,0,1|3,0,0]=4 1002 B12R1.32 CCCC(=O)Nc1ccccc1 WXVL_AG00183SB0073 [2,0,0,0,0,0|1,0,0]=3 1003 B12R1.32 CCCC(=O)Nc1ccccc1 WXVL_AG00183SB0073 [2,0,0,0,0,0|1,0,0]=3 1004 B12R1.32 CCCC(=O)Nc1ccccn1 WXVL_AF00298SB0073 [2,0,0,0,0,0|2,0,0]=4 1005 B12R1.32 CCCC(=O)Nc1ccccn1 WXVL_AF00298SB0073 [2,0,0,0,0,0|2,0,0]=4 1006 B12R1.32 CCNC(=O)Cc1ccccc1 WXVL_AK00476SB0092 [2,0,0,0,0,0|1,0,0]=3 1007 B12R1.32 CCNC(=O)Cc1ccccc1 WXVL_AK00476SB0092 [2,0,0,0,0,0|1,0,0]=3 1008 B12R1.32 CCNC(=O)Cc1ccccn1 WXVL_AK00476SA0032 [2,0,0,0,0,0|2,0,0]=4 1009 B12R1.32 CCNC(=O)Cc1ccccn1 WXVL_AK00476SA0032 [2,0,0,0,0,0|2,0,0]=4 1010 B12R1.32 CCNC(=O)Cc1cccnc1 WXVL_AK00476SA0029 [2,0,0,0,0,0|2,0,0]=4 1011 B12R1.32 CCNC(=O)Cc1cccnc1 WXVL_AK00476SA0029 [2,0,0,0,0,0|2,0,0]=4 1012 B12R1.32 CCNC(=O)Cc1cccnc1 WXVL_AK00476SB00049 [2,0,0,0,0,0|2,0,0]=4 1013 B12R1.32 CCNC(=O)Cc1cccnc1 WXVL_AK00476SB00049 [2,0,0,0,0,0|2,0,0]=4 1014 B12R1.32 CCNC(=O)Cc1ccncc1 WXVL_AK00476SA00106 [2,0,0,0,0,0|2,0,0]=4 1015 B12R1.32 CCNC(=O)Cc1ccncc1 WXVL_AK00476SA00106 [2,0,0,0,0,0|2,0,0]=4 1016 B12R1.32 COCC(=O)Nc1ccccc1 WXVL_AG00183SB0090 [2,0,0,0,0,0|2,0,0]=4 1017 B12R1.32 COCC(=O)Nc1ccccc1 WXVL_AG00183SB0090 [2,0,0,0,0,0|2,0,0]=4 1018 B12R1.32 CSCC(=O)Nc1ccccc1 WXVL_AG00183SB1267 [2,0,0,0,0,0|2,0,0]=4 1019 B12R1.32 CSCC(=O)Nc1ccccc1 WXVL_AG00183SB1267 [2,0,0,0,0,0|2,0,0]=4 1020 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Br WXVL_AK00504SB0926 [1,1,0,0,0,0|1,0,0]=3 1021 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Br WXVL_AK00504SB0926 [1,1,0,0,0,0|1,0,0]=3 1022 B14R1.33 CCCNC(=O)Cc1ccc(cc1)C WXVL_AK00504SB0112 [1,1,0,0,0,0|1,0,0]=3 1023 B14R1.33 CCCNC(=O)Cc1ccc(cc1)C WXVL_AK00504SB0112 [1,1,0,0,0,0|1,0,0]=3 1024 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK00504SB0107 [1,1,0,0,0,0|1,0,0]=3 1025 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK00504SB0107 [1,1,0,0,0,0|1,0,0]=3 1026 B14R1.33 CCCNC(=O)Cc1ccc(cc1)F WXVL_AK00504SB0106 [1,1,0,0,0,0|1,0,0]=3 1027 B14R1.33 CCCNC(=O)Cc1ccc(cc1)F WXVL_AK00504SB0106 [1,1,0,0,0,0|1,0,0]=3 1028 B14R1.33 CCCNC(=O)Cc1ccc(cc1)O WXVL_AK00504SB0110 [1,1,0,0,0,0|1,0,0]=3 1029 B14R1.33 CCCNC(=O)Cc1ccc(cc1)O WXVL_AK00504SB0110 [1,1,0,0,0,0|1,0,0]=3 1030 B14R1.33 CCCNC(=O)Cc1ccc(cn1)Br WXVL_AK00504SA0212 [1,1,0,0,0,0|2,0,0]=4 1031 B14R1.33 CCCNC(=O)Cc1ccc(cn1)Br WXVL_AK00504SA0212 [1,1,0,0,0,0|2,0,0]=4 1032 B14R1.33 CCCNC(=O)Cc1ccc(cn1)Cl WXVL_AK00504SA0537 [1,1,0,0,0,0|2,0,0]=4 1033 B14R1.33 CCCNC(=O)Cc1ccc(cn1)Cl WXVL_AK00504SA0537 [1,1,0,0,0,0|2,0,0]=4 1034 B14R1.33 CCCNC(=O)Cc1ccc(cn1)F WXVL_AK00504SA0011 [1,1,0,0,0,0|2,0,0]=4 1035 B14R1.33 CCCNC(=O)Cc1ccc(cn1)F WXVL_AK00504SA0011 [1,1,0,0,0,0|2,0,0]=4 1036 B14R1.33 CCCNC(=O)Cc1ccc(cn1)O WXVL_AK00504SA2976 [1,1,0,0,0,0|2,0,0]=4 1037 B14R1.33 CCCNC(=O)Cc1ccc(cn1)O WXVL_AK00504SA2976 [1,1,0,0,0,0|2,0,0]=4 1038 B14R1.33 CCCNC(=O)Cc1ccc(nc1)Br WXVL_AK00504SA00056 [1,1,0,0,0,0|2,0,0]=4 1039 B14R1.33 CCCNC(=O)Cc1ccc(nc1)Br WXVL_AK00504SA00056 [1,1,0,0,0,0|2,0,0]=4 1040 B14R1.33 CCCNC(=O)Cc1ccc(nc1)C WXVL_AK00504SA0250 [1,1,0,0,0,0|2,0,0]=4 1041 B14R1.33 CCCNC(=O)Cc1ccc(nc1)C WXVL_AK00504SA0250 [1,1,0,0,0,0|2,0,0]=4 1042 B14R1.33 CCCNC(=O)Nc1ccc(cc1)C WXVL_AK00504YV0026 [1,1,0,0,0,0|2,0,0]=4 1043 B14R1.33 CCCNC(=O)Nc1ccc(cc1)C WXVL_AK00504YV0026 [1,1,0,0,0,0|2,0,0]=4 1044 B14R1.33 CCCNC(=O)Nc1ccc(cc1)Cl WXVL_AK00504YV0023 [1,1,0,0,0,0|2,0,0]=4 1045 B14R1.33 CCCNC(=O)Nc1ccc(cc1)Cl WXVL_AK00504YV0023 [1,1,0,0,0,0|2,0,0]=4 1046 B14R1.33 CCOCC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0091 [1,1,0,0,0,0|2,0,0]=4 1047 B14R1.33 CCOCC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0091 [1,1,0,0,0,0|2,0,0]=4 1048 B14R1.33 CCOCC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0091 [1,1,0,0,0,0|2,0,0]=4 1049 B14R1.33 CCOCC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0091 [1,1,0,0,0,0|2,0,0]=4 1050 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0002 [1,1,0,0,0,0|2,0,0]=4 1051 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0002 [1,1,0,0,0,0|2,0,0]=4 1052 B14R1.33 CCSCC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0002 [1,1,0,0,0,0|2,0,0]=4 1053 B14R1.33 CCSCC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0002 [1,1,0,0,0,0|2,0,0]=4 1054 B14R1.33 COCCC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0156 [1,1,0,0,0,0|2,0,0]=4 1055 B14R1.33 COCCC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0156 [1,1,0,0,0,0|2,0,0]=4 1056 B14R1.33 COCCC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0156 [1,1,0,0,0,0|2,0,0]=4 1057 B14R1.33 COCCC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0156 [1,1,0,0,0,0|2,0,0]=4 1058 B14R1.33 CSCCC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0361 [1,1,0,0,0,0|2,0,0]=4 1059 B14R1.33 CSCCC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0361 [1,1,0,0,0,0|2,0,0]=4 1060 B14R1.33 CSCCC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0361 [1,1,0,0,0,0|2,0,0]=4 1061 B14R1.33 CSCCC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0361 [1,1,0,0,0,0|2,0,0]=4 1062 B14R1.33 Cc1ccc(cc1)CC(=O)NCCF WXVL_AK00466SB0112 [1,1,0,0,0,0|2,0,0]=4 1063 B14R1.33 Cc1ccc(cc1)CC(=O)NCCF WXVL_AK00466SB0112 [1,1,0,0,0,0|2,0,0]=4 1064 B14R1.33 O=C(Cc1ccc(cc1)Br)NCCF WXVL_AK00466SB0926 [1,1,0,0,0,0|2,0,0]=4 1065 B14R1.33 O=C(Cc1ccc(cc1)Br)NCCF WXVL_AK00466SB0926 [1,1,0,0,0,0|2,0,0]=4 1066 B14R1.33 O=C(Cc1ccc(cc1)Cl)NCCF WXVL_AK00466SB0107 [1,1,0,0,0,0|2,0,0]=4 1067 B14R1.33 O=C(Cc1ccc(cc1)Cl)NCCF WXVL_AK00466SB0107 [1,1,0,0,0,0|2,0,0]=4 1068 B14R1.33 O=C(Cc1ccc(cc1)F)NCCF WXVL_AK00466SB0106 [1,1,0,0,0,0|2,0,0]=4 1069 B14R1.33 O=C(Cc1ccc(cc1)F)NCCF WXVL_AK00466SB0106 [1,1,0,0,0,0|2,0,0]=4 1070 B14R1.33 O=C(Cc1ccc(cc1)O)NCCF WXVL_AK00466SB0110 [1,1,0,0,0,0|2,0,0]=4 1071 B14R1.33 O=C(Cc1ccc(cc1)O)NCCF WXVL_AK00466SB0110 [1,1,0,0,0,0|2,0,0]=4 1072 B14R1.34 CCCNC(=O)Cc1cccc(c1)Br WXVL_AK00504SB0099 [1,1,0,0,0,0|1,0,0]=3 1073 B14R1.34 CCCNC(=O)Cc1cccc(c1)Br WXVL_AK00504SB0099 [1,1,0,0,0,0|1,0,0]=3 1074 B14R1.34 CCCNC(=O)Cc1cccc(c1)C WXVL_AK00504SB0105 [1,1,0,0,0,0|1,0,0]=3 1075 B14R1.34 CCCNC(=O)Cc1cccc(c1)C WXVL_AK00504SB0105 [1,1,0,0,0,0|1,0,0]=3 1076 B14R1.34 CCCNC(=O)Cc1cccc(c1)Cl WXVL_AK00504SB0101 [1,1,0,0,0,0|1,0,0]=3 1077 B14R1.34 CCCNC(=O)Cc1cccc(c1)Cl WXVL_AK00504SB0101 [1,1,0,0,0,0|1,0,0]=3 1078 B14R1.34 CCCNC(=O)Cc1cccc(c1)F WXVL_AK00504SB0100 [1,1,0,0,0,0|1,0,0]=3 1079 B14R1.34 CCCNC(=O)Cc1cccc(c1)F WXVL_AK00504SB0100 [1,1,0,0,0,0|1,0,0]=3 1080 B14R1.34 CCCNC(=O)Cc1cccc(c1)O WXVL_AK00504SB0104 [1,1,0,0,0,0|1,0,0]=3 1081 B14R1.34 CCCNC(=O)Cc1cccc(c1)O WXVL_AK00504SB0104 [1,1,0,0,0,0|1,0,0]=3 1082 B14R1.34 CCCNC(=O)Cc1cccc(n1)C WXVL_AK00504SA0399 [1,1,0,0,0,0|2,0,0]=4 1083 B14R1.34 CCCNC(=O)Cc1cccc(n1)C WXVL_AK00504SA0399 [1,1,0,0,0,0|2,0,0]=4 1084 B14R1.34 CCCNC(=O)Cc1cccc(n1)Cl WXVL_AK00504SA0313 [1,1,0,0,0,0|2,0,0]=4 1085 B14R1.34 CCCNC(=O)Cc1cccc(n1)Cl WXVL_AK00504SA0313 [1,1,0,0,0,0|2,0,0]=4 1086 B14R1.34 CCCNC(=O)Cc1ccnc(c1)Br WXVL_AK00504SA0520 [1,1,0,0,0,0|2,0,0]=4 1087 B14R1.34 CCCNC(=O)Cc1ccnc(c1)Br WXVL_AK00504SA0520 [1,1,0,0,0,0|2,0,0]=4 1088 B14R1.34 CCCNC(=O)Nc1cccc(c1)Br WXVL_AK00504YV0098 [1,1,0,0,0,0|2,0,0]=4 1089 B14R1.34 CCCNC(=O)Nc1cccc(c1)Br WXVL_AK00504YV0098 [1,1,0,0,0,0|2,0,0]=4 1090 B14R1.34 CCCNC(=O)Nc1cccc(c1)C WXVL_AK00504YV0020 [1,1,0,0,0,0|2,0,0]=4 1091 B14R1.34 CCCNC(=O)Nc1cccc(c1)C WXVL_AK00504YV0020 [1,1,0,0,0,0|2,0,0]=4 1092 B14R1.34 CCCNC(=O)Nc1cccc(c1)Cl WXVL_AK00504YV0016 [1,1,0,0,0,0|2,0,0]=4 1093 B14R1.34 CCCNC(=O)Nc1cccc(c1)Cl WXVL_AK00504YV0016 [1,1,0,0,0,0|2,0,0]=4 1094 B14R1.34 CCOCC(=O)Nc1cccc(c1)C WXVL_AG0052SB0091 [1,1,0,0,0,0|2,0,0]=4 1095 B14R1.34 CCOCC(=O)Nc1cccc(c1)C WXVL_AG0052SB0091 [1,1,0,0,0,0|2,0,0]=4 1096 B14R1.34 CCOCC(=O)Nc1cccc(c1)I WXVL_AG0649SB0091 [1,1,0,0,0,0|2,0,0]=4 1097 B14R1.34 CCOCC(=O)Nc1cccc(c1)I WXVL_AG0649SB0091 [1,1,0,0,0,0|2,0,0]=4 1098 B14R1.34 CCOCC(=O)Nc1cccc(c1)O WXVL_AG00200SB0091 [1,1,0,0,0,0|2,0,0]=4 1099 B14R1.34 CCOCC(=O)Nc1cccc(c1)O WXVL_AG00200SB0091 [1,1,0,0,0,0|2,0,0]=4 1100 B14R1.34 CCSCC(=O)Nc1cccc(c1)C WXVL_AG0052SB0002 [1,1,0,0,0,0|2,0,0]=4 1101 B14R1.34 CCSCC(=O)Nc1cccc(c1)C WXVL_AG0052SB0002 [1,1,0,0,0,0|2,0,0]=4 1102 B14R1.34 CCSCC(=O)Nc1cccc(c1)I WXVL_AG0649SB0002 [1,1,0,0,0,0|2,0,0]=4 1103 B14R1.34 CCSCC(=O)Nc1cccc(c1)I WXVL_AG0649SB0002 [1,1,0,0,0,0|2,0,0]=4 1104 B14R1.34 CCSCC(=O)Nc1cccc(c1)O WXVL_AG00200SB0002 [1,1,0,0,0,0|2,0,0]=4 1105 B14R1.34 CCSCC(=O)Nc1cccc(c1)O WXVL_AG00200SB0002 [1,1,0,0,0,0|2,0,0]=4 1106 B14R1.34 COCCC(=O)Nc1cccc(c1)C WXVL_AG0052SB0156 [1,1,0,0,0,0|2,0,0]=4 1107 B14R1.34 COCCC(=O)Nc1cccc(c1)C WXVL_AG0052SB0156 [1,1,0,0,0,0|2,0,0]=4 1108 B14R1.34 COCCC(=O)Nc1cccc(c1)I WXVL_AG0649SB0156 [1,1,0,0,0,0|2,0,0]=4 1109 B14R1.34 COCCC(=O)Nc1cccc(c1)I WXVL_AG0649SB0156 [1,1,0,0,0,0|2,0,0]=4 1110 B14R1.34 COCCC(=O)Nc1cccc(c1)O WXVL_AG00200SB0156 [1,1,0,0,0,0|2,0,0]=4 1111 B14R1.34 COCCC(=O)Nc1cccc(c1)O WXVL_AG00200SB0156 [1,1,0,0,0,0|2,0,0]=4 1112 B14R1.34 CSCCC(=O)Nc1cccc(c1)C WXVL_AG0052SB0361 [1,1,0,0,0,0|2,0,0]=4 1113 B14R1.34 CSCCC(=O)Nc1cccc(c1)C WXVL_AG0052SB0361 [1,1,0,0,0,0|2,0,0]=4 1114 B14R1.34 CSCCC(=O)Nc1cccc(c1)I WXVL_AG0649SB0361 [1,1,0,0,0,0|2,0,0]=4 1115 B14R1.34 CSCCC(=O)Nc1cccc(c1)I WXVL_AG0649SB0361 [1,1,0,0,0,0|2,0,0]=4 1116 B14R1.34 CSCCC(=O)Nc1cccc(c1)O WXVL_AG00200SB0361 [1,1,0,0,0,0|2,0,0]=4 1117 B14R1.34 CSCCC(=O)Nc1cccc(c1)O WXVL_AG00200SB0361 [1,1,0,0,0,0|2,0,0]=4 1118 B14R1.34 Cc1cccc(c1)CC(=O)NCCF WXVL_AK00466SB0105 [1,1,0,0,0,0|2,0,0]=4 1119 B14R1.34 Cc1cccc(c1)CC(=O)NCCF WXVL_AK00466SB0105 [1,1,0,0,0,0|2,0,0]=4 1120 B14R1.34 O=C(Cc1cccc(c1)Br)NCCF WXVL_AK00466SB0099 [1,1,0,0,0,0|2,0,0]=4 1121 B14R1.34 O=C(Cc1cccc(c1)Br)NCCF WXVL_AK00466SB0099 [1,1,0,0,0,0|2,0,0]=4 1122 B14R1.34 O=C(Cc1cccc(c1)Cl)NCCF WXVL_AK00466SB0101 [1,1,0,0,0,0|2,0,0]=4 1123 B14R1.34 O=C(Cc1cccc(c1)Cl)NCCF WXVL_AK00466SB0101 [1,1,0,0,0,0|2,0,0]=4 1124 B14R1.34 O=C(Cc1cccc(c1)F)NCCF WXVL_AK00466SB0100 [1,1,0,0,0,0|2,0,0]=4 1125 B14R1.34 O=C(Cc1cccc(c1)F)NCCF WXVL_AK00466SB0100 [1,1,0,0,0,0|2,0,0]=4 1126 B14R1.34 O=C(Cc1cccc(c1)O)NCCF WXVL_AK00466SB0104 [1,1,0,0,0,0|2,0,0]=4 1127 B14R1.34 O=C(Cc1cccc(c1)O)NCCF WXVL_AK00466SB0104 [1,1,0,0,0,0|2,0,0]=4 1128 B14R1.60 CCCC(C)C(=O)Nc1ccccc1 WXVL_AG00183SB0352 [1,1,0,0,0,0|1,0,0]=3 1129 B14R1.60 CCCC(C)C(=O)Nc1ccccc1 WXVL_AG00183SB0352 [1,1,0,0,0,0|1,0,0]=3 1130 B14R1.60 CCCC(C)C(=O)Nc1ccccn1 WXVL_AF00298SB0352 [1,1,0,0,0,0|2,0,0]=4 1131 B14R1.60 CCCC(C)C(=O)Nc1ccccn1 WXVL_AF00298SB0352 [1,1,0,0,0,0|2,0,0]=4 1132 B14R1.60 CCC[C@H](O)C(=O)Nc1ccccc1 WXVL_AG00183SB3627 [1,1,0,0,0,0|1,0,0]=3 1133 B14R1.60 CCC[C@H](O)C(=O)Nc1ccccc1 WXVL_AG00183SB3627 [1,1,0,0,0,0|1,0,0]=3 1134 B14R1.60 CCC[C@H](O)C(=O)Nc1ccccn1 WXVL_AF00298SB3627 [1,1,0,0,0,0|2,0,0]=4 1135 B14R1.60 CCC[C@H](O)C(=O)Nc1ccccn1 WXVL_AF00298SB3627 [1,1,0,0,0,0|2,0,0]=4 1136 B14R1.60 CN(CCO)C(=O)Cc1ccccc1 WXVL_AN2670SB0092 [1,1,0,0,0,0|2,0,0]=4 1137 B14R1.60 CN(CCO)C(=O)Cc1ccccc1 WXVL_AN2670SB0092 [1,1,0,0,0,0|2,0,0]=4 1138 B14R1.166 CC(C(=O)NCCF)c1ccccc1 WXVL_AK00466SB2326 [1,1,0,0,0,0|2,0,0]=4 1139 B14R1.166 CC(C(=O)NCCF)c1ccccc1 WXVL_AK00466SB2326 [1,1,0,0,0,0|2,0,0]=4 1140 B14R1.166 CCCNC(=O)C(=O)c1ccccc1 WXVL_AK00504SB0050 [1,1,0,0,0,0|1,0,1]=4 1141 B14R1.166 CCCNC(=O)C(=O)c1ccccc1 WXVL_AK00504SB0050 [1,1,0,0,0,0|1,0,1]=4 1142 B14R1.166 CCCNC(=O)C(C)c1ccccc1 WXVL_AK00504SB2326 [1,1,0,0,0,0|1,0,0]=3 1143 B14R1.166 CCCNC(=O)C(C)c1ccccc1 WXVL_AK00504SB2326 [1,1,0,0,0,0|1,0,0]=3 1144 B14R1.166 CCCNC(=O)C(O)c1ccccc1 WXVL_AK00504SB0168 [1,1,0,0,0,0|1,0,0]=3 1145 B14R1.166 CCCNC(=O)C(O)c1ccccc1 WXVL_AK00504SB0168 [1,1,0,0,0,0|1,0,0]=3 1146 B14R1.166 O=C(NCCF)C(O)c1ccccc1 WXVL_AK00466SB0168 [1,1,0,0,0,0|2,0,0]=4 1147 B14R1.166 O=C(NCCF)C(O)c1ccccc1 WXVL_AK00466SB0168 [1,1,0,0,0,0|2,0,0]=4 1148 B14R1.423 C=C(C)CNC(=O)Cc1ccccc1 WXVL_AK0761SB0092 [1,1,0,0,0,0|1,0,1]=4 1149 B14R1.423 C=C(C)CNC(=O)Cc1ccccc1 WXVL_AK0761SB0092 [1,1,0,0,0,0|1,0,1]=4 1150 B14R1.423 CC(=O)CCC(=O)Nc1ccccc1 WXVL_AG00183SB0072 [1,1,0,0,0,0|1,0,1]=4 1151 B14R1.423 CC(=O)CCC(=O)Nc1ccccc1 WXVL_AG00183SB0072 [1,1,0,0,0,0|1,0,1]=4 1152 B14R1.423 CC(C)CCC(=O)Nc1ccccc1 WXVL_AG00183SB0354 [1,1,0,0,0,0|1,0,0]=3 1153 B14R1.423 CC(C)CCC(=O)Nc1ccccc1 WXVL_AG00183SB0354 [1,1,0,0,0,0|1,0,0]=3 1154 B14R1.423 CC(C)CCC(=O)Nc1ccccn1 WXVL_AF00298SB0354 [1,1,0,0,0,0|2,0,0]=4 1155 B14R1.423 CC(C)CCC(=O)Nc1ccccn1 WXVL_AF00298SB0354 [1,1,0,0,0,0|2,0,0]=4 1156 B14R1.423 CC(C)CNC(=O)Cc1ccccc1 WXVL_AK00544SB0092 [1,1,0,0,0,0|1,0,0]=3 1157 B14R1.423 CC(C)CNC(=O)Cc1ccccc1 WXVL_AK00544SB0092 [1,1,0,0,0,0|1,0,0]=3 1158 B14R1.423 CC(C)CNC(=O)Cc1ccccn1 WXVL_AK00544SA0032 [1,1,0,0,0,0|2,0,0]=4 1159 B14R1.423 CC(C)CNC(=O)Cc1ccccn1 WXVL_AK00544SA0032 [1,1,0,0,0,0|2,0,0]=4 1160 B14R1.423 CC(C)CNC(=O)Cc1cccnc1 WXVL_AK00544SA0029 [1,1,0,0,0,0|2,0,0]=4 1161 B14R1.423 CC(C)CNC(=O)Cc1cccnc1 WXVL_AK00544SA0029 [1,1,0,0,0,0|2,0,0]=4 1162 B14R1.423 CC(C)CNC(=O)Cc1cccnc1 WXVL_AK00544SB00049 [1,1,0,0,0,0|2,0,0]=4 1163 B14R1.423 CC(C)CNC(=O)Cc1cccnc1 WXVL_AK00544SB00049 [1,1,0,0,0,0|2,0,0]=4 1164 B14R1.423 CC(C)CNC(=O)Cc1ccncc1 WXVL_AK00544SA00106 [1,1,0,0,0,0|2,0,0]=4 1165 B14R1.423 CC(C)CNC(=O)Cc1ccncc1 WXVL_AK00544SA00106 [1,1,0,0,0,0|2,0,0]=4 1166 B14R1.423 CC(C)OCC(=O)Nc1ccccc1 WXVL_AG00183SB0213 [1,1,0,0,0,0|2,0,0]=4 1167 B14R1.423 CC(C)OCC(=O)Nc1ccccc1 WXVL_AG00183SB0213 [1,1,0,0,0,0|2,0,0]=4 1168 B14R1.423 CC(O)CNC(=O)Cc1ccccc1 WXVL_AK0052SB0092 [1,1,0,0,0,0|1,0,0]=3 1169 B14R1.423 CC(O)CNC(=O)Cc1ccccc1 WXVL_AK0052SB0092 [1,1,0,0,0,0|1,0,0]=3 1170 B14R1.423 CC(O)CNC(=O)Cc1ccccn1 WXVL_AK0052SA0032 [1,1,0,0,0,0|2,0,0]=4 1171 B14R1.423 CC(O)CNC(=O)Cc1ccccn1 WXVL_AK0052SA0032 [1,1,0,0,0,0|2,0,0]=4 1172 B14R1.423 CC(O)CNC(=O)Cc1cccnc1 WXVL_AK0052SA0029 [1,1,0,0,0,0|2,0,0]=4 1173 B14R1.423 CC(O)CNC(=O)Cc1cccnc1 WXVL_AK0052SA0029 [1,1,0,0,0,0|2,0,0]=4 1174 B14R1.423 CC(O)CNC(=O)Cc1cccnc1 WXVL_AK0052SB00049 [1,1,0,0,0,0|2,0,0]=4 1175 B14R1.423 CC(O)CNC(=O)Cc1cccnc1 WXVL_AK0052SB00049 [1,1,0,0,0,0|2,0,0]=4 1176 B14R1.423 CC(O)CNC(=O)Cc1ccncc1 WXVL_AK0052SA00106 [1,1,0,0,0,0|2,0,0]=4 1177 B14R1.423 CC(O)CNC(=O)Cc1ccncc1 WXVL_AK0052SA00106 [1,1,0,0,0,0|2,0,0]=4 1178 B14R1.423 CN(C)CCC(=O)Nc1ccccc1 WXVL_AG00183SB00052 [1,1,0,0,0,0|2,0,0]=4 1179 B14R1.423 CN(C)CCC(=O)Nc1ccccc1 WXVL_AG00183SB00052 [1,1,0,0,0,0|2,0,0]=4 1180 B14R1.423 C[C@H](O)CNC(=O)Cc1ccccc1 WXVL_AK0113SB0092 [1,1,0,0,0,0|1,0,0]=3 1181 B14R1.423 C[C@H](O)CNC(=O)Cc1ccccc1 WXVL_AK0113SB0092 [1,1,0,0,0,0|1,0,0]=3 1182 B14R1.423 C[C@H](O)CNC(=O)Cc1ccccn1 WXVL_AK0113SA0032 [1,1,0,0,0,0|2,0,0]=4 1183 B14R1.423 C[C@H](O)CNC(=O)Cc1ccccn1 WXVL_AK0113SA0032 [1,1,0,0,0,0|2,0,0]=4 1184 B14R1.423 C[C@H](O)CNC(=O)Cc1cccnc1 WXVL_AK0113SA0029 [1,1,0,0,0,0|2,0,0]=4 1185 B14R1.423 C[C@H](O)CNC(=O)Cc1cccnc1 WXVL_AK0113SA0029 [1,1,0,0,0,0|2,0,0]=4 1186 B14R1.423 C[C@H](O)CNC(=O)Cc1cccnc1 WXVL_AK0113SB00049 [1,1,0,0,0,0|2,0,0]=4 1187 B14R1.423 C[C@H](O)CNC(=O)Cc1cccnc1 WXVL_AK0113SB00049 [1,1,0,0,0,0|2,0,0]=4 1188 B14R1.423 C[C@H](O)CNC(=O)Cc1ccncc1 WXVL_AK0113SA00106 [1,1,0,0,0,0|2,0,0]=4 1189 B14R1.423 C[C@H](O)CNC(=O)Cc1ccncc1 WXVL_AK0113SA00106 [1,1,0,0,0,0|2,0,0]=4 1190 B14R1.423 O=C(Cc1ccccc1)NCC(F)F WXVL_AK0136SB0092 [1,1,0,0,0,0|2,0,0]=4 1191 B14R1.423 O=C(Cc1ccccc1)NCC(F)F WXVL_AK0136SB0092 [1,1,0,0,0,0|2,0,0]=4 1192 B14R1.743 CCC(C)CC(=O)Nc1ccccc1 WXVL_AG00183SB0353 [1,1,0,0,0,0|1,0,0]=3 1193 B14R1.743 CCC(C)CC(=O)Nc1ccccc1 WXVL_AG00183SB0353 [1,1,0,0,0,0|1,0,0]=3 1194 B14R1.743 CCC(C)CC(=O)Nc1ccccn1 WXVL_AF00298SB0353 [1,1,0,0,0,0|2,0,0]=4 1195 B14R1.743 CCC(C)CC(=O)Nc1ccccn1 WXVL_AF00298SB0353 [1,1,0,0,0,0|2,0,0]=4 1196 B14R1.743 CCC(O)CC(=O)Nc1ccccc1 WXVL_AG00183SB4092 [1,1,0,0,0,0|1,0,0]=3 1197 B14R1.743 CCC(O)CC(=O)Nc1ccccc1 WXVL_AG00183SB4092 [1,1,0,0,0,0|1,0,0]=3 1198 B14R1.743 CCC(O)CC(=O)Nc1ccccn1 WXVL_AF00298SB4092 [1,1,0,0,0,0|2,0,0]=4 1199 B14R1.743 CCC(O)CC(=O)Nc1ccccn1 WXVL_AF00298SB4092 [1,1,0,0,0,0|2,0,0]=4 1200 B14R1.743 CC[C@@H](C)CC(=O)Nc1ccccc1 WXVL_AG00183SB8650 [1,1,0,0,0,0|1,0,0]=3 1201 B14R1.743 CC[C@@H](C)CC(=O)Nc1ccccc1 WXVL_AG00183SB8650 [1,1,0,0,0,0|1,0,0]=3 1202 B14R1.743 CC[C@@H](C)CC(=O)Nc1ccccn1 WXVL_AF00298SB8650 [1,1,0,0,0,0|2,0,0]=4 1203 B14R1.743 CC[C@@H](C)CC(=O)Nc1ccccn1 WXVL_AF00298SB8650 [1,1,0,0,0,0|2,0,0]=4 1204 B14R1.743 CC[C@H](C)NC(=O)Cc1ccccc1 WXVL_AK00678SB0092 [1,1,0,0,0,0|1,0,0]=3 1205 B14R1.743 CC[C@H](C)NC(=O)Cc1ccccc1 WXVL_AK00678SB0092 [1,1,0,0,0,0|1,0,0]=3 1206 B14R1.743 CC[C@H](C)NC(=O)Cc1ccccn1 WXVL_AK00678SA0032 [1,1,0,0,0,0|2,0,0]=4 1207 B14R1.743 CC[C@H](C)NC(=O)Cc1ccccn1 WXVL_AK00678SA0032 [1,1,0,0,0,0|2,0,0]=4 1208 B14R1.743 CC[C@H](C)NC(=O)Cc1cccnc1 WXVL_AK00678SA0029 [1,1,0,0,0,0|2,0,0]=4 1209 B14R1.743 CC[C@H](C)NC(=O)Cc1cccnc1 WXVL_AK00678SA0029 [1,1,0,0,0,0|2,0,0]=4 1210 B14R1.743 CC[C@H](C)NC(=O)Cc1cccnc1 WXVL_AK00678SB00049 [1,1,0,0,0,0|2,0,0]=4 1211 B14R1.743 CC[C@H](C)NC(=O)Cc1cccnc1 WXVL_AK00678SB00049 [1,1,0,0,0,0|2,0,0]=4 1212 B14R1.743 CC[C@H](C)NC(=O)Cc1ccncc1 WXVL_AK00678SA00106 [1,1,0,0,0,0|2,0,0]=4 1213 B14R1.743 CC[C@H](C)NC(=O)Cc1ccncc1 WXVL_AK00678SA00106 [1,1,0,0,0,0|2,0,0]=4 1214 B14R1.743 C[C@@H](CF)NC(=O)Cc1ccccc1 WXVL_AK00558SB0092 [1,1,0,0,0,0|2,0,0]=4 1215 B14R1.743 C[C@@H](CF)NC(=O)Cc1ccccc1 WXVL_AK00558SB0092 [1,1,0,0,0,0|2,0,0]=4 1216 B14R1.743 C[C@@H](CO)NC(=O)Cc1ccccc1 WXVL_AK0109SB0092 [1,1,0,0,0,0|2,0,0]=4 1217 B14R1.743 C[C@@H](CO)NC(=O)Cc1ccccc1 WXVL_AK0109SB0092 [1,1,0,0,0,0|2,0,0]=4 1218 B14R1.946 CCCNC(=O)Cc1ccccc1Br WXVL_AK00504SB0093 [1,1,0,0,0,0|1,0,0]=3 1219 B14R1.946 CCCNC(=O)Cc1ccccc1Br WXVL_AK00504SB0093 [1,1,0,0,0,0|1,0,0]=3 1220 B14R1.946 CCCNC(=O)Cc1ccccc1C WXVL_AK00504SB0098 [1,1,0,0,0,0|1,0,0]=3 1221 B14R1.946 CCCNC(=O)Cc1ccccc1C WXVL_AK00504SB0098 [1,1,0,0,0,0|1,0,0]=3 1222 B14R1.946 CCCNC(=O)Cc1ccccc1Cl WXVL_AK00504SB0095 [1,1,0,0,0,0|1,0,0]=3 1223 B14R1.946 CCCNC(=O)Cc1ccccc1Cl WXVL_AK00504SB0095 [1,1,0,0,0,0|1,0,0]=3 1224 B14R1.946 CCCNC(=O)Cc1ccccc1F WXVL_AK00504SB0094 [1,1,0,0,0,0|1,0,0]=3 1225 B14R1.946 CCCNC(=O)Cc1ccccc1F WXVL_AK00504SB0094 [1,1,0,0,0,0|1,0,0]=3 1226 B14R1.946 CCCNC(=O)Cc1ccccc1I WXVL_AK00504SB1145 [1,1,0,0,0,0|1,0,0]=3 1227 B14R1.946 CCCNC(=O)Cc1ccccc1I WXVL_AK00504SB1145 [1,1,0,0,0,0|1,0,0]=3 1228 B14R1.946 CCCNC(=O)Cc1ccccc1O WXVL_AK00504SB0400 [1,1,0,0,0,0|1,0,0]=3 1229 B14R1.946 CCCNC(=O)Cc1ccccc1O WXVL_AK00504SB0400 [1,1,0,0,0,0|1,0,0]=3 1230 B14R1.946 CCCNC(=O)Cc1cccnc1Cl WXVL_AK00504SA0056 [1,1,0,0,0,0|2,0,0]=4 1231 B14R1.946 CCCNC(=O)Cc1cccnc1Cl WXVL_AK00504SA0056 [1,1,0,0,0,0|2,0,0]=4 1232 B14R1.946 CCCNC(=O)Nc1ccccc1Br WXVL_AK00504YV0003 [1,1,0,0,0,0|2,0,0]=4 1233 B14R1.946 CCCNC(=O)Nc1ccccc1Br WXVL_AK00504YV0003 [1,1,0,0,0,0|2,0,0]=4 1234 B14R1.946 CCCNC(=O)Nc1ccccc1C WXVL_AK00504YV0013 [1,1,0,0,0,0|2,0,0]=4 1235 B14R1.946 CCCNC(=O)Nc1ccccc1C WXVL_AK00504YV0013 [1,1,0,0,0,0|2,0,0]=4 1236 B14R1.946 CCCNC(=O)Nc1ccccc1Cl WXVL_AK00504YV0007 [1,1,0,0,0,0|2,0,0]=4 1237 B14R1.946 CCCNC(=O)Nc1ccccc1Cl WXVL_AK00504YV0007 [1,1,0,0,0,0|2,0,0]=4 1238 B14R1.946 CCOCC(=O)Nc1ccccc1Br WXVL_AG00180SB0091 [1,1,0,0,0,0|2,0,0]=4 1239 B14R1.946 CCOCC(=O)Nc1ccccc1Br WXVL_AG00180SB0091 [1,1,0,0,0,0|2,0,0]=4 1240 B14R1.946 CCOCC(=O)Nc1ccccc1C WXVL_AG0027SB0091 [1,1,0,0,0,0|2,0,0]=4 1241 B14R1.946 CCOCC(=O)Nc1ccccc1C WXVL_AG0027SB0091 [1,1,0,0,0,0|2,0,0]=4 1242 B14R1.946 CCOCC(=O)Nc1ccccc1Cl WXVL_AG00129SB0091 [1,1,0,0,0,0|2,0,0]=4 1243 B14R1.946 CCOCC(=O)Nc1ccccc1Cl WXVL_AG00129SB0091 [1,1,0,0,0,0|2,0,0]=4 1244 B14R1.946 CCOCC(=O)Nc1ccccc1I WXVL_AG0385SB0091 [1,1,0,0,0,0|2,0,0]=4 1245 B14R1.946 CCOCC(=O)Nc1ccccc1I WXVL_AG0385SB0091 [1,1,0,0,0,0|2,0,0]=4 1246 B14R1.946 CCSCC(=O)Nc1ccccc1Br WXVL_AG00180SB0002 [1,1,0,0,0,0|2,0,0]=4 1247 B14R1.946 CCSCC(=O)Nc1ccccc1Br WXVL_AG00180SB0002 [1,1,0,0,0,0|2,0,0]=4 1248 B14R1.946 CCSCC(=O)Nc1ccccc1C WXVL_AG0027SB0002 [1,1,0,0,0,0|2,0,0]=4 1249 B14R1.946 CCSCC(=O)Nc1ccccc1C WXVL_AG0027SB0002 [1,1,0,0,0,0|2,0,0]=4 1250 B14R1.946 CCSCC(=O)Nc1ccccc1Cl WXVL_AG00129SB0002 [1,1,0,0,0,0|2,0,0]=4 1251 B14R1.946 CCSCC(=O)Nc1ccccc1Cl WXVL_AG00129SB0002 [1,1,0,0,0,0|2,0,0]=4 1252 B14R1.946 CCSCC(=O)Nc1ccccc1I WXVL_AG0385SB0002 [1,1,0,0,0,0|2,0,0]=4 1253 B14R1.946 CCSCC(=O)Nc1ccccc1I WXVL_AG0385SB0002 [1,1,0,0,0,0|2,0,0]=4 1254 B14R1.946 COCCC(=O)Nc1ccccc1Br WXVL_AG00180SB0156 [1,1,0,0,0,0|2,0,0]=4 1255 B14R1.946 COCCC(=O)Nc1ccccc1Br WXVL_AG00180SB0156 [1,1,0,0,0,0|2,0,0]=4 1256 B14R1.946 COCCC(=O)Nc1ccccc1C WXVL_AG0027SB0156 [1,1,0,0,0,0|2,0,0]=4 1257 B14R1.946 COCCC(=O)Nc1ccccc1C WXVL_AG0027SB0156 [1,1,0,0,0,0|2,0,0]=4 1258 B14R1.946 COCCC(=O)Nc1ccccc1Cl WXVL_AG00129SB0156 [1,1,0,0,0,0|2,0,0]=4 1259 B14R1.946 COCCC(=O)Nc1ccccc1Cl WXVL_AG00129SB0156 [1,1,0,0,0,0|2,0,0]=4 1260 B14R1.946 COCCC(=O)Nc1ccccc1I WXVL_AG0385SB0156 [1,1,0,0,0,0|2,0,0]=4 1261 B14R1.946 COCCC(=O)Nc1ccccc1I WXVL_AG0385SB0156 [1,1,0,0,0,0|2,0,0]=4 1262 B14R1.946 CSCCC(=O)Nc1ccccc1Br WXVL_AG00180SB0361 [1,1,0,0,0,0|2,0,0]=4 1263 B14R1.946 CSCCC(=O)Nc1ccccc1Br WXVL_AG00180SB0361 [1,1,0,0,0,0|2,0,0]=4 1264 B14R1.946 CSCCC(=O)Nc1ccccc1C WXVL_AG0027SB0361 [1,1,0,0,0,0|2,0,0]=4 1265 B14R1.946 CSCCC(=O)Nc1ccccc1C WXVL_AG0027SB0361 [1,1,0,0,0,0|2,0,0]=4 1266 B14R1.946 CSCCC(=O)Nc1ccccc1Cl WXVL_AG00129SB0361 [1,1,0,0,0,0|2,0,0]=4 1267 B14R1.946 CSCCC(=O)Nc1ccccc1Cl WXVL_AG00129SB0361 [1,1,0,0,0,0|2,0,0]=4 1268 B14R1.946 CSCCC(=O)Nc1ccccc1I WXVL_AG0385SB0361 [1,1,0,0,0,0|2,0,0]=4 1269 B14R1.946 CSCCC(=O)Nc1ccccc1I WXVL_AG0385SB0361 [1,1,0,0,0,0|2,0,0]=4 1270 B14R1.946 Cc1ccccc1CC(=O)NCCF WXVL_AK00466SB0098 [1,1,0,0,0,0|2,0,0]=4 1271 B14R1.946 Cc1ccccc1CC(=O)NCCF WXVL_AK00466SB0098 [1,1,0,0,0,0|2,0,0]=4 1272 B14R1.946 O=C(Cc1ccccc1Br)NCCF WXVL_AK00466SB0093 [1,1,0,0,0,0|2,0,0]=4 1273 B14R1.946 O=C(Cc1ccccc1Br)NCCF WXVL_AK00466SB0093 [1,1,0,0,0,0|2,0,0]=4 1274 B14R1.946 O=C(Cc1ccccc1Cl)NCCF WXVL_AK00466SB0095 [1,1,0,0,0,0|2,0,0]=4 1275 B14R1.946 O=C(Cc1ccccc1Cl)NCCF WXVL_AK00466SB0095 [1,1,0,0,0,0|2,0,0]=4 1276 B14R1.946 O=C(Cc1ccccc1F)NCCF WXVL_AK00466SB0094 [1,1,0,0,0,0|2,0,0]=4 1277 B14R1.946 O=C(Cc1ccccc1F)NCCF WXVL_AK00466SB0094 [1,1,0,0,0,0|2,0,0]=4 1278 B14R1.946 O=C(Cc1ccccc1I)NCCF WXVL_AK00466SB1145 [1,1,0,0,0,0|2,0,0]=4 1279 B14R1.946 O=C(Cc1ccccc1I)NCCF WXVL_AK00466SB1145 [1,1,0,0,0,0|2,0,0]=4 1280 B14R1.946 O=C(Cc1ccccc1O)NCCF WXVL_AK00466SB0400 [1,1,0,0,0,0|2,0,0]=4 1281 B14R1.946 O=C(Cc1ccccc1O)NCCF WXVL_AK00466SB0400 [1,1,0,0,0,0|2,0,0]=4 1282 B14R1.4528 CCCCS(=O)(=O)Nc1ccccc1 WXVL_AG00183HU0031 [1,1,0,0,0,0|2,0,0]=4 1283 B14R1.4528 CCCCS(=O)(=O)Nc1ccccc1 WXVL_AG00183HU0031 [1,1,0,0,0,0|2,0,0]=4 1284 B14R1.4528 CCCNS(=O)(=O)Cc1ccccc1 WXVL_AK00504HU0025 [1,1,0,0,0,0|2,0,0]=4 1285 B14R1.4528 CCCNS(=O)(=O)Cc1ccccc1 WXVL_AK00504HU0025 [1,1,0,0,0,0|2,0,0]=4 1286 B14R1.19 CCCCNC(=O)c1cc[n+](cc1)[O-] WXVL_AK00588SC0858 [0,1,0,0,1,0|2,0,0]=4 1287 B14R1.19 CCCCNC(=O)c1cc[n+](cc1)[O-] WXVL_AK00588SC0858 [0,1,0,0,1,0|2,0,0]=4 1288 B14R1.19 CCCCNC(=O)c1ccc(=O)[nH]c1 WXVL_AK00588SC2212 [0,1,0,0,1,0|2,0,0]=4 1289 B14R1.19 CCCCNC(=O)c1ccc(=O)[nH]c1 WXVL_AK00588SC2212 [0,1,0,0,1,0|2,0,0]=4 1290 B14R1.19 CCCCNC(=O)c1ccc(=O)oc1 WXVL_AK00588SC0132 [0,1,0,0,1,0|2,0,0]=4 1291 B14R1.19 CCCCNC(=O)c1ccc(=O)oc1 WXVL_AK00588SC0132 [0,1,0,0,1,0|2,0,0]=4 1292 B14R1.19 CCCCNC(=O)c1ccc(cc1)Br WXVL_AK00588SD0060 [0,1,0,0,1,0|1,0,0]=3 1293 B14R1.19 CCCCNC(=O)c1ccc(cc1)Br WXVL_AK00588SD0060 [0,1,0,0,1,0|1,0,0]=3 1294 B14R1.19 CCCCNC(=O)c1ccc(cc1)C WXVL_AK00588SD0078 [0,1,0,0,1,0|1,0,0]=3 1295 B14R1.19 CCCCNC(=O)c1ccc(cc1)C WXVL_AK00588SD0078 [0,1,0,0,1,0|1,0,0]=3 1296 B14R1.19 CCCCNC(=O)c1ccc(cc1)Cl WXVL_AK00588SD0062 [0,1,0,0,1,0|1,0,0]=3 1297 B14R1.19 CCCCNC(=O)c1ccc(cc1)Cl WXVL_AK00588SD0062 [0,1,0,0,1,0|1,0,0]=3 1298 B14R1.19 CCCCNC(=O)c1ccc(cc1)F WXVL_AK00588SD0061 [0,1,0,0,1,0|1,0,0]=3 1299 B14R1.19 CCCCNC(=O)c1ccc(cc1)F WXVL_AK00588SD0061 [0,1,0,0,1,0|1,0,0]=3 1300 B14R1.19 CCCCNC(=O)c1ccc(cc1)I WXVL_AK00588SD0421 [0,1,0,0,1,0|1,0,0]=3 1301 B14R1.19 CCCCNC(=O)c1ccc(cc1)I WXVL_AK00588SD0421 [0,1,0,0,1,0|1,0,0]=3 1302 B14R1.19 CCCCNC(=O)c1ccc(cc1)O WXVL_AK00588SD0069 [0,1,0,0,1,0|1,0,0]=3 1303 B14R1.19 CCCCNC(=O)c1ccc(cc1)O WXVL_AK00588SD0069 [0,1,0,0,1,0|1,0,0]=3 1304 B14R1.19 CCCCNC(=O)c1ccc(cc1)S WXVL_AK00588SD0154 [0,1,0,0,1,0|1,0,0]=3 1305 B14R1.19 CCCCNC(=O)c1ccc(cc1)S WXVL_AK00588SD0154 [0,1,0,0,1,0|1,0,0]=3 1306 B14R1.19 CCCCNC(=O)c1ccc(cn1)Br WXVL_AK00588SC0363 [0,1,0,0,1,0|2,0,0]=4 1307 B14R1.19 CCCCNC(=O)c1ccc(cn1)Br WXVL_AK00588SC0363 [0,1,0,0,1,0|2,0,0]=4 1308 B14R1.19 CCCCNC(=O)c1ccc(cn1)C WXVL_AK00588SC0104 [0,1,0,0,1,0|2,0,0]=4 1309 B14R1.19 CCCCNC(=O)c1ccc(cn1)C WXVL_AK00588SC0104 [0,1,0,0,1,0|2,0,0]=4 1310 B14R1.19 CCCCNC(=O)c1ccc(cn1)Cl WXVL_AK00588SC0381 [0,1,0,0,1,0|2,0,0]=4 1311 B14R1.19 CCCCNC(=O)c1ccc(cn1)Cl WXVL_AK00588SC0381 [0,1,0,0,1,0|2,0,0]=4 1312 B14R1.19 CCCCNC(=O)c1ccc(cn1)F WXVL_AK00588SC0114 [0,1,0,0,1,0|2,0,0]=4 1313 B14R1.19 CCCCNC(=O)c1ccc(cn1)F WXVL_AK00588SC0114 [0,1,0,0,1,0|2,0,0]=4 1314 B14R1.19 CCCCNC(=O)c1ccc(cn1)O WXVL_AK00588SC0130 [0,1,0,0,1,0|2,0,0]=4 1315 B14R1.19 CCCCNC(=O)c1ccc(cn1)O WXVL_AK00588SC0130 [0,1,0,0,1,0|2,0,0]=4 1316 B14R1.19 CCCCNC(=O)c1ccc(nc1)Br WXVL_AK00588SC0352 [0,1,0,0,1,0|2,0,0]=4 1317 B14R1.19 CCCCNC(=O)c1ccc(nc1)Br WXVL_AK00588SC0352 [0,1,0,0,1,0|2,0,0]=4 1318 B14R1.19 CCCCNC(=O)c1ccc(nc1)C WXVL_AK00588SC0060 [0,1,0,0,1,0|2,0,0]=4 1319 B14R1.19 CCCCNC(=O)c1ccc(nc1)C WXVL_AK00588SC0060 [0,1,0,0,1,0|2,0,0]=4 1320 B14R1.19 CCCCNC(=O)c1ccc(nc1)Cl WXVL_AK00588SC0147 [0,1,0,0,1,0|2,0,0]=4 1321 B14R1.19 CCCCNC(=O)c1ccc(nc1)Cl WXVL_AK00588SC0147 [0,1,0,0,1,0|2,0,0]=4 1322 B14R1.19 CCCCNC(=O)c1ccc(nc1)F WXVL_AK00588SC0370 [0,1,0,0,1,0|2,0,0]=4 1323 B14R1.19 CCCCNC(=O)c1ccc(nc1)F WXVL_AK00588SC0370 [0,1,0,0,1,0|2,0,0]=4 1324 B14R1.19 CCCCNC(=O)c1ccc(nc1)O WXVL_AK00588SC0057 [0,1,0,0,1,0|2,0,0]=4 1325 B14R1.19 CCCCNC(=O)c1ccc(nc1)O WXVL_AK00588SC0057 [0,1,0,0,1,0|2,0,0]=4 1326 B14R1.19 CSCCNC(=O)c1ccc(cc1)Br WXVL_AK00440SD0060 [0,1,0,0,1,0|2,0,0]=4 1327 B14R1.19 CSCCNC(=O)c1ccc(cc1)Br WXVL_AK00440SD0060 [0,1,0,0,1,0|2,0,0]=4 1328 B14R1.19 CSCCNC(=O)c1ccc(cc1)C WXVL_AK00440SD0078 [0,1,0,0,1,0|2,0,0]=4 1329 B14R1.19 CSCCNC(=O)c1ccc(cc1)C WXVL_AK00440SD0078 [0,1,0,0,1,0|2,0,0]=4 1330 B14R1.19 CSCCNC(=O)c1ccc(cc1)Cl WXVL_AK00440SD0062 [0,1,0,0,1,0|2,0,0]=4 1331 B14R1.19 CSCCNC(=O)c1ccc(cc1)Cl WXVL_AK00440SD0062 [0,1,0,0,1,0|2,0,0]=4 1332 B14R1.19 CSCCNC(=O)c1ccc(cc1)F WXVL_AK00440SD0061 [0,1,0,0,1,0|2,0,0]=4 1333 B14R1.19 CSCCNC(=O)c1ccc(cc1)F WXVL_AK00440SD0061 [0,1,0,0,1,0|2,0,0]=4 1334 B14R1.19 CSCCNC(=O)c1ccc(cc1)I WXVL_AK00440SD0421 [0,1,0,0,1,0|2,0,0]=4 1335 B14R1.19 CSCCNC(=O)c1ccc(cc1)I WXVL_AK00440SD0421 [0,1,0,0,1,0|2,0,0]=4 1336 B14R1.19 CSCCNC(=O)c1ccc(cc1)O WXVL_AK00440SD0069 [0,1,0,0,1,0|2,0,0]=4 1337 B14R1.19 CSCCNC(=O)c1ccc(cc1)O WXVL_AK00440SD0069 [0,1,0,0,1,0|2,0,0]=4 1338 B14R1.19 CSCCNC(=O)c1ccc(cc1)S WXVL_AK00440SD0154 [0,1,0,0,1,0|2,0,0]=4 1339 B14R1.19 CSCCNC(=O)c1ccc(cc1)S WXVL_AK00440SD0154 [0,1,0,0,1,0|2,0,0]=4 1340 B14R1.19 Cc1ccc(cc1)C(=O)NCCCO WXVL_AK0073SD0078 [0,1,0,0,1,0|2,0,0]=4 1341 B14R1.19 Cc1ccc(cc1)C(=O)NCCCO WXVL_AK0073SD0078 [0,1,0,0,1,0|2,0,0]=4 1342 B14R1.19 O=C(NCCCO)c1ccc(cc1)Br WXVL_AK0073SD0060 [0,1,0,0,1,0|2,0,0]=4 1343 B14R1.19 O=C(NCCCO)c1ccc(cc1)Br WXVL_AK0073SD0060 [0,1,0,0,1,0|2,0,0]=4 1344 B14R1.19 O=C(NCCCO)c1ccc(cc1)Cl WXVL_AK0073SD0062 [0,1,0,0,1,0|2,0,0]=4 1345 B14R1.19 O=C(NCCCO)c1ccc(cc1)Cl WXVL_AK0073SD0062 [0,1,0,0,1,0|2,0,0]=4 1346 B14R1.19 O=C(NCCCO)c1ccc(cc1)F WXVL_AK0073SD0061 [0,1,0,0,1,0|2,0,0]=4 1347 B14R1.19 O=C(NCCCO)c1ccc(cc1)F WXVL_AK0073SD0061 [0,1,0,0,1,0|2,0,0]=4 1348 B14R1.19 O=C(NCCCO)c1ccc(cc1)I WXVL_AK0073SD0421 [0,1,0,0,1,0|2,0,0]=4 1349 B14R1.19 O=C(NCCCO)c1ccc(cc1)I WXVL_AK0073SD0421 [0,1,0,0,1,0|2,0,0]=4 1350 B14R1.19 O=C(NCCCO)c1ccc(cc1)O WXVL_AK0073SD0069 [0,1,0,0,1,0|2,0,0]=4 1351 B14R1.19 O=C(NCCCO)c1ccc(cc1)O WXVL_AK0073SD0069 [0,1,0,0,1,0|2,0,0]=4 1352 B14R1.19 O=C(NCCCO)c1ccc(cc1)S WXVL_AK0073SD0154 [0,1,0,0,1,0|2,0,0]=4 1353 B14R1.19 O=C(NCCCO)c1ccc(cc1)S WXVL_AK0073SD0154 [0,1,0,0,1,0|2,0,0]=4 1354 B14R1.20 CCCCNC(=O)c1cc(=O)cco1 WXVL_AK00588SC0133 [0,1,0,0,1,0|2,0,0]=4 1355 B14R1.20 CCCCNC(=O)c1cc(=O)cco1 WXVL_AK00588SC0133 [0,1,0,0,1,0|2,0,0]=4 1356 B14R1.20 CCCCNC(=O)c1cc(ccn1)Br WXVL_AK00588SC0243 [0,1,0,0,1,0|2,0,0]=4 1357 B14R1.20 CCCCNC(=O)c1cc(ccn1)Br WXVL_AK00588SC0243 [0,1,0,0,1,0|2,0,0]=4 1358 B14R1.20 CCCCNC(=O)c1cc(ccn1)C WXVL_AK00588SC0235 [0,1,0,0,1,0|2,0,0]=4 1359 B14R1.20 CCCCNC(=O)c1cc(ccn1)C WXVL_AK00588SC0235 [0,1,0,0,1,0|2,0,0]=4 1360 B14R1.20 CCCCNC(=O)c1cc(ccn1)Cl WXVL_AK00588SC0373 [0,1,0,0,1,0|2,0,0]=4 1361 B14R1.20 CCCCNC(=O)c1cc(ccn1)Cl WXVL_AK00588SC0373 [0,1,0,0,1,0|2,0,0]=4 1362 B14R1.20 CCCCNC(=O)c1ccc[n+](c1)[O-] WXVL_AK00588SC1039 [0,1,0,0,1,0|2,0,0]=4 1363 B14R1.20 CCCCNC(=O)c1ccc[n+](c1)[O-] WXVL_AK00588SC1039 [0,1,0,0,1,0|2,0,0]=4 1364 B14R1.20 CCCCNC(=O)c1cccc(c1)Br WXVL_AK00588SD0041 [0,1,0,0,1,0|1,0,0]=3 1365 B14R1.20 CCCCNC(=O)c1cccc(c1)Br WXVL_AK00588SD0041 [0,1,0,0,1,0|1,0,0]=3 1366 B14R1.20 CCCCNC(=O)c1cccc(c1)C WXVL_AK00588SD0056 [0,1,0,0,1,0|1,0,0]=3 1367 B14R1.20 CCCCNC(=O)c1cccc(c1)C WXVL_AK00588SD0056 [0,1,0,0,1,0|1,0,0]=3 1368 B14R1.20 CCCCNC(=O)c1cccc(c1)Cl WXVL_AK00588SD0045 [0,1,0,0,1,0|1,0,0]=3 1369 B14R1.20 CCCCNC(=O)c1cccc(c1)Cl WXVL_AK00588SD0045 [0,1,0,0,1,0|1,0,0]=3 1370 B14R1.20 CCCCNC(=O)c1cccc(c1)F WXVL_AK00588SD0043 [0,1,0,0,1,0|1,0,0]=3 1371 B14R1.20 CCCCNC(=O)c1cccc(c1)F WXVL_AK00588SD0043 [0,1,0,0,1,0|1,0,0]=3 1372 B14R1.20 CCCCNC(=O)c1cccc(c1)I WXVL_AK00588SD0405 [0,1,0,0,1,0|1,0,0]=3 1373 B14R1.20 CCCCNC(=O)c1cccc(c1)I WXVL_AK00588SD0405 [0,1,0,0,1,0|1,0,0]=3 1374 B14R1.20 CCCCNC(=O)c1cccc(c1)O WXVL_AK00588SD1724 [0,1,0,0,1,0|1,0,0]=3 1375 B14R1.20 CCCCNC(=O)c1cccc(c1)O WXVL_AK00588SD1724 [0,1,0,0,1,0|1,0,0]=3 1376 B14R1.20 CCCCNC(=O)c1cccc(n1)Br WXVL_AK00588SC0366 [0,1,0,0,1,0|2,0,0]=4 1377 B14R1.20 CCCCNC(=O)c1cccc(n1)Br WXVL_AK00588SC0366 [0,1,0,0,1,0|2,0,0]=4 1378 B14R1.20 CCCCNC(=O)c1cccc(n1)F WXVL_AK00588SC0386 [0,1,0,0,1,0|2,0,0]=4 1379 B14R1.20 CCCCNC(=O)c1cccc(n1)F WXVL_AK00588SC0386 [0,1,0,0,1,0|2,0,0]=4 1380 B14R1.20 CCCCNC(=O)c1cccc(n1)O WXVL_AK00588SC0084 [0,1,0,0,1,0|2,0,0]=4 1381 B14R1.20 CCCCNC(=O)c1cccc(n1)O WXVL_AK00588SC0084 [0,1,0,0,1,0|2,0,0]=4 1382 B14R1.20 CCCCNC(=O)c1ccnc(c1)Br WXVL_AK00588SC0349 [0,1,0,0,1,0|2,0,0]=4 1383 B14R1.20 CCCCNC(=O)c1ccnc(c1)Br WXVL_AK00588SC0349 [0,1,0,0,1,0|2,0,0]=4 1384 B14R1.20 CCCCNC(=O)c1ccnc(c1)C WXVL_AK00588SC0400 [0,1,0,0,1,0|2,0,0]=4 1385 B14R1.20 CCCCNC(=O)c1ccnc(c1)C WXVL_AK00588SC0400 [0,1,0,0,1,0|2,0,0]=4 1386 B14R1.20 CCCCNC(=O)c1ccnc(c1)Cl WXVL_AK00588SC0083 [0,1,0,0,1,0|2,0,0]=4 1387 B14R1.20 CCCCNC(=O)c1ccnc(c1)Cl WXVL_AK00588SC0083 [0,1,0,0,1,0|2,0,0]=4 1388 B14R1.20 CCCCNC(=O)c1ccnc(c1)F WXVL_AK00588SC0015 [0,1,0,0,1,0|2,0,0]=4 1389 B14R1.20 CCCCNC(=O)c1ccnc(c1)F WXVL_AK00588SC0015 [0,1,0,0,1,0|2,0,0]=4 1390 B14R1.20 CCCCNC(=O)c1ccnc(c1)O WXVL_AK00588SC0131 [0,1,0,0,1,0|2,0,0]=4 1391 B14R1.20 CCCCNC(=O)c1ccnc(c1)O WXVL_AK00588SC0131 [0,1,0,0,1,0|2,0,0]=4 1392 B14R1.20 CCCCNC(=O)c1cncc(c1)Br WXVL_AK00588SC0369 [0,1,0,0,1,0|2,0,0]=4 1393 B14R1.20 CCCCNC(=O)c1cncc(c1)Br WXVL_AK00588SC0369 [0,1,0,0,1,0|2,0,0]=4 1394 B14R1.20 CCCCNC(=O)c1cncc(c1)C WXVL_AK00588SC0095 [0,1,0,0,1,0|2,0,0]=4 1395 B14R1.20 CCCCNC(=O)c1cncc(c1)C WXVL_AK00588SC0095 [0,1,0,0,1,0|2,0,0]=4 1396 B14R1.20 CCCCNC(=O)c1cncc(c1)Cl WXVL_AK00588SC0291 [0,1,0,0,1,0|2,0,0]=4 1397 B14R1.20 CCCCNC(=O)c1cncc(c1)Cl WXVL_AK00588SC0291 [0,1,0,0,1,0|2,0,0]=4 1398 B14R1.20 CCCCNC(=O)c1cncc(c1)F WXVL_AK00588SC0102 [0,1,0,0,1,0|2,0,0]=4 1399 B14R1.20 CCCCNC(=O)c1cncc(c1)F WXVL_AK00588SC0102 [0,1,0,0,1,0|2,0,0]=4 1400 B14R1.20 CCCCNC(=O)c1cncc(c1)O WXVL_AK00588SC0333 [0,1,0,0,1,0|2,0,0]=4 1401 B14R1.20 CCCCNC(=O)c1cncc(c1)O WXVL_AK00588SC0333 [0,1,0,0,1,0|2,0,0]=4 1402 B14R1.20 CSCCNC(=O)c1cccc(c1)Br WXVL_AK00440SD0041 [0,1,0,0,1,0|2,0,0]=4 1403 B14R1.20 CSCCNC(=O)c1cccc(c1)Br WXVL_AK00440SD0041 [0,1,0,0,1,0|2,0,0]=4 1404 B14R1.20 CSCCNC(=O)c1cccc(c1)C WXVL_AK00440SD0056 [0,1,0,0,1,0|2,0,0]=4 1405 B14R1.20 CSCCNC(=O)c1cccc(c1)C WXVL_AK00440SD0056 [0,1,0,0,1,0|2,0,0]=4 1406 B14R1.20 CSCCNC(=O)c1cccc(c1)Cl WXVL_AK00440SD0045 [0,1,0,0,1,0|2,0,0]=4 1407 B14R1.20 CSCCNC(=O)c1cccc(c1)Cl WXVL_AK00440SD0045 [0,1,0,0,1,0|2,0,0]=4 1408 B14R1.20 CSCCNC(=O)c1cccc(c1)F WXVL_AK00440SD0043 [0,1,0,0,1,0|2,0,0]=4 1409 B14R1.20 CSCCNC(=O)c1cccc(c1)F WXVL_AK00440SD0043 [0,1,0,0,1,0|2,0,0]=4 1410 B14R1.20 CSCCNC(=O)c1cccc(c1)I WXVL_AK00440SD0405 [0,1,0,0,1,0|2,0,0]=4 1411 B14R1.20 CSCCNC(=O)c1cccc(c1)I WXVL_AK00440SD0405 [0,1,0,0,1,0|2,0,0]=4 1412 B14R1.20 CSCCNC(=O)c1cccc(c1)O WXVL_AK00440SD1724 [0,1,0,0,1,0|2,0,0]=4 1413 B14R1.20 CSCCNC(=O)c1cccc(c1)O WXVL_AK00440SD1724 [0,1,0,0,1,0|2,0,0]=4 1414 B14R1.20 Cc1cccc(c1)C(=O)NCCCO WXVL_AK0073SD0056 [0,1,0,0,1,0|2,0,0]=4 1415 B14R1.20 Cc1cccc(c1)C(=O)NCCCO WXVL_AK0073SD0056 [0,1,0,0,1,0|2,0,0]=4 1416 B14R1.20 O=C(NCCCO)c1cccc(c1)Br WXVL_AK0073SD0041 [0,1,0,0,1,0|2,0,0]=4 1417 B14R1.20 O=C(NCCCO)c1cccc(c1)Br WXVL_AK0073SD0041 [0,1,0,0,1,0|2,0,0]=4 1418 B14R1.20 O=C(NCCCO)c1cccc(c1)Cl WXVL_AK0073SD0045 [0,1,0,0,1,0|2,0,0]=4 1419 B14R1.20 O=C(NCCCO)c1cccc(c1)Cl WXVL_AK0073SD0045 [0,1,0,0,1,0|2,0,0]=4 1420 B14R1.20 O=C(NCCCO)c1cccc(c1)F WXVL_AK0073SD0043 [0,1,0,0,1,0|2,0,0]=4 1421 B14R1.20 O=C(NCCCO)c1cccc(c1)F WXVL_AK0073SD0043 [0,1,0,0,1,0|2,0,0]=4 1422 B14R1.20 O=C(NCCCO)c1cccc(c1)I WXVL_AK0073SD0405 [0,1,0,0,1,0|2,0,0]=4 1423 B14R1.20 O=C(NCCCO)c1cccc(c1)I WXVL_AK0073SD0405 [0,1,0,0,1,0|2,0,0]=4 1424 B14R1.20 O=C(NCCCO)c1cccc(c1)O WXVL_AK0073SD1724 [0,1,0,0,1,0|2,0,0]=4 1425 B14R1.20 O=C(NCCCO)c1cccc(c1)O WXVL_AK0073SD1724 [0,1,0,0,1,0|2,0,0]=4 1426 B14R1.29 CC(CCO)NC(=O)c1ccccc1 WXVL_AK1288SD0001 [0,1,0,0,1,0|2,0,0]=4 1427 B14R1.29 CC(CCO)NC(=O)c1ccccc1 WXVL_AK1288SD0001 [0,1,0,0,1,0|2,0,0]=4 1428 B14R1.29 CCC[C@H](C)NC(=O)c1ccccc1 WXVL_AK00682SD0001 [0,1,0,0,1,0|1,0,0]=3 1429 B14R1.29 CCC[C@H](C)NC(=O)c1ccccc1 WXVL_AK00682SD0001 [0,1,0,0,1,0|1,0,0]=3 1430 B14R1.29 CCC[C@H](C)NC(=O)c1ccccn1 WXVL_AK00682SC0058 [0,1,0,0,1,0|2,0,0]=4 1431 B14R1.29 CCC[C@H](C)NC(=O)c1ccccn1 WXVL_AK00682SC0058 [0,1,0,0,1,0|2,0,0]=4 1432 B14R1.29 CCC[C@H](C)NC(=O)c1cccnc1 WXVL_AK00682SC0061 [0,1,0,0,1,0|2,0,0]=4 1433 B14R1.29 CCC[C@H](C)NC(=O)c1cccnc1 WXVL_AK00682SC0061 [0,1,0,0,1,0|2,0,0]=4 1434 B14R1.29 CCC[C@H](C)NC(=O)c1ccncc1 WXVL_AK00682SC0062 [0,1,0,0,1,0|2,0,0]=4 1435 B14R1.29 CCC[C@H](C)NC(=O)c1ccncc1 WXVL_AK00682SC0062 [0,1,0,0,1,0|2,0,0]=4 1436 B14R1.29 COC[C@@H](C)NC(=O)c1ccccc1 WXVL_AK00613SD0001 [0,1,0,0,1,0|2,0,0]=4 1437 B14R1.29 COC[C@@H](C)NC(=O)c1ccccc1 WXVL_AK00613SD0001 [0,1,0,0,1,0|2,0,0]=4 1438 B14R1.29 COC[C@H](C)NC(=O)c1ccccc1 WXVL_AK0137SD0001 [0,1,0,0,1,0|2,0,0]=4 1439 B14R1.29 COC[C@H](C)NC(=O)c1ccccc1 WXVL_AK0137SD0001 [0,1,0,0,1,0|2,0,0]=4 1440 B14R1.163 CO[C@H](C)CNC(=O)c1ccccc1 WXVL_AK00704SD0001 [0,1,0,0,1,0|2,0,0]=4 1441 B14R1.163 CO[C@H](C)CNC(=O)c1ccccc1 WXVL_AK00704SD0001 [0,1,0,0,1,0|2,0,0]=4 1442 B14R1.163 O=C(NC[C@@H](F)CO)c1ccccc1 WXVL_AK00590SD0001 [0,1,0,0,1,0|2,0,0]=4 1443 B14R1.163 O=C(NC[C@@H](F)CO)c1ccccc1 WXVL_AK00590SD0001 [0,1,0,0,1,0|2,0,0]=4 1444 B14R1.163 O=C(NC[C@H](O)CO)c1ccccc1 WXVL_AK00483SD0001 [0,1,0,0,1,0|2,0,0]=4 1445 B14R1.163 O=C(NC[C@H](O)CO)c1ccccc1 WXVL_AK00483SD0001 [0,1,0,0,1,0|2,0,0]=4 1446 B14R1.420 CC(C)CCNC(=O)c1ccccc1 WXVL_AK0068SD0001 [0,1,0,0,1,0|1,0,0]=3 1447 B14R1.420 CC(C)CCNC(=O)c1ccccc1 WXVL_AK0068SD0001 [0,1,0,0,1,0|1,0,0]=3 1448 B14R1.420 CC(C)CCNC(=O)c1ccccn1 WXVL_AK0068SC0058 [0,1,0,0,1,0|2,0,0]=4 1449 B14R1.420 CC(C)CCNC(=O)c1ccccn1 WXVL_AK0068SC0058 [0,1,0,0,1,0|2,0,0]=4 1450 B14R1.420 CC(C)CCNC(=O)c1cccnc1 WXVL_AK0068SC0061 [0,1,0,0,1,0|2,0,0]=4 1451 B14R1.420 CC(C)CCNC(=O)c1cccnc1 WXVL_AK0068SC0061 [0,1,0,0,1,0|2,0,0]=4 1452 B14R1.420 CC(C)CCNC(=O)c1ccncc1 WXVL_AK0068SC0062 [0,1,0,0,1,0|2,0,0]=4 1453 B14R1.420 CC(C)CCNC(=O)c1ccncc1 WXVL_AK0068SC0062 [0,1,0,0,1,0|2,0,0]=4 1454 B14R1.420 CN(C)CCNC(=O)c1ccccc1 WXVL_AK0058SD0001 [0,1,0,0,1,0|2,0,0]=4 1455 B14R1.420 CN(C)CCNC(=O)c1ccccc1 WXVL_AK0058SD0001 [0,1,0,0,1,0|2,0,0]=4 1456 B14R1.1035 CCCCNC(=O)c1ccccc1Br WXVL_AK00588SD0002 [0,1,0,0,1,0|1,0,0]=3 1457 B14R1.1035 CCCCNC(=O)c1ccccc1Br WXVL_AK00588SD0002 [0,1,0,0,1,0|1,0,0]=3 1458 B14R1.1035 CCCCNC(=O)c1ccccc1C WXVL_AK00588SD0037 [0,1,0,0,1,0|1,0,0]=3 1459 B14R1.1035 CCCCNC(=O)c1ccccc1C WXVL_AK00588SD0037 [0,1,0,0,1,0|1,0,0]=3 1460 B14R1.1035 CCCCNC(=O)c1ccccc1Cl WXVL_AK00588SD0006 [0,1,0,0,1,0|1,0,0]=3 1461 B14R1.1035 CCCCNC(=O)c1ccccc1Cl WXVL_AK00588SD0006 [0,1,0,0,1,0|1,0,0]=3 1462 B14R1.1035 CCCCNC(=O)c1ccccc1F WXVL_AK00588SD0003 [0,1,0,0,1,0|1,0,0]=3 1463 B14R1.1035 CCCCNC(=O)c1ccccc1F WXVL_AK00588SD0003 [0,1,0,0,1,0|1,0,0]=3 1464 B14R1.1035 CCCCNC(=O)c1ccccc1I WXVL_AK00588SD0303 [0,1,0,0,1,0|1,0,0]=3 1465 B14R1.1035 CCCCNC(=O)c1ccccc1I WXVL_AK00588SD0303 [0,1,0,0,1,0|1,0,0]=3 1466 B14R1.1035 CCCCNC(=O)c1ccccc1O WXVL_AK00588SD00056 [0,1,0,0,1,0|1,0,0]=3 1467 B14R1.1035 CCCCNC(=O)c1ccccc1O WXVL_AK00588SD00056 [0,1,0,0,1,0|1,0,0]=3 1468 B14R1.1035 CCCCNC(=O)c1ccccc1S WXVL_AK00588SD0153 [0,1,0,0,1,0|1,0,0]=3 1469 B14R1.1035 CCCCNC(=O)c1ccccc1S WXVL_AK00588SD0153 [0,1,0,0,1,0|1,0,0]=3 1470 B14R1.1035 CCCCNC(=O)c1cccnc1Br WXVL_AK00588SC0367 [0,1,0,0,1,0|2,0,0]=4 1471 B14R1.1035 CCCCNC(=O)c1cccnc1Br WXVL_AK00588SC0367 [0,1,0,0,1,0|2,0,0]=4 1472 B14R1.1035 CCCCNC(=O)c1cccnc1C WXVL_AK00588SC0065 [0,1,0,0,1,0|2,0,0]=4 1473 B14R1.1035 CCCCNC(=O)c1cccnc1C WXVL_AK00588SC0065 [0,1,0,0,1,0|2,0,0]=4 1474 B14R1.1035 CCCCNC(=O)c1cccnc1Cl WXVL_AK00588SC0146 [0,1,0,0,1,0|2,0,0]=4 1475 B14R1.1035 CCCCNC(=O)c1cccnc1Cl WXVL_AK00588SC0146 [0,1,0,0,1,0|2,0,0]=4 1476 B14R1.1035 CCCCNC(=O)c1cccnc1F WXVL_AK00588SC0350 [0,1,0,0,1,0|2,0,0]=4 1477 B14R1.1035 CCCCNC(=O)c1cccnc1F WXVL_AK00588SC0350 [0,1,0,0,1,0|2,0,0]=4 1478 B14R1.1035 CCCCNC(=O)c1cccnc1O WXVL_AK00588SC0063 [0,1,0,0,1,0|2,0,0]=4 1479 B14R1.1035 CCCCNC(=O)c1cccnc1O WXVL_AK00588SC0063 [0,1,0,0,1,0|2,0,0]=4 1480 B14R1.1035 CCCCNC(=O)c1ccncc1Br WXVL_AK00588SC0365 [0,1,0,0,1,0|2,0,0]=4 1481 B14R1.1035 CCCCNC(=O)c1ccncc1Br WXVL_AK00588SC0365 [0,1,0,0,1,0|2,0,0]=4 1482 B14R1.1035 CCCCNC(=O)c1ccncc1Cl WXVL_AK00588SC0375 [0,1,0,0,1,0|2,0,0]=4 1483 B14R1.1035 CCCCNC(=O)c1ccncc1Cl WXVL_AK00588SC0375 [0,1,0,0,1,0|2,0,0]=4 1484 B14R1.1035 CCCCNC(=O)c1ccncc1F WXVL_AK00588SC0320 [0,1,0,0,1,0|2,0,0]=4 1485 B14R1.1035 CCCCNC(=O)c1ccncc1F WXVL_AK00588SC0320 [0,1,0,0,1,0|2,0,0]=4 1486 B14R1.1035 CCCCNC(=O)c1ccncc1O WXVL_AK00588SC0354 [0,1,0,0,1,0|2,0,0]=4 1487 B14R1.1035 CCCCNC(=O)c1ccncc1O WXVL_AK00588SC0354 [0,1,0,0,1,0|2,0,0]=4 1488 B14R1.1035 CCCCNC(=O)c1cnccc1Br WXVL_AK00588SC0500 [0,1,0,0,1,0|2,0,0]=4 1489 B14R1.1035 CCCCNC(=O)c1cnccc1Br WXVL_AK00588SC0500 [0,1,0,0,1,0|2,0,0]=4 1490 B14R1.1035 CCCCNC(=O)c1cnccc1C WXVL_AK00588SC0301 [0,1,0,0,1,0|2,0,0]=4 1491 B14R1.1035 CCCCNC(=O)c1cnccc1C WXVL_AK00588SC0301 [0,1,0,0,1,0|2,0,0]=4 1492 B14R1.1035 CCCCNC(=O)c1cnccc1Cl WXVL_AK00588SC0340 [0,1,0,0,1,0|2,0,0]=4 1493 B14R1.1035 CCCCNC(=O)c1cnccc1Cl WXVL_AK00588SC0340 [0,1,0,0,1,0|2,0,0]=4 1494 B14R1.1035 CCCCNC(=O)c1ncccc1Br WXVL_AK00588SC0501 [0,1,0,0,1,0|2,0,0]=4 1495 B14R1.1035 CCCCNC(=O)c1ncccc1Br WXVL_AK00588SC0501 [0,1,0,0,1,0|2,0,0]=4 1496 B14R1.1035 CCCCNC(=O)c1ncccc1C WXVL_AK00588SC0008 [0,1,0,0,1,0|2,0,0]=4 1497 B14R1.1035 CCCCNC(=O)c1ncccc1C WXVL_AK00588SC0008 [0,1,0,0,1,0|2,0,0]=4 1498 B14R1.1035 CCCCNC(=O)c1ncccc1Cl WXVL_AK00588SC0609 [0,1,0,0,1,0|2,0,0]=4 1499 B14R1.1035 CCCCNC(=O)c1ncccc1Cl WXVL_AK00588SC0609 [0,1,0,0,1,0|2,0,0]=4 1500 B14R1.1035 CCCCNC(=O)c1ncccc1F WXVL_AK00588SC0773 [0,1,0,0,1,0|2,0,0]=4 1501 B14R1.1035 CCCCNC(=O)c1ncccc1F WXVL_AK00588SC0773 [0,1,0,0,1,0|2,0,0]=4 1502 B14R1.1035 CSCCNC(=O)c1ccccc1Br WXVL_AK00440SD0002 [0,1,0,0,1,0|2,0,0]=4 1503 B14R1.1035 CSCCNC(=O)c1ccccc1Br WXVL_AK00440SD0002 [0,1,0,0,1,0|2,0,0]=4 1504 B14R1.1035 CSCCNC(=O)c1ccccc1C WXVL_AK00440SD0037 [0,1,0,0,1,0|2,0,0]=4 1505 B14R1.1035 CSCCNC(=O)c1ccccc1C WXVL_AK00440SD0037 [0,1,0,0,1,0|2,0,0]=4 1506 B14R1.1035 CSCCNC(=O)c1ccccc1Cl WXVL_AK00440SD0006 [0,1,0,0,1,0|2,0,0]=4 1507 B14R1.1035 CSCCNC(=O)c1ccccc1Cl WXVL_AK00440SD0006 [0,1,0,0,1,0|2,0,0]=4 1508 B14R1.1035 CSCCNC(=O)c1ccccc1F WXVL_AK00440SD0003 [0,1,0,0,1,0|2,0,0]=4 1509 B14R1.1035 CSCCNC(=O)c1ccccc1F WXVL_AK00440SD0003 [0,1,0,0,1,0|2,0,0]=4 1510 B14R1.1035 CSCCNC(=O)c1ccccc1I WXVL_AK00440SD0303 [0,1,0,0,1,0|2,0,0]=4 1511 B14R1.1035 CSCCNC(=O)c1ccccc1I WXVL_AK00440SD0303 [0,1,0,0,1,0|2,0,0]=4 1512 B14R1.1035 CSCCNC(=O)c1ccccc1O WXVL_AK00440SD00056 [0,1,0,0,1,0|2,0,0]=4 1513 B14R1.1035 CSCCNC(=O)c1ccccc1O WXVL_AK00440SD00056 [0,1,0,0,1,0|2,0,0]=4 1514 B14R1.1035 CSCCNC(=O)c1ccccc1S WXVL_AK00440SD0153 [0,1,0,0,1,0|2,0,0]=4 1515 B14R1.1035 CSCCNC(=O)c1ccccc1S WXVL_AK00440SD0153 [0,1,0,0,1,0|2,0,0]=4 1516 B14R1.1035 Cc1ccccc1C(=O)NCCCO WXVL_AK0073SD0037 [0,1,0,0,1,0|2,0,0]=4 1517 B14R1.1035 Cc1ccccc1C(=O)NCCCO WXVL_AK0073SD0037 [0,1,0,0,1,0|2,0,0]=4 1518 B14R1.1035 O=C(NCCCO)c1ccccc1Br WXVL_AK0073SD0002 [0,1,0,0,1,0|2,0,0]=4 1519 B14R1.1035 O=C(NCCCO)c1ccccc1Br WXVL_AK0073SD0002 [0,1,0,0,1,0|2,0,0]=4 1520 B14R1.1035 O=C(NCCCO)c1ccccc1Cl WXVL_AK0073SD0006 [0,1,0,0,1,0|2,0,0]=4 1521 B14R1.1035 O=C(NCCCO)c1ccccc1Cl WXVL_AK0073SD0006 [0,1,0,0,1,0|2,0,0]=4 1522 B14R1.1035 O=C(NCCCO)c1ccccc1F WXVL_AK0073SD0003 [0,1,0,0,1,0|2,0,0]=4 1523 B14R1.1035 O=C(NCCCO)c1ccccc1F WXVL_AK0073SD0003 [0,1,0,0,1,0|2,0,0]=4 1524 B14R1.1035 O=C(NCCCO)c1ccccc1I WXVL_AK0073SD0303 [0,1,0,0,1,0|2,0,0]=4 1525 B14R1.1035 O=C(NCCCO)c1ccccc1I WXVL_AK0073SD0303 [0,1,0,0,1,0|2,0,0]=4 1526 B14R1.1035 O=C(NCCCO)c1ccccc1O WXVL_AK0073SD00056 [0,1,0,0,1,0|2,0,0]=4 1527 B14R1.1035 O=C(NCCCO)c1ccccc1O WXVL_AK0073SD00056 [0,1,0,0,1,0|2,0,0]=4 1528 B14R1.1035 O=C(NCCCO)c1ccccc1S WXVL_AK0073SD0153 [0,1,0,0,1,0|2,0,0]=4 1529 B14R1.1035 O=C(NCCCO)c1ccccc1S WXVL_AK0073SD0153 [0,1,0,0,1,0|2,0,0]=4 1530 B14R1.92 CCCCCNC(=O)Cc1cccs1 WXVL_AK0076SA0018 [0,1,0,0,1,0|2,0,0]=4 1531 B14R1.92 CCCCCNC(=O)Cc1cccs1 WXVL_AK0076SA0018 [0,1,0,0,1,0|2,0,0]=4 1532 B14R1.92 CCCCCNC(=O)Cc1ccsc1 WXVL_AK0076SA0020 [0,1,0,0,1,0|2,0,0]=4 1533 B14R1.92 CCCCCNC(=O)Cc1ccsc1 WXVL_AK0076SA0020 [0,1,0,0,1,0|2,0,0]=4 1534 B14R1.92 CCSCCNC(=O)Cc1cccs1 WXVL_AK00494SA0018 [0,1,0,0,1,0|2,0,0]=4 1535 B14R1.92 CCSCCNC(=O)Cc1cccs1 WXVL_AK00494SA0018 [0,1,0,0,1,0|2,0,0]=4 1536 B14R1.92 CCSCCNC(=O)Cc1ccsc1 WXVL_AK00494SA0020 [0,1,0,0,1,0|2,0,0]=4 1537 B14R1.92 CCSCCNC(=O)Cc1ccsc1 WXVL_AK00494SA0020 [0,1,0,0,1,0|2,0,0]=4 1538 B14R1.92 COCCCNC(=O)Cc1cccs1 WXVL_AK00637SA0018 [0,1,0,0,1,0|2,0,0]=4 1539 B14R1.92 COCCCNC(=O)Cc1cccs1 WXVL_AK00637SA0018 [0,1,0,0,1,0|2,0,0]=4 1540 B14R1.92 COCCCNC(=O)Cc1ccsc1 WXVL_AK00637SA0020 [0,1,0,0,1,0|2,0,0]=4 1541 B14R1.92 COCCCNC(=O)Cc1ccsc1 WXVL_AK00637SA0020 [0,1,0,0,1,0|2,0,0]=4 1542 B14R1.92 CSCCCNC(=O)Cc1cccs1 WXVL_AK0965SA0018 [0,1,0,0,1,0|2,0,0]=4 1543 B14R1.92 CSCCCNC(=O)Cc1cccs1 WXVL_AK0965SA0018 [0,1,0,0,1,0|2,0,0]=4 1544 B14R1.92 CSCCCNC(=O)Cc1ccsc1 WXVL_AK0965SA0020 [0,1,0,0,1,0|2,0,0]=4 1545 B14R1.92 CSCCCNC(=O)Cc1ccsc1 WXVL_AK0965SA0020 [0,1,0,0,1,0|2,0,0]=4 1546 B14R1.92 O=C(Cc1cccs1)NCCCCO WXVL_AK0075SA0018 [0,1,0,0,1,0|2,0,0]=4 1547 B14R1.92 O=C(Cc1cccs1)NCCCCO WXVL_AK0075SA0018 [0,1,0,0,1,0|2,0,0]=4 1548 B14R1.92 O=C(Cc1ccsc1)NCCCCO WXVL_AK0075SA0020 [0,1,0,0,1,0|2,0,0]=4 1549 B14R1.92 O=C(Cc1ccsc1)NCCCCO WXVL_AK0075SA0020 [0,1,0,0,1,0|2,0,0]=4 1550 B14R1.107 CCCCNC(=O)C(C)c1cccs1 WXVL_AK00588SA1203 [0,1,0,0,1,0|2,0,0]=4 1551 B14R1.107 CCCCNC(=O)C(C)c1cccs1 WXVL_AK00588SA1203 [0,1,0,0,1,0|2,0,0]=4 1552 B14R1.157 CCCCNC(=O)Cc1cc(cs1)Br WXVL_AK00588SA0181 [0,1,0,0,1,0|2,0,0]=4 1553 B14R1.157 CCCCNC(=O)Cc1cc(cs1)Br WXVL_AK00588SA0181 [0,1,0,0,1,0|2,0,0]=4 1554 B14R1.157 CCCCNC(=O)Cc1ccc(s1)Cl WXVL_AK00588SA0043 [0,1,0,0,1,0|2,0,0]=4 1555 B14R1.157 CCCCNC(=O)Cc1ccc(s1)Cl WXVL_AK00588SA0043 [0,1,0,0,1,0|2,0,0]=4 1556 B14R1.621 CCC[C@H](C)NC(=O)Cc1cccs1 WXVL_AK00682SA0018 [0,1,0,0,1,0|2,0,0]=4 1557 B14R1.621 CCC[C@H](C)NC(=O)Cc1cccs1 WXVL_AK00682SA0018 [0,1,0,0,1,0|2,0,0]=4 1558 B14R1.621 CCC[C@H](C)NC(=O)Cc1ccsc1 WXVL_AK00682SA0020 [0,1,0,0,1,0|2,0,0]=4 1559 B14R1.621 CCC[C@H](C)NC(=O)Cc1ccsc1 WXVL_AK00682SA0020 [0,1,0,0,1,0|2,0,0]=4 1560 B14R1.810 CC(C)CCNC(=O)Cc1cccs1 WXVL_AK0068SA0018 [0,1,0,0,1,0|2,0,0]=4 1561 B14R1.810 CC(C)CCNC(=O)Cc1cccs1 WXVL_AK0068SA0018 [0,1,0,0,1,0|2,0,0]=4 1562 B14R1.810 CC(C)CCNC(=O)Cc1ccsc1 WXVL_AK0068SA0020 [0,1,0,0,1,0|2,0,0]=4 1563 B14R1.810 CC(C)CCNC(=O)Cc1ccsc1 WXVL_AK0068SA0020 [0,1,0,0,1,0|2,0,0]=4 1564 B16R1.35 CC(CC(=O)NCCCO)c1ccccc1 WXVL_AK0073SB0419 [0,1,0,0,0,1|2,0,0]=4 1565 B16R1.35 CC(CC(=O)NCCCO)c1ccccc1 WXVL_AK0073SB0419 [0,1,0,0,0,1|2,0,0]=4 1566 B16R1.35 CCCCNC(=O)CC(C)c1ccccc1 WXVL_AK00588SB0419 [0,1,0,0,0,1|1,0,0]=3 1567 B16R1.35 CCCCNC(=O)CC(C)c1ccccc1 WXVL_AK00588SB0419 [0,1,0,0,0,1|1,0,0]=3 1568 B16R1.35 CCCCNC(=O)CC(O)c1ccccc1 WXVL_AK00588SB2325 [0,1,0,0,0,1|1,0,0]=3 1569 B16R1.35 CCCCNC(=O)CC(O)c1ccccc1 WXVL_AK00588SB2325 [0,1,0,0,0,1|1,0,0]=3 1570 B16R1.35 CCCCNC(=O)NC(=O)c1ccccc1 WXVL_AK00588YV0027 [0,1,0,0,0,1|1,0,1]=4 1571 B16R1.35 CCCCNC(=O)NC(=O)c1ccccc1 WXVL_AK00588YV0027 [0,1,0,0,0,1|1,0,1]=4 1572 B16R1.35 CCCCNC(=O)N[C@@H](C)c1ccccc1 WXVL_AK00588YV0029 [0,1,0,0,0,1|1,0,0]=3 1573 B16R1.35 CCCCNC(=O)N[C@@H](C)c1ccccc1 WXVL_AK00588YV0029 [0,1,0,0,0,1|1,0,0]=3 1574 B16R1.35 CCCCNC(=O)N[C@H](C)c1ccccc1 WXVL_AK00588YV0061 [0,1,0,0,0,1|1,0,0]=3 1575 B16R1.35 CCCCNC(=O)N[C@H](C)c1ccccc1 WXVL_AK00588YV0061 [0,1,0,0,0,1|1,0,0]=3 1576 B16R1.35 CSCCNC(=O)CC(C)c1ccccc1 WXVL_AK00440SB0419 [0,1,0,0,0,1|2,0,0]=4 1577 B16R1.35 CSCCNC(=O)CC(C)c1ccccc1 WXVL_AK00440SB0419 [0,1,0,0,0,1|2,0,0]=4 1578 B16R1.35 CSCCNC(=O)CC(O)c1ccccc1 WXVL_AK00440SB2325 [0,1,0,0,0,1|2,0,0]=4 1579 B16R1.35 CSCCNC(=O)CC(O)c1ccccc1 WXVL_AK00440SB2325 [0,1,0,0,0,1|2,0,0]=4 1580 B16R1.35 CSCCNC(=O)N[C@@H](C)c1ccccc1 WXVL_AK00440YV0029 [0,1,0,0,0,1|2,0,0]=4 1581 B16R1.35 CSCCNC(=O)N[C@@H](C)c1ccccc1 WXVL_AK00440YV0029 [0,1,0,0,0,1|2,0,0]=4 1582 B16R1.35 CSCCNC(=O)N[C@H](C)c1ccccc1 WXVL_AK00440YV0061 [0,1,0,0,0,1|2,0,0]=4 1583 B16R1.35 CSCCNC(=O)N[C@H](C)c1ccccc1 WXVL_AK00440YV0061 [0,1,0,0,0,1|2,0,0]=4 1584 B16R1.35 C[C@@H](NC(=O)NCCCO)c1ccccc1 WXVL_AK0073YV0061 [0,1,0,0,0,1|2,0,0]=4 1585 B16R1.35 C[C@@H](NC(=O)NCCCO)c1ccccc1 WXVL_AK0073YV0061 [0,1,0,0,0,1|2,0,0]=4 1586 B16R1.35 C[C@H](NC(=O)NCCCO)c1ccccc1 WXVL_AK0073YV0029 [0,1,0,0,0,1|2,0,0]=4 1587 B16R1.35 C[C@H](NC(=O)NCCCO)c1ccccc1 WXVL_AK0073YV0029 [0,1,0,0,0,1|2,0,0]=4 1588 B16R1.35 O=C(CC(O)c1ccccc1)NCCCO WXVL_AK0073SB2325 [0,1,0,0,0,1|2,0,0]=4 1589 B16R1.35 O=C(CC(O)c1ccccc1)NCCCO WXVL_AK0073SB2325 [0,1,0,0,0,1|2,0,0]=4 1590 B16R1.51 CCCCNC(=O)/C=C/c1ccc(cc1)O WXVL_AK00588SB0418 [0,1,0,0,0,1|1,0,1]=4 1591 B16R1.51 CCCCNC(=O)/C=C/c1ccc(cc1)O WXVL_AK00588SB0418 [0,1,0,0,0,1|1,0,1]=4 1592 B16R1.51 CCCCNC(=O)C#Cc1ccc(cc1)Cl WXVL_AK00588SB3517 [0,1,0,0,0,1|1,0,1]=4 1593 B16R1.51 CCCCNC(=O)C#Cc1ccc(cc1)Cl WXVL_AK00588SB3517 [0,1,0,0,0,1|1,0,1]=4 1594 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)Br WXVL_AK00588SB1122 [0,1,0,0,0,1|1,0,1]=4 1595 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)Br WXVL_AK00588SB1122 [0,1,0,0,0,1|1,0,1]=4 1596 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)C WXVL_AK00588SB0060 [0,1,0,0,0,1|1,0,1]=4 1597 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)C WXVL_AK00588SB0060 [0,1,0,0,0,1|1,0,1]=4 1598 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00588SB0119 [0,1,0,0,0,1|1,0,1]=4 1599 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00588SB0119 [0,1,0,0,0,1|1,0,1]=4 1600 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)F WXVL_AK00588SB1186 [0,1,0,0,0,1|1,0,1]=4 1601 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)F WXVL_AK00588SB1186 [0,1,0,0,0,1|1,0,1]=4 1602 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)Br WXVL_AK00588SB1166 [0,1,0,0,0,1|1,0,0]=3 1603 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)Br WXVL_AK00588SB1166 [0,1,0,0,0,1|1,0,0]=3 1604 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)C WXVL_AK00588SB0421 [0,1,0,0,0,1|1,0,0]=3 1605 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)C WXVL_AK00588SB0421 [0,1,0,0,0,1|1,0,0]=3 1606 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)F WXVL_AK00588SB1123 [0,1,0,0,0,1|1,0,0]=3 1607 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)F WXVL_AK00588SB1123 [0,1,0,0,0,1|1,0,0]=3 1608 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)O WXVL_AK00588SB2324 [0,1,0,0,0,1|1,0,0]=3 1609 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)O WXVL_AK00588SB2324 [0,1,0,0,0,1|1,0,0]=3 1610 B16R1.51 CCCCNC(=O)CCc1ccc(cn1)C WXVL_AK00588SA0125 [0,1,0,0,0,1|2,0,0]=4 1611 B16R1.51 CCCCNC(=O)CCc1ccc(cn1)C WXVL_AK00588SA0125 [0,1,0,0,0,1|2,0,0]=4 1612 B16R1.51 CCCCNC(=O)CCc1ccc(nc1)C WXVL_AK00588SA0115 [0,1,0,0,0,1|2,0,0]=4 1613 B16R1.51 CCCCNC(=O)CCc1ccc(nc1)C WXVL_AK00588SA0115 [0,1,0,0,0,1|2,0,0]=4 1614 B16R1.51 CCCCNC(=O)CCc1ccc(nc1)F WXVL_AK00588SA0106 [0,1,0,0,0,1|2,0,0]=4 1615 B16R1.51 CCCCNC(=O)CCc1ccc(nc1)F WXVL_AK00588SA0106 [0,1,0,0,0,1|2,0,0]=4 1616 B16R1.51 CCCCNC(=O)COc1ccc(cc1)C WXVL_AK00588SB0138 [0,1,0,0,0,1|1,0,0]=3 1617 B16R1.51 CCCCNC(=O)COc1ccc(cc1)C WXVL_AK00588SB0138 [0,1,0,0,0,1|1,0,0]=3 1618 B16R1.51 CCCCNC(=O)COc1ccc(cc1)F WXVL_AK00588SB0088 [0,1,0,0,0,1|1,0,0]=3 1619 B16R1.51 CCCCNC(=O)COc1ccc(cc1)F WXVL_AK00588SB0088 [0,1,0,0,0,1|1,0,0]=3 1620 B16R1.51 CCCCNC(=O)COc1ccc(cc1)O WXVL_AK00588SB3388 [0,1,0,0,0,1|1,0,0]=3 1621 B16R1.51 CCCCNC(=O)COc1ccc(cc1)O WXVL_AK00588SB3388 [0,1,0,0,0,1|1,0,0]=3 1622 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)C WXVL_AK00588SB0830 [0,1,0,0,0,1|1,0,0]=3 1623 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)C WXVL_AK00588SB0830 [0,1,0,0,0,1|1,0,0]=3 1624 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)C WXVL_AK00588YV0067 [0,1,0,0,0,1|1,0,0]=3 1625 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)C WXVL_AK00588YV0067 [0,1,0,0,0,1|1,0,0]=3 1626 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)Br WXVL_AK00440SB1166 [0,1,0,0,0,1|2,0,0]=4 1627 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)Br WXVL_AK00440SB1166 [0,1,0,0,0,1|2,0,0]=4 1628 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)C WXVL_AK00440SB0421 [0,1,0,0,0,1|2,0,0]=4 1629 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)C WXVL_AK00440SB0421 [0,1,0,0,0,1|2,0,0]=4 1630 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)F WXVL_AK00440SB1123 [0,1,0,0,0,1|2,0,0]=4 1631 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)F WXVL_AK00440SB1123 [0,1,0,0,0,1|2,0,0]=4 1632 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)O WXVL_AK00440SB2324 [0,1,0,0,0,1|2,0,0]=4 1633 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)O WXVL_AK00440SB2324 [0,1,0,0,0,1|2,0,0]=4 1634 B16R1.51 CSCCNC(=O)COc1ccc(cc1)C WXVL_AK00440SB0138 [0,1,0,0,0,1|2,0,0]=4 1635 B16R1.51 CSCCNC(=O)COc1ccc(cc1)C WXVL_AK00440SB0138 [0,1,0,0,0,1|2,0,0]=4 1636 B16R1.51 CSCCNC(=O)COc1ccc(cc1)F WXVL_AK00440SB0088 [0,1,0,0,0,1|2,0,0]=4 1637 B16R1.51 CSCCNC(=O)COc1ccc(cc1)F WXVL_AK00440SB0088 [0,1,0,0,0,1|2,0,0]=4 1638 B16R1.51 CSCCNC(=O)COc1ccc(cc1)O WXVL_AK00440SB3388 [0,1,0,0,0,1|2,0,0]=4 1639 B16R1.51 CSCCNC(=O)COc1ccc(cc1)O WXVL_AK00440SB3388 [0,1,0,0,0,1|2,0,0]=4 1640 B16R1.51 CSCCNC(=O)CSc1ccc(cc1)C WXVL_AK00440SB0830 [0,1,0,0,0,1|2,0,0]=4 1641 B16R1.51 CSCCNC(=O)CSc1ccc(cc1)C WXVL_AK00440SB0830 [0,1,0,0,0,1|2,0,0]=4 1642 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)C WXVL_AK00440YV0067 [0,1,0,0,0,1|2,0,0]=4 1643 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)C WXVL_AK00440YV0067 [0,1,0,0,0,1|2,0,0]=4 1644 B16R1.51 Cc1ccc(cc1)CCC(=O)NCCCO WXVL_AK0073SB0421 [0,1,0,0,0,1|2,0,0]=4 1645 B16R1.51 Cc1ccc(cc1)CCC(=O)NCCCO WXVL_AK0073SB0421 [0,1,0,0,0,1|2,0,0]=4 1646 B16R1.51 Cc1ccc(cc1)CNC(=O)CCCCBr WXVL_AK0048SB3153 [0,1,0,0,0,1|2,0,0]=4 1647 B16R1.51 Cc1ccc(cc1)CNC(=O)CCCCBr WXVL_AK0048SB3153 [0,1,0,0,0,1|2,0,0]=4 1648 B16R1.51 Cc1ccc(cc1)CNC(=O)CCCCCl WXVL_AK0048SB0379 [0,1,0,0,0,1|2,0,0]=4 1649 B16R1.51 Cc1ccc(cc1)CNC(=O)CCCCCl WXVL_AK0048SB0379 [0,1,0,0,0,1|2,0,0]=4 1650 B16R1.51 Cc1ccc(cc1)CNC(=O)NCCCCl WXVL_AK0048YV0130 [0,1,0,0,0,1|2,0,0]=4 1651 B16R1.51 Cc1ccc(cc1)CNC(=O)NCCCCl WXVL_AK0048YV0130 [0,1,0,0,0,1|2,0,0]=4 1652 B16R1.51 Cc1ccc(cc1)CNC(=O)NCCCO WXVL_AK0073YV0067 [0,1,0,0,0,1|2,0,0]=4 1653 B16R1.51 Cc1ccc(cc1)CNC(=O)NCCCO WXVL_AK0073YV0067 [0,1,0,0,0,1|2,0,0]=4 1654 B16R1.51 Cc1ccc(cc1)OCC(=O)NCCCO WXVL_AK0073SB0138 [0,1,0,0,0,1|2,0,0]=4 1655 B16R1.51 Cc1ccc(cc1)OCC(=O)NCCCO WXVL_AK0073SB0138 [0,1,0,0,0,1|2,0,0]=4 1656 B16R1.51 Cc1ccc(cc1)SCC(=O)NCCCO WXVL_AK0073SB0830 [0,1,0,0,0,1|2,0,0]=4 1657 B16R1.51 Cc1ccc(cc1)SCC(=O)NCCCO WXVL_AK0073SB0830 [0,1,0,0,0,1|2,0,0]=4 1658 B16R1.51 O=C(CCCCBr)NCc1ccc(cc1)Br WXVL_AK1474SB3153 [0,1,0,0,0,1|2,0,0]=4 1659 B16R1.51 O=C(CCCCBr)NCc1ccc(cc1)Br WXVL_AK1474SB3153 [0,1,0,0,0,1|2,0,0]=4 1660 B16R1.51 O=C(CCCCBr)NCc1ccc(cc1)Cl WXVL_AK0047SB3153 [0,1,0,0,0,1|2,0,0]=4 1661 B16R1.51 O=C(CCCCBr)NCc1ccc(cc1)Cl WXVL_AK0047SB3153 [0,1,0,0,0,1|2,0,0]=4 1662 B16R1.51 O=C(CCCCBr)NCc1ccc(cc1)F WXVL_AK0046SB3153 [0,1,0,0,0,1|2,0,0]=4 1663 B16R1.51 O=C(CCCCBr)NCc1ccc(cc1)F WXVL_AK0046SB3153 [0,1,0,0,0,1|2,0,0]=4 1664 B16R1.51 O=C(CCCCBr)NCc1ccc(cc1)I WXVL_AK1644SB3153 [0,1,0,0,0,1|2,0,0]=4 1665 B16R1.51 O=C(CCCCBr)NCc1ccc(cc1)I WXVL_AK1644SB3153 [0,1,0,0,0,1|2,0,0]=4 1666 B16R1.51 O=C(CCCCBr)NCc1ccc(cc1)O WXVL_AK0926SB3153 [0,1,0,0,0,1|2,0,0]=4 1667 B16R1.51 O=C(CCCCBr)NCc1ccc(cc1)O WXVL_AK0926SB3153 [0,1,0,0,0,1|2,0,0]=4 1668 B16R1.51 O=C(CCCCCl)NCc1ccc(cc1)Br WXVL_AK1474SB0379 [0,1,0,0,0,1|2,0,0]=4 1669 B16R1.51 O=C(CCCCCl)NCc1ccc(cc1)Br WXVL_AK1474SB0379 [0,1,0,0,0,1|2,0,0]=4 1670 B16R1.51 O=C(CCCCCl)NCc1ccc(cc1)Cl WXVL_AK0047SB0379 [0,1,0,0,0,1|2,0,0]=4 1671 B16R1.51 O=C(CCCCCl)NCc1ccc(cc1)Cl WXVL_AK0047SB0379 [0,1,0,0,0,1|2,0,0]=4 1672 B16R1.51 O=C(CCCCCl)NCc1ccc(cc1)F WXVL_AK0046SB0379 [0,1,0,0,0,1|2,0,0]=4 1673 B16R1.51 O=C(CCCCCl)NCc1ccc(cc1)F WXVL_AK0046SB0379 [0,1,0,0,0,1|2,0,0]=4 1674 B16R1.51 O=C(CCCCCl)NCc1ccc(cc1)I WXVL_AK1644SB0379 [0,1,0,0,0,1|2,0,0]=4 1675 B16R1.51 O=C(CCCCCl)NCc1ccc(cc1)I WXVL_AK1644SB0379 [0,1,0,0,0,1|2,0,0]=4 1676 B16R1.51 O=C(CCCCCl)NCc1ccc(cc1)O WXVL_AK0926SB0379 [0,1,0,0,0,1|2,0,0]=4 1677 B16R1.51 O=C(CCCCCl)NCc1ccc(cc1)O WXVL_AK0926SB0379 [0,1,0,0,0,1|2,0,0]=4 1678 B16R1.51 O=C(CCc1ccc(cc1)Br)NCCCO WXVL_AK0073SB1166 [0,1,0,0,0,1|2,0,0]=4 1679 B16R1.51 O=C(CCc1ccc(cc1)Br)NCCCO WXVL_AK0073SB1166 [0,1,0,0,0,1|2,0,0]=4 1680 B16R1.51 O=C(CCc1ccc(cc1)F)NCCCO WXVL_AK0073SB1123 [0,1,0,0,0,1|2,0,0]=4 1681 B16R1.51 O=C(CCc1ccc(cc1)F)NCCCO WXVL_AK0073SB1123 [0,1,0,0,0,1|2,0,0]=4 1682 B16R1.51 O=C(CCc1ccc(cc1)O)NCCCO WXVL_AK0073SB2324 [0,1,0,0,0,1|2,0,0]=4 1683 B16R1.51 O=C(CCc1ccc(cc1)O)NCCCO WXVL_AK0073SB2324 [0,1,0,0,0,1|2,0,0]=4 1684 B16R1.51 O=C(COc1ccc(cc1)F)NCCCO WXVL_AK0073SB0088 [0,1,0,0,0,1|2,0,0]=4 1685 B16R1.51 O=C(COc1ccc(cc1)F)NCCCO WXVL_AK0073SB0088 [0,1,0,0,0,1|2,0,0]=4 1686 B16R1.51 O=C(COc1ccc(cc1)O)NCCCO WXVL_AK0073SB3388 [0,1,0,0,0,1|2,0,0]=4 1687 B16R1.51 O=C(COc1ccc(cc1)O)NCCCO WXVL_AK0073SB3388 [0,1,0,0,0,1|2,0,0]=4 1688 B16R1.51 O=C(NCCCCl)NCc1ccc(cc1)Br WXVL_AK1474YV0130 [0,1,0,0,0,1|2,0,0]=4 1689 B16R1.51 O=C(NCCCCl)NCc1ccc(cc1)Br WXVL_AK1474YV0130 [0,1,0,0,0,1|2,0,0]=4 1690 B16R1.51 O=C(NCCCCl)NCc1ccc(cc1)Cl WXVL_AK0047YV0130 [0,1,0,0,0,1|2,0,0]=4 1691 B16R1.51 O=C(NCCCCl)NCc1ccc(cc1)Cl WXVL_AK0047YV0130 [0,1,0,0,0,1|2,0,0]=4 1692 B16R1.51 O=C(NCCCCl)NCc1ccc(cc1)F WXVL_AK0046YV0130 [0,1,0,0,0,1|2,0,0]=4 1693 B16R1.51 O=C(NCCCCl)NCc1ccc(cc1)F WXVL_AK0046YV0130 [0,1,0,0,0,1|2,0,0]=4 1694 B16R1.51 O=C(NCCCCl)NCc1ccc(cc1)I WXVL_AK1644YV0130 [0,1,0,0,0,1|2,0,0]=4 1695 B16R1.51 O=C(NCCCCl)NCc1ccc(cc1)I WXVL_AK1644YV0130 [0,1,0,0,0,1|2,0,0]=4 1696 B16R1.51 O=C(NCCCCl)NCc1ccc(cc1)O WXVL_AK0926YV0130 [0,1,0,0,0,1|2,0,0]=4 1697 B16R1.51 O=C(NCCCCl)NCc1ccc(cc1)O WXVL_AK0926YV0130 [0,1,0,0,0,1|2,0,0]=4 1698 B16R1.52 CCCCNC(=O)C=Cc1cccc(c1)Cl WXVL_AK00588SB1601 [0,1,0,0,0,1|1,0,1]=4 1699 B16R1.52 CCCCNC(=O)C=Cc1cccc(c1)Cl WXVL_AK00588SB1601 [0,1,0,0,0,1|1,0,1]=4 1700 B16R1.52 CCCCNC(=O)C=Cc1cccc(c1)O WXVL_AK00588SB0417 [0,1,0,0,0,1|1,0,1]=4 1701 B16R1.52 CCCCNC(=O)C=Cc1cccc(c1)O WXVL_AK00588SB0417 [0,1,0,0,0,1|1,0,1]=4 1702 B16R1.52 CCCCNC(=O)CCc1cc(ccn1)F WXVL_AK00588SA0107 [0,1,0,0,0,1|2,0,0]=4 1703 B16R1.52 CCCCNC(=O)CCc1cc(ccn1)F WXVL_AK00588SA0107 [0,1,0,0,0,1|2,0,0]=4 1704 B16R1.52 CCCCNC(=O)CCc1cccc(c1)Br WXVL_AK00588SB0278 [0,1,0,0,0,1|1,0,0]=3 1705 B16R1.52 CCCCNC(=O)CCc1cccc(c1)Br WXVL_AK00588SB0278 [0,1,0,0,0,1|1,0,0]=3 1706 B16R1.52 CCCCNC(=O)CCc1cccc(c1)C WXVL_AK00588SB1394 [0,1,0,0,0,1|1,0,0]=3 1707 B16R1.52 CCCCNC(=O)CCc1cccc(c1)C WXVL_AK00588SB1394 [0,1,0,0,0,1|1,0,0]=3 1708 B16R1.52 CCCCNC(=O)CCc1cccc(c1)O WXVL_AK00588SB3088 [0,1,0,0,0,1|1,0,0]=3 1709 B16R1.52 CCCCNC(=O)CCc1cccc(c1)O WXVL_AK00588SB3088 [0,1,0,0,0,1|1,0,0]=3 1710 B16R1.52 CCCCNC(=O)CCc1cccc(n1)C WXVL_AK00588SA0044 [0,1,0,0,0,1|2,0,0]=4 1711 B16R1.52 CCCCNC(=O)CCc1cccc(n1)C WXVL_AK00588SA0044 [0,1,0,0,0,1|2,0,0]=4 1712 B16R1.52 CCCCNC(=O)CCc1ccnc(c1)C WXVL_AK00588SA0045 [0,1,0,0,0,1|2,0,0]=4 1713 B16R1.52 CCCCNC(=O)CCc1ccnc(c1)C WXVL_AK00588SA0045 [0,1,0,0,0,1|2,0,0]=4 1714 B16R1.52 CCCCNC(=O)COc1cccc(c1)Cl WXVL_AK00588SB0493 [0,1,0,0,0,1|1,0,0]=3 1715 B16R1.52 CCCCNC(=O)COc1cccc(c1)Cl WXVL_AK00588SB0493 [0,1,0,0,0,1|1,0,0]=3 1716 B16R1.52 CCCCNC(=O)NCc1cccc(c1)C WXVL_AK00588YV0178 [0,1,0,0,0,1|1,0,0]=3 1717 B16R1.52 CCCCNC(=O)NCc1cccc(c1)C WXVL_AK00588YV0178 [0,1,0,0,0,1|1,0,0]=3 1718 B16R1.52 CCCCNC(=O)NCc1cccc(c1)F WXVL_AK00588YV0073 [0,1,0,0,0,1|1,0,0]=3 1719 B16R1.52 CCCCNC(=O)NCc1cccc(c1)F WXVL_AK00588YV0073 [0,1,0,0,0,1|1,0,0]=3 1720 B16R1.52 CSCCNC(=O)CCc1cccc(c1)Br WXVL_AK00440SB0278 [0,1,0,0,0,1|2,0,0]=4 1721 B16R1.52 CSCCNC(=O)CCc1cccc(c1)Br WXVL_AK00440SB0278 [0,1,0,0,0,1|2,0,0]=4 1722 B16R1.52 CSCCNC(=O)CCc1cccc(c1)C WXVL_AK00440SB1394 [0,1,0,0,0,1|2,0,0]=4 1723 B16R1.52 CSCCNC(=O)CCc1cccc(c1)C WXVL_AK00440SB1394 [0,1,0,0,0,1|2,0,0]=4 1724 B16R1.52 CSCCNC(=O)CCc1cccc(c1)O WXVL_AK00440SB3088 [0,1,0,0,0,1|2,0,0]=4 1725 B16R1.52 CSCCNC(=O)CCc1cccc(c1)O WXVL_AK00440SB3088 [0,1,0,0,0,1|2,0,0]=4 1726 B16R1.52 CSCCNC(=O)COc1cccc(c1)Cl WXVL_AK00440SB0493 [0,1,0,0,0,1|2,0,0]=4 1727 B16R1.52 CSCCNC(=O)COc1cccc(c1)Cl WXVL_AK00440SB0493 [0,1,0,0,0,1|2,0,0]=4 1728 B16R1.52 CSCCNC(=O)NCc1cccc(c1)C WXVL_AK00440YV0178 [0,1,0,0,0,1|2,0,0]=4 1729 B16R1.52 CSCCNC(=O)NCc1cccc(c1)C WXVL_AK00440YV0178 [0,1,0,0,0,1|2,0,0]=4 1730 B16R1.52 CSCCNC(=O)NCc1cccc(c1)F WXVL_AK00440YV0073 [0,1,0,0,0,1|2,0,0]=4 1731 B16R1.52 CSCCNC(=O)NCc1cccc(c1)F WXVL_AK00440YV0073 [0,1,0,0,0,1|2,0,0]=4 1732 B16R1.52 Cc1cccc(c1)CCC(=O)NCCCO WXVL_AK0073SB1394 [0,1,0,0,0,1|2,0,0]=4 1733 B16R1.52 Cc1cccc(c1)CCC(=O)NCCCO WXVL_AK0073SB1394 [0,1,0,0,0,1|2,0,0]=4 1734 B16R1.52 Cc1cccc(c1)CNC(=O)CCCCBr WXVL_AK0045SB3153 [0,1,0,0,0,1|2,0,0]=4 1735 B16R1.52 Cc1cccc(c1)CNC(=O)CCCCBr WXVL_AK0045SB3153 [0,1,0,0,0,1|2,0,0]=4 1736 B16R1.52 Cc1cccc(c1)CNC(=O)CCCCCl WXVL_AK0045SB0379 [0,1,0,0,0,1|2,0,0]=4 1737 B16R1.52 Cc1cccc(c1)CNC(=O)CCCCCl WXVL_AK0045SB0379 [0,1,0,0,0,1|2,0,0]=4 1738 B16R1.52 Cc1cccc(c1)CNC(=O)NCCCCl WXVL_AK0045YV0130 [0,1,0,0,0,1|2,0,0]=4 1739 B16R1.52 Cc1cccc(c1)CNC(=O)NCCCCl WXVL_AK0045YV0130 [0,1,0,0,0,1|2,0,0]=4 1740 B16R1.52 Cc1cccc(c1)CNC(=O)NCCCO WXVL_AK0073YV0178 [0,1,0,0,0,1|2,0,0]=4 1741 B16R1.52 Cc1cccc(c1)CNC(=O)NCCCO WXVL_AK0073YV0178 [0,1,0,0,0,1|2,0,0]=4 1742 B16R1.52 O=C(CCCCBr)NCc1cccc(c1)Br WXVL_AK1177SB3153 [0,1,0,0,0,1|2,0,0]=4 1743 B16R1.52 O=C(CCCCBr)NCc1cccc(c1)Br WXVL_AK1177SB3153 [0,1,0,0,0,1|2,0,0]=4 1744 B16R1.52 O=C(CCCCBr)NCc1cccc(c1)Cl WXVL_AK0094SB3153 [0,1,0,0,0,1|2,0,0]=4 1745 B16R1.52 O=C(CCCCBr)NCc1cccc(c1)Cl WXVL_AK0094SB3153 [0,1,0,0,0,1|2,0,0]=4 1746 B16R1.52 O=C(CCCCBr)NCc1cccc(c1)F WXVL_AK0041SB3153 [0,1,0,0,0,1|2,0,0]=4 1747 B16R1.52 O=C(CCCCBr)NCc1cccc(c1)F WXVL_AK0041SB3153 [0,1,0,0,0,1|2,0,0]=4 1748 B16R1.52 O=C(CCCCBr)NCc1cccc(c1)I WXVL_AK1572SB3153 [0,1,0,0,0,1|2,0,0]=4 1749 B16R1.52 O=C(CCCCBr)NCc1cccc(c1)I WXVL_AK1572SB3153 [0,1,0,0,0,1|2,0,0]=4 1750 B16R1.52 O=C(CCCCBr)NCc1cccc(c1)O WXVL_AK0974SB3153 [0,1,0,0,0,1|2,0,0]=4 1751 B16R1.52 O=C(CCCCBr)NCc1cccc(c1)O WXVL_AK0974SB3153 [0,1,0,0,0,1|2,0,0]=4 1752 B16R1.52 O=C(CCCCCl)NCc1cccc(c1)Br WXVL_AK1177SB0379 [0,1,0,0,0,1|2,0,0]=4 1753 B16R1.52 O=C(CCCCCl)NCc1cccc(c1)Br WXVL_AK1177SB0379 [0,1,0,0,0,1|2,0,0]=4 1754 B16R1.52 O=C(CCCCCl)NCc1cccc(c1)Cl WXVL_AK0094SB0379 [0,1,0,0,0,1|2,0,0]=4 1755 B16R1.52 O=C(CCCCCl)NCc1cccc(c1)Cl WXVL_AK0094SB0379 [0,1,0,0,0,1|2,0,0]=4 1756 B16R1.52 O=C(CCCCCl)NCc1cccc(c1)F WXVL_AK0041SB0379 [0,1,0,0,0,1|2,0,0]=4 1757 B16R1.52 O=C(CCCCCl)NCc1cccc(c1)F WXVL_AK0041SB0379 [0,1,0,0,0,1|2,0,0]=4 1758 B16R1.52 O=C(CCCCCl)NCc1cccc(c1)I WXVL_AK1572SB0379 [0,1,0,0,0,1|2,0,0]=4 1759 B16R1.52 O=C(CCCCCl)NCc1cccc(c1)I WXVL_AK1572SB0379 [0,1,0,0,0,1|2,0,0]=4 1760 B16R1.52 O=C(CCCCCl)NCc1cccc(c1)O WXVL_AK0974SB0379 [0,1,0,0,0,1|2,0,0]=4 1761 B16R1.52 O=C(CCCCCl)NCc1cccc(c1)O WXVL_AK0974SB0379 [0,1,0,0,0,1|2,0,0]=4 1762 B16R1.52 O=C(CCc1cccc(c1)Br)NCCCO WXVL_AK0073SB0278 [0,1,0,0,0,1|2,0,0]=4 1763 B16R1.52 O=C(CCc1cccc(c1)Br)NCCCO WXVL_AK0073SB0278 [0,1,0,0,0,1|2,0,0]=4 1764 B16R1.52 O=C(CCc1cccc(c1)O)NCCCO WXVL_AK0073SB3088 [0,1,0,0,0,1|2,0,0]=4 1765 B16R1.52 O=C(CCc1cccc(c1)O)NCCCO WXVL_AK0073SB3088 [0,1,0,0,0,1|2,0,0]=4 1766 B16R1.52 O=C(COc1cccc(c1)Cl)NCCCO WXVL_AK0073SB0493 [0,1,0,0,0,1|2,0,0]=4 1767 B16R1.52 O=C(COc1cccc(c1)Cl)NCCCO WXVL_AK0073SB0493 [0,1,0,0,0,1|2,0,0]=4 1768 B16R1.52 O=C(NCCCCl)NCc1cccc(c1)Br WXVL_AK1177YV0130 [0,1,0,0,0,1|2,0,0]=4 1769 B16R1.52 O=C(NCCCCl)NCc1cccc(c1)Br WXVL_AK1177YV0130 [0,1,0,0,0,1|2,0,0]=4 1770 B16R1.52 O=C(NCCCCl)NCc1cccc(c1)Cl WXVL_AK0094YV0130 [0,1,0,0,0,1|2,0,0]=4 1771 B16R1.52 O=C(NCCCCl)NCc1cccc(c1)Cl WXVL_AK0094YV0130 [0,1,0,0,0,1|2,0,0]=4 1772 B16R1.52 O=C(NCCCCl)NCc1cccc(c1)F WXVL_AK0041YV0130 [0,1,0,0,0,1|2,0,0]=4 1773 B16R1.52 O=C(NCCCCl)NCc1cccc(c1)F WXVL_AK0041YV0130 [0,1,0,0,0,1|2,0,0]=4 1774 B16R1.52 O=C(NCCCCl)NCc1cccc(c1)I WXVL_AK1572YV0130 [0,1,0,0,0,1|2,0,0]=4 1775 B16R1.52 O=C(NCCCCl)NCc1cccc(c1)I WXVL_AK1572YV0130 [0,1,0,0,0,1|2,0,0]=4 1776 B16R1.52 O=C(NCCCCl)NCc1cccc(c1)O WXVL_AK0974YV0130 [0,1,0,0,0,1|2,0,0]=4 1777 B16R1.52 O=C(NCCCCl)NCc1cccc(c1)O WXVL_AK0974YV0130 [0,1,0,0,0,1|2,0,0]=4 1778 B16R1.52 O=C(NCCCO)NCc1cccc(c1)F WXVL_AK0073YV0073 [0,1,0,0,0,1|2,0,0]=4 1779 B16R1.52 O=C(NCCCO)NCc1cccc(c1)F WXVL_AK0073YV0073 [0,1,0,0,0,1|2,0,0]=4 1780 B16R1.608 CC(C)CCCC(=O)NCc1ccccc1 WXVL_AK00502SB1301 [0,1,0,0,0,1|1,0,0]=3 1781 B16R1.608 CC(C)CCCC(=O)NCc1ccccc1 WXVL_AK00502SB1301 [0,1,0,0,0,1|1,0,0]=3 1782 B16R1.608 CC(C)CCCC(=O)NCc1ccccn1 WXVL_AK0018SB1301 [0,1,0,0,0,1|2,0,0]=4 1783 B16R1.608 CC(C)CCCC(=O)NCc1ccccn1 WXVL_AK0018SB1301 [0,1,0,0,0,1|2,0,0]=4 1784 B16R1.608 CC(C)CCCC(=O)NCc1cccnc1 WXVL_AK0020SB1301 [0,1,0,0,0,1|2,0,0]=4 1785 B16R1.608 CC(C)CCCC(=O)NCc1cccnc1 WXVL_AK0020SB1301 [0,1,0,0,0,1|2,0,0]=4 1786 B16R1.608 CC(C)CCCC(=O)NCc1ccncc1 WXVL_AK0021SB1301 [0,1,0,0,0,1|2,0,0]=4 1787 B16R1.608 CC(C)CCCC(=O)NCc1ccncc1 WXVL_AK0021SB1301 [0,1,0,0,0,1|2,0,0]=4 1788 B16R1.608 CC(C)CCNC(=O)/C=C/c1ccccc1 WXVL_AK0068SB0115 [0,1,0,0,0,1|1,0,1]=4 1789 B16R1.608 CC(C)CCNC(=O)/C=C/c1ccccc1 WXVL_AK0068SB0115 [0,1,0,0,0,1|1,0,1]=4 1790 B16R1.608 CC(C)CCNC(=O)C#Cc1ccccc1 WXVL_AK0068SB0114 [0,1,0,0,0,1|1,0,1]=4 1791 B16R1.608 CC(C)CCNC(=O)C#Cc1ccccc1 WXVL_AK0068SB0114 [0,1,0,0,0,1|1,0,1]=4 1792 B16R1.608 CC(C)CCNC(=O)CCc1ccccc1 WXVL_AK0068SB0067 [0,1,0,0,0,1|1,0,0]=3 1793 B16R1.608 CC(C)CCNC(=O)CCc1ccccc1 WXVL_AK0068SB0067 [0,1,0,0,0,1|1,0,0]=3 1794 B16R1.608 CC(C)CCNC(=O)CCc1ccccn1 WXVL_AK0068SA0316 [0,1,0,0,0,1|2,0,0]=4 1795 B16R1.608 CC(C)CCNC(=O)CCc1ccccn1 WXVL_AK0068SA0316 [0,1,0,0,0,1|2,0,0]=4 1796 B16R1.608 CC(C)CCNC(=O)CCc1cccnc1 WXVL_AK0068SA0031 [0,1,0,0,0,1|2,0,0]=4 1797 B16R1.608 CC(C)CCNC(=O)CCc1cccnc1 WXVL_AK0068SA0031 [0,1,0,0,0,1|2,0,0]=4 1798 B16R1.608 CC(C)CCNC(=O)COc1ccccc1 WXVL_AK0068SB0086 [0,1,0,0,0,1|1,0,0]=3 1799 B16R1.608 CC(C)CCNC(=O)COc1ccccc1 WXVL_AK0068SB0086 [0,1,0,0,0,1|1,0,0]=3 1800 B16R1.608 CC(C)CCNC(=O)COc1cccnc1 WXVL_AK0068SA0051 [0,1,0,0,0,1|2,0,0]=4 1801 B16R1.608 CC(C)CCNC(=O)COc1cccnc1 WXVL_AK0068SA0051 [0,1,0,0,0,1|2,0,0]=4 1802 B16R1.608 CC(C)CCNC(=O)CSc1ccccc1 WXVL_AK0068SB0113 [0,1,0,0,0,1|1,0,0]=3 1803 B16R1.608 CC(C)CCNC(=O)CSc1ccccc1 WXVL_AK0068SB0113 [0,1,0,0,0,1|1,0,0]=3 1804 B16R1.608 CC(C)CCNC(=O)CSc1ccncc1 WXVL_AK0068SA0055 [0,1,0,0,0,1|2,0,0]=4 1805 B16R1.608 CC(C)CCNC(=O)CSc1ccncc1 WXVL_AK0068SA0055 [0,1,0,0,0,1|2,0,0]=4 1806 B16R1.608 CN(C)CCCC(=O)NCc1ccccc1 WXVL_AK00502SB00055 [0,1,0,0,0,1|2,0,0]=4 1807 B16R1.608 CN(C)CCCC(=O)NCc1ccccc1 WXVL_AK00502SB00055 [0,1,0,0,0,1|2,0,0]=4 1808 B16R1.608 CN(C)CCNC(=O)CCc1ccccc1 WXVL_AK0058SB0067 [0,1,0,0,0,1|2,0,0]=4 1809 B16R1.608 CN(C)CCNC(=O)CCc1ccccc1 WXVL_AK0058SB0067 [0,1,0,0,0,1|2,0,0]=4 1810 B16R1.608 CN(C)CCNC(=O)COc1ccccc1 WXVL_AK0058SB0086 [0,1,0,0,0,1|2,0,0]=4 1811 B16R1.608 CN(C)CCNC(=O)COc1ccccc1 WXVL_AK0058SB0086 [0,1,0,0,0,1|2,0,0]=4 1812 B16R1.608 CN(C)CCNC(=O)CSc1ccccc1 WXVL_AK0058SB0113 [0,1,0,0,0,1|2,0,0]=4 1813 B16R1.608 CN(C)CCNC(=O)CSc1ccccc1 WXVL_AK0058SB0113 [0,1,0,0,0,1|2,0,0]=4 1814 B16R1.688 C#CCCCNC(=O)CCc1ccccc1 WXVL_AK00218SB0067 [0,1,0,0,0,1|1,0,1]=4 1815 B16R1.688 C#CCCCNC(=O)CCc1ccccc1 WXVL_AK00218SB0067 [0,1,0,0,0,1|1,0,1]=4 1816 B16R1.688 C#CCCCNC(=O)COc1ccccc1 WXVL_AK00218SB0086 [0,1,0,0,0,1|1,0,1]=4 1817 B16R1.688 C#CCCCNC(=O)COc1ccccc1 WXVL_AK00218SB0086 [0,1,0,0,0,1|1,0,1]=4 1818 B16R1.688 C#CCCCNC(=O)CSc1ccccc1 WXVL_AK00218SB0113 [0,1,0,0,0,1|1,0,1]=4 1819 B16R1.688 C#CCCCNC(=O)CSc1ccccc1 WXVL_AK00218SB0113 [0,1,0,0,0,1|1,0,1]=4 1820 B16R1.688 CCCCCNC(=O)/C=C/c1ccccc1 WXVL_AK0076SB0115 [0,1,0,0,0,1|1,0,1]=4 1821 B16R1.688 CCCCCNC(=O)/C=C/c1ccccc1 WXVL_AK0076SB0115 [0,1,0,0,0,1|1,0,1]=4 1822 B16R1.688 CCCCCNC(=O)C#Cc1ccccc1 WXVL_AK0076SB0114 [0,1,0,0,0,1|1,0,1]=4 1823 B16R1.688 CCCCCNC(=O)C#Cc1ccccc1 WXVL_AK0076SB0114 [0,1,0,0,0,1|1,0,1]=4 1824 B16R1.688 CCCCCNC(=O)CCc1ccccc1 WXVL_AK0076SB0067 [0,1,0,0,0,1|1,0,0]=3 1825 B16R1.688 CCCCCNC(=O)CCc1ccccc1 WXVL_AK0076SB0067 [0,1,0,0,0,1|1,0,0]=3 1826 B16R1.688 CCCCCNC(=O)CCc1ccccn1 WXVL_AK0076SA0316 [0,1,0,0,0,1|2,0,0]=4 1827 B16R1.688 CCCCCNC(=O)CCc1ccccn1 WXVL_AK0076SA0316 [0,1,0,0,0,1|2,0,0]=4 1828 B16R1.688 CCCCCNC(=O)CCc1cccnc1 WXVL_AK0076SA0031 [0,1,0,0,0,1|2,0,0]=4 1829 B16R1.688 CCCCCNC(=O)CCc1cccnc1 WXVL_AK0076SA0031 [0,1,0,0,0,1|2,0,0]=4 1830 B16R1.688 CCCCCNC(=O)COc1ccccc1 WXVL_AK0076SB0086 [0,1,0,0,0,1|1,0,0]=3 1831 B16R1.688 CCCCCNC(=O)COc1ccccc1 WXVL_AK0076SB0086 [0,1,0,0,0,1|1,0,0]=3 1832 B16R1.688 CCCCCNC(=O)COc1cccnc1 WXVL_AK0076SA0051 [0,1,0,0,0,1|2,0,0]=4 1833 B16R1.688 CCCCCNC(=O)COc1cccnc1 WXVL_AK0076SA0051 [0,1,0,0,0,1|2,0,0]=4 1834 B16R1.688 CCCCCNC(=O)CSc1ccccc1 WXVL_AK0076SB0113 [0,1,0,0,0,1|1,0,0]=3 1835 B16R1.688 CCCCCNC(=O)CSc1ccccc1 WXVL_AK0076SB0113 [0,1,0,0,0,1|1,0,0]=3 1836 B16R1.688 CCCCCNC(=O)CSc1ccncc1 WXVL_AK0076SA0055 [0,1,0,0,0,1|2,0,0]=4 1837 B16R1.688 CCCCCNC(=O)CSc1ccncc1 WXVL_AK0076SA0055 [0,1,0,0,0,1|2,0,0]=4 1838 B16R1.688 CCSCCNC(=O)/C=C/c1ccccc1 WXVL_AK00494SB0115 [0,1,0,0,0,1|1,0,1]=4 1839 B16R1.688 CCSCCNC(=O)/C=C/c1ccccc1 WXVL_AK00494SB0115 [0,1,0,0,0,1|1,0,1]=4 1840 B16R1.688 CCSCCNC(=O)C#Cc1ccccc1 WXVL_AK00494SB0114 [0,1,0,0,0,1|1,0,1]=4 1841 B16R1.688 CCSCCNC(=O)C#Cc1ccccc1 WXVL_AK00494SB0114 [0,1,0,0,0,1|1,0,1]=4 1842 B16R1.688 CCSCCNC(=O)CCc1ccccc1 WXVL_AK00494SB0067 [0,1,0,0,0,1|1,0,0]=3 1843 B16R1.688 CCSCCNC(=O)CCc1ccccc1 WXVL_AK00494SB0067 [0,1,0,0,0,1|1,0,0]=3 1844 B16R1.688 CCSCCNC(=O)CCc1ccccn1 WXVL_AK00494SA0316 [0,1,0,0,0,1|2,0,0]=4 1845 B16R1.688 CCSCCNC(=O)CCc1ccccn1 WXVL_AK00494SA0316 [0,1,0,0,0,1|2,0,0]=4 1846 B16R1.688 CCSCCNC(=O)CCc1cccnc1 WXVL_AK00494SA0031 [0,1,0,0,0,1|2,0,0]=4 1847 B16R1.688 CCSCCNC(=O)CCc1cccnc1 WXVL_AK00494SA0031 [0,1,0,0,0,1|2,0,0]=4 1848 B16R1.688 CCSCCNC(=O)COc1ccccc1 WXVL_AK00494SB0086 [0,1,0,0,0,1|1,0,0]=3 1849 B16R1.688 CCSCCNC(=O)COc1ccccc1 WXVL_AK00494SB0086 [0,1,0,0,0,1|1,0,0]=3 1850 B16R1.688 CCSCCNC(=O)COc1cccnc1 WXVL_AK00494SA0051 [0,1,0,0,0,1|2,0,0]=4 1851 B16R1.688 CCSCCNC(=O)COc1cccnc1 WXVL_AK00494SA0051 [0,1,0,0,0,1|2,0,0]=4 1852 B16R1.688 CCSCCNC(=O)CSc1ccccc1 WXVL_AK00494SB0113 [0,1,0,0,0,1|1,0,0]=3 1853 B16R1.688 CCSCCNC(=O)CSc1ccccc1 WXVL_AK00494SB0113 [0,1,0,0,0,1|1,0,0]=3 1854 B16R1.688 CCSCCNC(=O)CSc1ccncc1 WXVL_AK00494SA0055 [0,1,0,0,0,1|2,0,0]=4 1855 B16R1.688 CCSCCNC(=O)CSc1ccncc1 WXVL_AK00494SA0055 [0,1,0,0,0,1|2,0,0]=4 1856 B16R1.688 COCCCNC(=O)/C=C/c1ccccc1 WXVL_AK00637SB0115 [0,1,0,0,0,1|1,0,1]=4 1857 B16R1.688 COCCCNC(=O)/C=C/c1ccccc1 WXVL_AK00637SB0115 [0,1,0,0,0,1|1,0,1]=4 1858 B16R1.688 COCCCNC(=O)C#Cc1ccccc1 WXVL_AK00637SB0114 [0,1,0,0,0,1|1,0,1]=4 1859 B16R1.688 COCCCNC(=O)C#Cc1ccccc1 WXVL_AK00637SB0114 [0,1,0,0,0,1|1,0,1]=4 1860 B16R1.688 COCCCNC(=O)CCc1ccccc1 WXVL_AK00637SB0067 [0,1,0,0,0,1|1,0,0]=3 1861 B16R1.688 COCCCNC(=O)CCc1ccccc1 WXVL_AK00637SB0067 [0,1,0,0,0,1|1,0,0]=3 1862 B16R1.688 COCCCNC(=O)CCc1ccccn1 WXVL_AK00637SA0316 [0,1,0,0,0,1|2,0,0]=4 1863 B16R1.688 COCCCNC(=O)CCc1ccccn1 WXVL_AK00637SA0316 [0,1,0,0,0,1|2,0,0]=4 1864 B16R1.688 COCCCNC(=O)CCc1cccnc1 WXVL_AK00637SA0031 [0,1,0,0,0,1|2,0,0]=4 1865 B16R1.688 COCCCNC(=O)CCc1cccnc1 WXVL_AK00637SA0031 [0,1,0,0,0,1|2,0,0]=4 1866 B16R1.688 COCCCNC(=O)COc1ccccc1 WXVL_AK00637SB0086 [0,1,0,0,0,1|1,0,0]=3 1867 B16R1.688 COCCCNC(=O)COc1ccccc1 WXVL_AK00637SB0086 [0,1,0,0,0,1|1,0,0]=3 1868 B16R1.688 COCCCNC(=O)COc1cccnc1 WXVL_AK00637SA0051 [0,1,0,0,0,1|2,0,0]=4 1869 B16R1.688 COCCCNC(=O)COc1cccnc1 WXVL_AK00637SA0051 [0,1,0,0,0,1|2,0,0]=4 1870 B16R1.688 COCCCNC(=O)CSc1ccccc1 WXVL_AK00637SB0113 [0,1,0,0,0,1|1,0,0]=3 1871 B16R1.688 COCCCNC(=O)CSc1ccccc1 WXVL_AK00637SB0113 [0,1,0,0,0,1|1,0,0]=3 1872 B16R1.688 COCCCNC(=O)CSc1ccncc1 WXVL_AK00637SA0055 [0,1,0,0,0,1|2,0,0]=4 1873 B16R1.688 COCCCNC(=O)CSc1ccncc1 WXVL_AK00637SA0055 [0,1,0,0,0,1|2,0,0]=4 1874 B16R1.688 COCCOCC(=O)NCc1ccccc1 WXVL_AK00502SB0159 [0,1,0,0,0,1|1,0,0]=3 1875 B16R1.688 COCCOCC(=O)NCc1ccccc1 WXVL_AK00502SB0159 [0,1,0,0,0,1|1,0,0]=3 1876 B16R1.688 COCCOCC(=O)NCc1ccccn1 WXVL_AK0018SB0159 [0,1,0,0,0,1|2,0,0]=4 1877 B16R1.688 COCCOCC(=O)NCc1ccccn1 WXVL_AK0018SB0159 [0,1,0,0,0,1|2,0,0]=4 1878 B16R1.688 COCCOCC(=O)NCc1cccnc1 WXVL_AK0020SB0159 [0,1,0,0,0,1|2,0,0]=4 1879 B16R1.688 COCCOCC(=O)NCc1cccnc1 WXVL_AK0020SB0159 [0,1,0,0,0,1|2,0,0]=4 1880 B16R1.688 COCCOCC(=O)NCc1ccncc1 WXVL_AK0021SB0159 [0,1,0,0,0,1|2,0,0]=4 1881 B16R1.688 COCCOCC(=O)NCc1ccncc1 WXVL_AK0021SB0159 [0,1,0,0,0,1|2,0,0]=4 1882 B16R1.688 CSCCCNC(=O)/C=C/c1ccccc1 WXVL_AK0965SB0115 [0,1,0,0,0,1|1,0,1]=4 1883 B16R1.688 CSCCCNC(=O)/C=C/c1ccccc1 WXVL_AK0965SB0115 [0,1,0,0,0,1|1,0,1]=4 1884 B16R1.688 CSCCCNC(=O)C#Cc1ccccc1 WXVL_AK0965SB0114 [0,1,0,0,0,1|1,0,1]=4 1885 B16R1.688 CSCCCNC(=O)C#Cc1ccccc1 WXVL_AK0965SB0114 [0,1,0,0,0,1|1,0,1]=4 1886 B16R1.688 CSCCCNC(=O)CCc1ccccc1 WXVL_AK0965SB0067 [0,1,0,0,0,1|1,0,0]=3 1887 B16R1.688 CSCCCNC(=O)CCc1ccccc1 WXVL_AK0965SB0067 [0,1,0,0,0,1|1,0,0]=3 1888 B16R1.688 CSCCCNC(=O)CCc1ccccn1 WXVL_AK0965SA0316 [0,1,0,0,0,1|2,0,0]=4 1889 B16R1.688 CSCCCNC(=O)CCc1ccccn1 WXVL_AK0965SA0316 [0,1,0,0,0,1|2,0,0]=4 1890 B16R1.688 CSCCCNC(=O)CCc1cccnc1 WXVL_AK0965SA0031 [0,1,0,0,0,1|2,0,0]=4 1891 B16R1.688 CSCCCNC(=O)CCc1cccnc1 WXVL_AK0965SA0031 [0,1,0,0,0,1|2,0,0]=4 1892 B16R1.688 CSCCCNC(=O)COc1ccccc1 WXVL_AK0965SB0086 [0,1,0,0,0,1|1,0,0]=3 1893 B16R1.688 CSCCCNC(=O)COc1ccccc1 WXVL_AK0965SB0086 [0,1,0,0,0,1|1,0,0]=3 1894 B16R1.688 CSCCCNC(=O)COc1cccnc1 WXVL_AK0965SA0051 [0,1,0,0,0,1|2,0,0]=4 1895 B16R1.688 CSCCCNC(=O)COc1cccnc1 WXVL_AK0965SA0051 [0,1,0,0,0,1|2,0,0]=4 1896 B16R1.688 CSCCCNC(=O)CSc1ccccc1 WXVL_AK0965SB0113 [0,1,0,0,0,1|1,0,0]=3 1897 B16R1.688 CSCCCNC(=O)CSc1ccccc1 WXVL_AK0965SB0113 [0,1,0,0,0,1|1,0,0]=3 1898 B16R1.688 CSCCCNC(=O)CSc1ccncc1 WXVL_AK0965SA0055 [0,1,0,0,0,1|2,0,0]=4 1899 B16R1.688 CSCCCNC(=O)CSc1ccncc1 WXVL_AK0965SA0055 [0,1,0,0,0,1|2,0,0]=4 1900 B16R1.688 O=C(/C=C/c1ccccc1)NCCCCO WXVL_AK0075SB0115 [0,1,0,0,0,1|1,0,1]=4 1901 B16R1.688 O=C(/C=C/c1ccccc1)NCCCCO WXVL_AK0075SB0115 [0,1,0,0,0,1|1,0,1]=4 1902 B16R1.688 O=C(C#Cc1ccccc1)NCCCCO WXVL_AK0075SB0114 [0,1,0,0,0,1|1,0,1]=4 1903 B16R1.688 O=C(C#Cc1ccccc1)NCCCCO WXVL_AK0075SB0114 [0,1,0,0,0,1|1,0,1]=4 1904 B16R1.688 O=C(CCCCCBr)NCc1ccccc1 WXVL_AK00502SB2192 [0,1,0,0,0,1|1,0,0]=3 1905 B16R1.688 O=C(CCCCCBr)NCc1ccccc1 WXVL_AK00502SB2192 [0,1,0,0,0,1|1,0,0]=3 1906 B16R1.688 O=C(CCCCCBr)NCc1ccccn1 WXVL_AK0018SB2192 [0,1,0,0,0,1|2,0,0]=4 1907 B16R1.688 O=C(CCCCCBr)NCc1ccccn1 WXVL_AK0018SB2192 [0,1,0,0,0,1|2,0,0]=4 1908 B16R1.688 O=C(CCCCCBr)NCc1cccnc1 WXVL_AK0020SB2192 [0,1,0,0,0,1|2,0,0]=4 1909 B16R1.688 O=C(CCCCCBr)NCc1cccnc1 WXVL_AK0020SB2192 [0,1,0,0,0,1|2,0,0]=4 1910 B16R1.688 O=C(CCCCCBr)NCc1ccncc1 WXVL_AK0021SB2192 [0,1,0,0,0,1|2,0,0]=4 1911 B16R1.688 O=C(CCCCCBr)NCc1ccncc1 WXVL_AK0021SB2192 [0,1,0,0,0,1|2,0,0]=4 1912 B16R1.688 O=C(CCCCCO)NCc1ccccc1 WXVL_AK00502SB2973 [0,1,0,0,0,1|1,0,0]=3 1913 B16R1.688 O=C(CCCCCO)NCc1ccccc1 WXVL_AK00502SB2973 [0,1,0,0,0,1|1,0,0]=3 1914 B16R1.688 O=C(CCCCCO)NCc1ccccn1 WXVL_AK0018SB2973 [0,1,0,0,0,1|2,0,0]=4 1915 B16R1.688 O=C(CCCCCO)NCc1ccccn1 WXVL_AK0018SB2973 [0,1,0,0,0,1|2,0,0]=4 1916 B16R1.688 O=C(CCCCCO)NCc1cccnc1 WXVL_AK0020SB2973 [0,1,0,0,0,1|2,0,0]=4 1917 B16R1.688 O=C(CCCCCO)NCc1cccnc1 WXVL_AK0020SB2973 [0,1,0,0,0,1|2,0,0]=4 1918 B16R1.688 O=C(CCCCCO)NCc1ccncc1 WXVL_AK0021SB2973 [0,1,0,0,0,1|2,0,0]=4 1919 B16R1.688 O=C(CCCCCO)NCc1ccncc1 WXVL_AK0021SB2973 [0,1,0,0,0,1|2,0,0]=4 1920 B16R1.688 O=C(CCc1ccccc1)NCCCCO WXVL_AK0075SB0067 [0,1,0,0,0,1|1,0,0]=3 1921 B16R1.688 O=C(CCc1ccccc1)NCCCCO WXVL_AK0075SB0067 [0,1,0,0,0,1|1,0,0]=3 1922 B16R1.688 O=C(CCc1ccccn1)NCCCCO WXVL_AK0075SA0316 [0,1,0,0,0,1|2,0,0]=4 1923 B16R1.688 O=C(CCc1ccccn1)NCCCCO WXVL_AK0075SA0316 [0,1,0,0,0,1|2,0,0]=4 1924 B16R1.688 O=C(CCc1cccnc1)NCCCCO WXVL_AK0075SA0031 [0,1,0,0,0,1|2,0,0]=4 1925 B16R1.688 O=C(CCc1cccnc1)NCCCCO WXVL_AK0075SA0031 [0,1,0,0,0,1|2,0,0]=4 1926 B16R1.688 O=C(COc1ccccc1)NCCCCO WXVL_AK0075SB0086 [0,1,0,0,0,1|1,0,0]=3 1927 B16R1.688 O=C(COc1ccccc1)NCCCCO WXVL_AK0075SB0086 [0,1,0,0,0,1|1,0,0]=3 1928 B16R1.688 O=C(COc1cccnc1)NCCCCO WXVL_AK0075SA0051 [0,1,0,0,0,1|2,0,0]=4 1929 B16R1.688 O=C(COc1cccnc1)NCCCCO WXVL_AK0075SA0051 [0,1,0,0,0,1|2,0,0]=4 1930 B16R1.688 O=C(CSc1ccccc1)NCCCCO WXVL_AK0075SB0113 [0,1,0,0,0,1|1,0,0]=3 1931 B16R1.688 O=C(CSc1ccccc1)NCCCCO WXVL_AK0075SB0113 [0,1,0,0,0,1|1,0,0]=3 1932 B16R1.688 O=C(CSc1ccncc1)NCCCCO WXVL_AK0075SA0055 [0,1,0,0,0,1|2,0,0]=4 1933 B16R1.688 O=C(CSc1ccncc1)NCCCCO WXVL_AK0075SA0055 [0,1,0,0,0,1|2,0,0]=4 1934 B16R1.1216 C=C(Cc1ccccc1)C(=O)NCCCC WXVL_AK00588SB0413 [0,1,0,0,0,1|1,0,0]=3 1935 B16R1.1216 C=C(Cc1ccccc1)C(=O)NCCCC WXVL_AK00588SB0413 [0,1,0,0,0,1|1,0,0]=3 1936 B16R1.1216 C=C(Cc1ccccc1)C(=O)NCCCO WXVL_AK0073SB0413 [0,1,0,0,0,1|2,0,0]=4 1937 B16R1.1216 C=C(Cc1ccccc1)C(=O)NCCCO WXVL_AK0073SB0413 [0,1,0,0,0,1|2,0,0]=4 1938 B16R1.1216 C=C(Cc1ccccc1)C(=O)NCCSC WXVL_AK00440SB0413 [0,1,0,0,0,1|2,0,0]=4 1939 B16R1.1216 C=C(Cc1ccccc1)C(=O)NCCSC WXVL_AK00440SB0413 [0,1,0,0,0,1|2,0,0]=4 1940 B16R1.1216 CC(Cc1ccccc1)C(=O)NCCCO WXVL_AK0073SB3205 [0,1,0,0,0,1|2,0,0]=4 1941 B16R1.1216 CC(Cc1ccccc1)C(=O)NCCCO WXVL_AK0073SB3205 [0,1,0,0,0,1|2,0,0]=4 1942 B16R1.1216 CC(Oc1ccccc1)C(=O)NCCCO WXVL_AK0073SB0426 [0,1,0,0,0,1|2,0,0]=4 1943 B16R1.1216 CC(Oc1ccccc1)C(=O)NCCCO WXVL_AK0073SB0426 [0,1,0,0,0,1|2,0,0]=4 1944 B16R1.1216 CC(Sc1ccccc1)C(=O)NCCCO WXVL_AK0073SB9992 [0,1,0,0,0,1|2,0,0]=4 1945 B16R1.1216 CC(Sc1ccccc1)C(=O)NCCCO WXVL_AK0073SB9992 [0,1,0,0,0,1|2,0,0]=4 1946 B16R1.1216 CCCCNC(=O)C(C)Cc1ccccc1 WXVL_AK00588SB3205 [0,1,0,0,0,1|1,0,0]=3 1947 B16R1.1216 CCCCNC(=O)C(C)Cc1ccccc1 WXVL_AK00588SB3205 [0,1,0,0,0,1|1,0,0]=3 1948 B16R1.1216 CCCCNC(=O)C(C)Cc1ccccn1 WXVL_AK00588SA0686 [0,1,0,0,0,1|2,0,0]=4 1949 B16R1.1216 CCCCNC(=O)C(C)Cc1ccccn1 WXVL_AK00588SA0686 [0,1,0,0,0,1|2,0,0]=4 1950 B16R1.1216 CCCCNC(=O)C(C)Oc1ccccc1 WXVL_AK00588SB0426 [0,1,0,0,0,1|1,0,0]=3 1951 B16R1.1216 CCCCNC(=O)C(C)Oc1ccccc1 WXVL_AK00588SB0426 [0,1,0,0,0,1|1,0,0]=3 1952 B16R1.1216 CCCCNC(=O)C(C)Oc1ccccn1 WXVL_AK00588SA1980 [0,1,0,0,0,1|2,0,0]=4 1953 B16R1.1216 CCCCNC(=O)C(C)Oc1ccccn1 WXVL_AK00588SA1980 [0,1,0,0,0,1|2,0,0]=4 1954 B16R1.1216 CCCCNC(=O)C(C)Sc1ccccc1 WXVL_AK00588SB9992 [0,1,0,0,0,1|1,0,0]=3 1955 B16R1.1216 CCCCNC(=O)C(C)Sc1ccccc1 WXVL_AK00588SB9992 [0,1,0,0,0,1|1,0,0]=3 1956 B16R1.1216 CCCCNC(=O)C(C)Sc1ccccn1 WXVL_AK00588SA1317 [0,1,0,0,0,1|2,0,0]=4 1957 B16R1.1216 CCCCNC(=O)C(C)Sc1ccccn1 WXVL_AK00588SA1317 [0,1,0,0,0,1|2,0,0]=4 1958 B16R1.1216 CCCCNC(=O)[C@@H](C)Oc1ccccc1 WXVL_AK00588SB5803 [0,1,0,0,0,1|1,0,0]=3 1959 B16R1.1216 CCCCNC(=O)[C@@H](C)Oc1ccccc1 WXVL_AK00588SB5803 [0,1,0,0,0,1|1,0,0]=3 1960 B16R1.1216 CCCCOC(=O)[C@H](C)Nc1ccncn1 WXVL_AK1571LP3358 [0,1,0,0,0,1|2,0,0]=4 1961 B16R1.1216 CCCCOC(=O)[C@H](C)Nc1ccncn1 WXVL_AK1571LP3358 [0,1,0,0,0,1|2,0,0]=4 1962 B16R1.1216 CCCCOC(=O)[C@H](C)Nc1ncccn1 WXVL_AK1571LP0002 [0,1,0,0,0,1|2,0,0]=4 1963 B16R1.1216 CCCCOC(=O)[C@H](C)Nc1ncccn1 WXVL_AK1571LP0002 [0,1,0,0,0,1|2,0,0]=4 1964 B16R1.1216 CN(Cc1ccccc1)C(=O)CCCCBr WXVL_AN0033SB3153 [0,1,0,0,0,1|2,0,0]=4 1965 B16R1.1216 CN(Cc1ccccc1)C(=O)CCCCBr WXVL_AN0033SB3153 [0,1,0,0,0,1|2,0,0]=4 1966 B16R1.1216 CN(Cc1ccccc1)C(=O)CCCCCl WXVL_AN0033SB0379 [0,1,0,0,0,1|2,0,0]=4 1967 B16R1.1216 CN(Cc1ccccc1)C(=O)CCCCCl WXVL_AN0033SB0379 [0,1,0,0,0,1|2,0,0]=4 1968 B16R1.1216 CN(Cc1ccccc1)C(=O)NCCCCl WXVL_AN0033YV0130 [0,1,0,0,0,1|2,0,0]=4 1969 B16R1.1216 CN(Cc1ccccc1)C(=O)NCCCCl WXVL_AN0033YV0130 [0,1,0,0,0,1|2,0,0]=4 1970 B16R1.1216 CSCCNC(=O)C(C)Cc1ccccc1 WXVL_AK00440SB3205 [0,1,0,0,0,1|2,0,0]=4 1971 B16R1.1216 CSCCNC(=O)C(C)Cc1ccccc1 WXVL_AK00440SB3205 [0,1,0,0,0,1|2,0,0]=4 1972 B16R1.1216 CSCCNC(=O)C(C)Oc1ccccc1 WXVL_AK00440SB0426 [0,1,0,0,0,1|2,0,0]=4 1973 B16R1.1216 CSCCNC(=O)C(C)Oc1ccccc1 WXVL_AK00440SB0426 [0,1,0,0,0,1|2,0,0]=4 1974 B16R1.1216 CSCCNC(=O)C(C)Sc1ccccc1 WXVL_AK00440SB9992 [0,1,0,0,0,1|2,0,0]=4 1975 B16R1.1216 CSCCNC(=O)C(C)Sc1ccccc1 WXVL_AK00440SB9992 [0,1,0,0,0,1|2,0,0]=4 1976 B16R1.1216 CSCCNC(=O)[C@@H](C)Oc1ccccc1 WXVL_AK00440SB5803 [0,1,0,0,0,1|2,0,0]=4 1977 B16R1.1216 CSCCNC(=O)[C@@H](C)Oc1ccccc1 WXVL_AK00440SB5803 [0,1,0,0,0,1|2,0,0]=4 1978 B16R1.1216 C[C@@H](Oc1ccccc1)C(=O)NCCCO WXVL_AK0073SB5803 [0,1,0,0,0,1|2,0,0]=4 1979 B16R1.1216 C[C@@H](Oc1ccccc1)C(=O)NCCCO WXVL_AK0073SB5803 [0,1,0,0,0,1|2,0,0]=4 1980 B16R1.1343 CO[C@H](C)CNC(=O)CCc1ccccc1 WXVL_AK00704SB0067 [0,1,0,0,0,1|2,0,0]=4 1981 B16R1.1343 CO[C@H](C)CNC(=O)CCc1ccccc1 WXVL_AK00704SB0067 [0,1,0,0,0,1|2,0,0]=4 1982 B16R1.1343 CO[C@H](C)CNC(=O)COc1ccccc1 WXVL_AK00704SB0086 [0,1,0,0,0,1|2,0,0]=4 1983 B16R1.1343 CO[C@H](C)CNC(=O)COc1ccccc1 WXVL_AK00704SB0086 [0,1,0,0,0,1|2,0,0]=4 1984 B16R1.1343 CO[C@H](C)CNC(=O)CSc1ccccc1 WXVL_AK00704SB0113 [0,1,0,0,0,1|2,0,0]=4 1985 B16R1.1343 CO[C@H](C)CNC(=O)CSc1ccccc1 WXVL_AK00704SB0113 [0,1,0,0,0,1|2,0,0]=4 1986 B16R1.1343 O=C(CCc1ccccc1)NC[C@@H](F)CO WXVL_AK00590SB0067 [0,1,0,0,0,1|2,0,0]=4 1987 B16R1.1343 O=C(CCc1ccccc1)NC[C@@H](F)CO WXVL_AK00590SB0067 [0,1,0,0,0,1|2,0,0]=4 1988 B16R1.1343 O=C(CCc1ccccc1)NC[C@H](O)CO WXVL_AK00483SB0067 [0,1,0,0,0,1|2,0,0]=4 1989 B16R1.1343 O=C(CCc1ccccc1)NC[C@H](O)CO WXVL_AK00483SB0067 [0,1,0,0,0,1|2,0,0]=4 1990 B16R1.1343 O=C(COc1ccccc1)NC[C@@H](F)CO WXVL_AK00590SB0086 [0,1,0,0,0,1|2,0,0]=4 1991 B16R1.1343 O=C(COc1ccccc1)NC[C@@H](F)CO WXVL_AK00590SB0086 [0,1,0,0,0,1|2,0,0]=4 1992 B16R1.1343 O=C(COc1ccccc1)NC[C@H](O)CO WXVL_AK00483SB0086 [0,1,0,0,0,1|2,0,0]=4 1993 B16R1.1343 O=C(COc1ccccc1)NC[C@H](O)CO WXVL_AK00483SB0086 [0,1,0,0,0,1|2,0,0]=4 1994 B16R1.1343 O=C(CSc1ccccc1)NC[C@@H](F)CO WXVL_AK00590SB0113 [0,1,0,0,0,1|2,0,0]=4 1995 B16R1.1343 O=C(CSc1ccccc1)NC[C@@H](F)CO WXVL_AK00590SB0113 [0,1,0,0,0,1|2,0,0]=4 1996 B16R1.1343 O=C(CSc1ccccc1)NC[C@H](O)CO WXVL_AK00483SB0113 [0,1,0,0,0,1|2,0,0]=4 1997 B16R1.1343 O=C(CSc1ccccc1)NC[C@H](O)CO WXVL_AK00483SB0113 [0,1,0,0,0,1|2,0,0]=4 1998 B16R1.1516 CCCCC(O)C(=O)NCc1ccccc1 WXVL_AK00502SB3429 [0,1,0,0,0,1|1,0,0]=3 1999 B16R1.1516 CCCCC(O)C(=O)NCc1ccccc1 WXVL_AK00502SB3429 [0,1,0,0,0,1|1,0,0]=3 2000 B16R1.1516 CCCCC(O)C(=O)NCc1ccccn1 WXVL_AK0018SB3429 [0,1,0,0,0,1|2,0,0]=4 2001 B16R1.1516 CCCCC(O)C(=O)NCc1ccccn1 WXVL_AK0018SB3429 [0,1,0,0,0,1|2,0,0]=4 2002 B16R1.1516 CCCCC(O)C(=O)NCc1cccnc1 WXVL_AK0020SB3429 [0,1,0,0,0,1|2,0,0]=4 2003 B16R1.1516 CCCCC(O)C(=O)NCc1cccnc1 WXVL_AK0020SB3429 [0,1,0,0,0,1|2,0,0]=4 2004 B16R1.1516 CCCCC(O)C(=O)NCc1ccncc1 WXVL_AK0021SB3429 [0,1,0,0,0,1|2,0,0]=4 2005 B16R1.1516 CCCCC(O)C(=O)NCc1ccncc1 WXVL_AK0021SB3429 [0,1,0,0,0,1|2,0,0]=4 2006 B16R1.1516 COCCN(C)C(=O)CCc1ccccc1 WXVL_AN0085SB0067 [0,1,0,0,0,1|2,0,0]=4 2007 B16R1.1516 COCCN(C)C(=O)CCc1ccccc1 WXVL_AN0085SB0067 [0,1,0,0,0,1|2,0,0]=4 2008 B16R1.1516 COCCN(C)C(=O)COc1ccccc1 WXVL_AN0085SB0086 [0,1,0,0,0,1|2,0,0]=4 2009 B16R1.1516 COCCN(C)C(=O)COc1ccccc1 WXVL_AN0085SB0086 [0,1,0,0,0,1|2,0,0]=4 2010 B16R1.1516 COCCN(C)C(=O)CSc1ccccc1 WXVL_AN0085SB0113 [0,1,0,0,0,1|2,0,0]=4 2011 B16R1.1516 COCCN(C)C(=O)CSc1ccccc1 WXVL_AN0085SB0113 [0,1,0,0,0,1|2,0,0]=4 2012 B16R1.1570 CC(CCO)NC(=O)CCc1ccccc1 WXVL_AK1288SB0067 [0,1,0,0,0,1|2,0,0]=4 2013 B16R1.1570 CC(CCO)NC(=O)CCc1ccccc1 WXVL_AK1288SB0067 [0,1,0,0,0,1|2,0,0]=4 2014 B16R1.1570 CC(CCO)NC(=O)COc1ccccc1 WXVL_AK1288SB0086 [0,1,0,0,0,1|2,0,0]=4 2015 B16R1.1570 CC(CCO)NC(=O)COc1ccccc1 WXVL_AK1288SB0086 [0,1,0,0,0,1|2,0,0]=4 2016 B16R1.1570 CC(CCO)NC(=O)CSc1ccccc1 WXVL_AK1288SB0113 [0,1,0,0,0,1|2,0,0]=4 2017 B16R1.1570 CC(CCO)NC(=O)CSc1ccccc1 WXVL_AK1288SB0113 [0,1,0,0,0,1|2,0,0]=4 2018 B16R1.1570 CCC[C@H](C)NC(=O)/C=C/c1ccccc1 WXVL_AK00682SB0115 [0,1,0,0,0,1|1,0,1]=4 2019 B16R1.1570 CCC[C@H](C)NC(=O)/C=C/c1ccccc1 WXVL_AK00682SB0115 [0,1,0,0,0,1|1,0,1]=4 2020 B16R1.1570 CCC[C@H](C)NC(=O)C#Cc1ccccc1 WXVL_AK00682SB0114 [0,1,0,0,0,1|1,0,1]=4 2021 B16R1.1570 CCC[C@H](C)NC(=O)C#Cc1ccccc1 WXVL_AK00682SB0114 [0,1,0,0,0,1|1,0,1]=4 2022 B16R1.1570 CCC[C@H](C)NC(=O)CCc1ccccc1 WXVL_AK00682SB0067 [0,1,0,0,0,1|1,0,0]=3 2023 B16R1.1570 CCC[C@H](C)NC(=O)CCc1ccccc1 WXVL_AK00682SB0067 [0,1,0,0,0,1|1,0,0]=3 2024 B16R1.1570 CCC[C@H](C)NC(=O)CCc1ccccn1 WXVL_AK00682SA0316 [0,1,0,0,0,1|2,0,0]=4 2025 B16R1.1570 CCC[C@H](C)NC(=O)CCc1ccccn1 WXVL_AK00682SA0316 [0,1,0,0,0,1|2,0,0]=4 2026 B16R1.1570 CCC[C@H](C)NC(=O)CCc1cccnc1 WXVL_AK00682SA0031 [0,1,0,0,0,1|2,0,0]=4 2027 B16R1.1570 CCC[C@H](C)NC(=O)CCc1cccnc1 WXVL_AK00682SA0031 [0,1,0,0,0,1|2,0,0]=4 2028 B16R1.1570 CCC[C@H](C)NC(=O)COc1ccccc1 WXVL_AK00682SB0086 [0,1,0,0,0,1|1,0,0]=3 2029 B16R1.1570 CCC[C@H](C)NC(=O)COc1ccccc1 WXVL_AK00682SB0086 [0,1,0,0,0,1|1,0,0]=3 2030 B16R1.1570 CCC[C@H](C)NC(=O)COc1cccnc1 WXVL_AK00682SA0051 [0,1,0,0,0,1|2,0,0]=4 2031 B16R1.1570 CCC[C@H](C)NC(=O)COc1cccnc1 WXVL_AK00682SA0051 [0,1,0,0,0,1|2,0,0]=4 2032 B16R1.1570 CCC[C@H](C)NC(=O)CSc1ccccc1 WXVL_AK00682SB0113 [0,1,0,0,0,1|1,0,0]=3 2033 B16R1.1570 CCC[C@H](C)NC(=O)CSc1ccccc1 WXVL_AK00682SB0113 [0,1,0,0,0,1|1,0,0]=3 2034 B16R1.1570 CCC[C@H](C)NC(=O)CSc1ccncc1 WXVL_AK00682SA0055 [0,1,0,0,0,1|2,0,0]=4 2035 B16R1.1570 CCC[C@H](C)NC(=O)CSc1ccncc1 WXVL_AK00682SA0055 [0,1,0,0,0,1|2,0,0]=4 2036 B16R1.1570 COC[C@@H](C)NC(=O)CCc1ccccc1 WXVL_AK00613SB0067 [0,1,0,0,0,1|2,0,0]=4 2037 B16R1.1570 COC[C@@H](C)NC(=O)CCc1ccccc1 WXVL_AK00613SB0067 [0,1,0,0,0,1|2,0,0]=4 2038 B16R1.1570 COC[C@@H](C)NC(=O)COc1ccccc1 WXVL_AK00613SB0086 [0,1,0,0,0,1|2,0,0]=4 2039 B16R1.1570 COC[C@@H](C)NC(=O)COc1ccccc1 WXVL_AK00613SB0086 [0,1,0,0,0,1|2,0,0]=4 2040 B16R1.1570 COC[C@@H](C)NC(=O)CSc1ccccc1 WXVL_AK00613SB0113 [0,1,0,0,0,1|2,0,0]=4 2041 B16R1.1570 COC[C@@H](C)NC(=O)CSc1ccccc1 WXVL_AK00613SB0113 [0,1,0,0,0,1|2,0,0]=4 2042 B16R1.1570 COC[C@H](C)NC(=O)CCc1ccccc1 WXVL_AK0137SB0067 [0,1,0,0,0,1|2,0,0]=4 2043 B16R1.1570 COC[C@H](C)NC(=O)CCc1ccccc1 WXVL_AK0137SB0067 [0,1,0,0,0,1|2,0,0]=4 2044 B16R1.1570 COC[C@H](C)NC(=O)COc1ccccc1 WXVL_AK0137SB0086 [0,1,0,0,0,1|2,0,0]=4 2045 B16R1.1570 COC[C@H](C)NC(=O)COc1ccccc1 WXVL_AK0137SB0086 [0,1,0,0,0,1|2,0,0]=4 2046 B16R1.1570 COC[C@H](C)NC(=O)CSc1ccccc1 WXVL_AK0137SB0113 [0,1,0,0,0,1|2,0,0]=4 2047 B16R1.1570 COC[C@H](C)NC(=O)CSc1ccccc1 WXVL_AK0137SB0113 [0,1,0,0,0,1|2,0,0]=4 2048 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1Br WXVL_AK00588SB3065 [0,1,0,0,0,1|1,0,1]=4 2049 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1Br WXVL_AK00588SB3065 [0,1,0,0,0,1|1,0,1]=4 2050 B16R1.1696 CCCCNC(=O)CCc1ccccc1Br WXVL_AK00588SB1278 [0,1,0,0,0,1|1,0,0]=3 2051 B16R1.1696 CCCCNC(=O)CCc1ccccc1Br WXVL_AK00588SB1278 [0,1,0,0,0,1|1,0,0]=3 2052 B16R1.1696 CCCCNC(=O)CCc1ccccc1C WXVL_AK00588SB0422 [0,1,0,0,0,1|1,0,0]=3 2053 B16R1.1696 CCCCNC(=O)CCc1ccccc1C WXVL_AK00588SB0422 [0,1,0,0,0,1|1,0,0]=3 2054 B16R1.1696 CCCCNC(=O)CCc1ccccc1Cl WXVL_AK00588SB0140 [0,1,0,0,0,1|1,0,0]=3 2055 B16R1.1696 CCCCNC(=O)CCc1ccccc1Cl WXVL_AK00588SB0140 [0,1,0,0,0,1|1,0,0]=3 2056 B16R1.1696 CCCCNC(=O)CCc1ccccc1F WXVL_AK00588SB0008 [0,1,0,0,0,1|1,0,0]=3 2057 B16R1.1696 CCCCNC(=O)CCc1ccccc1F WXVL_AK00588SB0008 [0,1,0,0,0,1|1,0,0]=3 2058 B16R1.1696 CCCCNC(=O)CCc1cccnc1C WXVL_AK00588SA0046 [0,1,0,0,0,1|2,0,0]=4 2059 B16R1.1696 CCCCNC(=O)CCc1cccnc1C WXVL_AK00588SA0046 [0,1,0,0,0,1|2,0,0]=4 2060 B16R1.1696 CCCCNC(=O)CCc1ncccc1C WXVL_AK00588SA0096 [0,1,0,0,0,1|2,0,0]=4 2061 B16R1.1696 CCCCNC(=O)CCc1ncccc1C WXVL_AK00588SA0096 [0,1,0,0,0,1|2,0,0]=4 2062 B16R1.1696 CCCCNC(=O)COc1ccccc1C WXVL_AK00588SB0136 [0,1,0,0,0,1|1,0,0]=3 2063 B16R1.1696 CCCCNC(=O)COc1ccccc1C WXVL_AK00588SB0136 [0,1,0,0,0,1|1,0,0]=3 2064 B16R1.1696 CCCCNC(=O)COc1ccccc1F WXVL_AK00588SB0441 [0,1,0,0,0,1|1,0,0]=3 2065 B16R1.1696 CCCCNC(=O)COc1ccccc1F WXVL_AK00588SB0441 [0,1,0,0,0,1|1,0,0]=3 2066 B16R1.1696 CSCCNC(=O)CCc1ccccc1Br WXVL_AK00440SB1278 [0,1,0,0,0,1|2,0,0]=4 2067 B16R1.1696 CSCCNC(=O)CCc1ccccc1Br WXVL_AK00440SB1278 [0,1,0,0,0,1|2,0,0]=4 2068 B16R1.1696 CSCCNC(=O)CCc1ccccc1C WXVL_AK00440SB0422 [0,1,0,0,0,1|2,0,0]=4 2069 B16R1.1696 CSCCNC(=O)CCc1ccccc1C WXVL_AK00440SB0422 [0,1,0,0,0,1|2,0,0]=4 2070 B16R1.1696 CSCCNC(=O)CCc1ccccc1Cl WXVL_AK00440SB0140 [0,1,0,0,0,1|2,0,0]=4 2071 B16R1.1696 CSCCNC(=O)CCc1ccccc1Cl WXVL_AK00440SB0140 [0,1,0,0,0,1|2,0,0]=4 2072 B16R1.1696 CSCCNC(=O)CCc1ccccc1F WXVL_AK00440SB0008 [0,1,0,0,0,1|2,0,0]=4 2073 B16R1.1696 CSCCNC(=O)CCc1ccccc1F WXVL_AK00440SB0008 [0,1,0,0,0,1|2,0,0]=4 2074 B16R1.1696 CSCCNC(=O)COc1ccccc1C WXVL_AK00440SB0136 [0,1,0,0,0,1|2,0,0]=4 2075 B16R1.1696 CSCCNC(=O)COc1ccccc1C WXVL_AK00440SB0136 [0,1,0,0,0,1|2,0,0]=4 2076 B16R1.1696 CSCCNC(=O)COc1ccccc1F WXVL_AK00440SB0441 [0,1,0,0,0,1|2,0,0]=4 2077 B16R1.1696 CSCCNC(=O)COc1ccccc1F WXVL_AK00440SB0441 [0,1,0,0,0,1|2,0,0]=4 2078 B16R1.1696 Cc1ccccc1CCC(=O)NCCCO WXVL_AK0073SB0422 [0,1,0,0,0,1|2,0,0]=4 2079 B16R1.1696 Cc1ccccc1CCC(=O)NCCCO WXVL_AK0073SB0422 [0,1,0,0,0,1|2,0,0]=4 2080 B16R1.1696 Cc1ccccc1CNC(=O)CCCCBr WXVL_AK0040SB3153 [0,1,0,0,0,1|2,0,0]=4 2081 B16R1.1696 Cc1ccccc1CNC(=O)CCCCBr WXVL_AK0040SB3153 [0,1,0,0,0,1|2,0,0]=4 2082 B16R1.1696 Cc1ccccc1CNC(=O)CCCCCl WXVL_AK0040SB0379 [0,1,0,0,0,1|2,0,0]=4 2083 B16R1.1696 Cc1ccccc1CNC(=O)CCCCCl WXVL_AK0040SB0379 [0,1,0,0,0,1|2,0,0]=4 2084 B16R1.1696 Cc1ccccc1CNC(=O)NCCCCl WXVL_AK0040YV0130 [0,1,0,0,0,1|2,0,0]=4 2085 B16R1.1696 Cc1ccccc1CNC(=O)NCCCCl WXVL_AK0040YV0130 [0,1,0,0,0,1|2,0,0]=4 2086 B16R1.1696 Cc1ccccc1OCC(=O)NCCCO WXVL_AK0073SB0136 [0,1,0,0,0,1|2,0,0]=4 2087 B16R1.1696 Cc1ccccc1OCC(=O)NCCCO WXVL_AK0073SB0136 [0,1,0,0,0,1|2,0,0]=4 2088 B16R1.1696 O=C(CCCCBr)NCc1ccccc1Br WXVL_AK1632SB3153 [0,1,0,0,0,1|2,0,0]=4 2089 B16R1.1696 O=C(CCCCBr)NCc1ccccc1Br WXVL_AK1632SB3153 [0,1,0,0,0,1|2,0,0]=4 2090 B16R1.1696 O=C(CCCCBr)NCc1ccccc1Cl WXVL_AK0038SB3153 [0,1,0,0,0,1|2,0,0]=4 2091 B16R1.1696 O=C(CCCCBr)NCc1ccccc1Cl WXVL_AK0038SB3153 [0,1,0,0,0,1|2,0,0]=4 2092 B16R1.1696 O=C(CCCCBr)NCc1ccccc1F WXVL_AK0037SB3153 [0,1,0,0,0,1|2,0,0]=4 2093 B16R1.1696 O=C(CCCCBr)NCc1ccccc1F WXVL_AK0037SB3153 [0,1,0,0,0,1|2,0,0]=4 2094 B16R1.1696 O=C(CCCCBr)NCc1ccccc1I WXVL_AK3923SB3153 [0,1,0,0,0,1|2,0,0]=4 2095 B16R1.1696 O=C(CCCCBr)NCc1ccccc1I WXVL_AK3923SB3153 [0,1,0,0,0,1|2,0,0]=4 2096 B16R1.1696 O=C(CCCCBr)NCc1ccccc1O WXVL_AK0963SB3153 [0,1,0,0,0,1|2,0,0]=4 2097 B16R1.1696 O=C(CCCCBr)NCc1ccccc1O WXVL_AK0963SB3153 [0,1,0,0,0,1|2,0,0]=4 2098 B16R1.1696 O=C(CCCCCl)NCc1ccccc1Br WXVL_AK1632SB0379 [0,1,0,0,0,1|2,0,0]=4 2099 B16R1.1696 O=C(CCCCCl)NCc1ccccc1Br WXVL_AK1632SB0379 [0,1,0,0,0,1|2,0,0]=4 2100 B16R1.1696 O=C(CCCCCl)NCc1ccccc1Cl WXVL_AK0038SB0379 [0,1,0,0,0,1|2,0,0]=4 2101 B16R1.1696 O=C(CCCCCl)NCc1ccccc1Cl WXVL_AK0038SB0379 [0,1,0,0,0,1|2,0,0]=4 2102 B16R1.1696 O=C(CCCCCl)NCc1ccccc1F WXVL_AK0037SB0379 [0,1,0,0,0,1|2,0,0]=4 2103 B16R1.1696 O=C(CCCCCl)NCc1ccccc1F WXVL_AK0037SB0379 [0,1,0,0,0,1|2,0,0]=4 2104 B16R1.1696 O=C(CCCCCl)NCc1ccccc1I WXVL_AK3923SB0379 [0,1,0,0,0,1|2,0,0]=4 2105 B16R1.1696 O=C(CCCCCl)NCc1ccccc1I WXVL_AK3923SB0379 [0,1,0,0,0,1|2,0,0]=4 2106 B16R1.1696 O=C(CCCCCl)NCc1ccccc1O WXVL_AK0963SB0379 [0,1,0,0,0,1|2,0,0]=4 2107 B16R1.1696 O=C(CCCCCl)NCc1ccccc1O WXVL_AK0963SB0379 [0,1,0,0,0,1|2,0,0]=4 2108 B16R1.1696 O=C(CCc1ccccc1Br)NCCCO WXVL_AK0073SB1278 [0,1,0,0,0,1|2,0,0]=4 2109 B16R1.1696 O=C(CCc1ccccc1Br)NCCCO WXVL_AK0073SB1278 [0,1,0,0,0,1|2,0,0]=4 2110 B16R1.1696 O=C(CCc1ccccc1Cl)NCCCO WXVL_AK0073SB0140 [0,1,0,0,0,1|2,0,0]=4 2111 B16R1.1696 O=C(CCc1ccccc1Cl)NCCCO WXVL_AK0073SB0140 [0,1,0,0,0,1|2,0,0]=4 2112 B16R1.1696 O=C(CCc1ccccc1F)NCCCO WXVL_AK0073SB0008 [0,1,0,0,0,1|2,0,0]=4 2113 B16R1.1696 O=C(CCc1ccccc1F)NCCCO WXVL_AK0073SB0008 [0,1,0,0,0,1|2,0,0]=4 2114 B16R1.1696 O=C(COc1ccccc1F)NCCCO WXVL_AK0073SB0441 [0,1,0,0,0,1|2,0,0]=4 2115 B16R1.1696 O=C(COc1ccccc1F)NCCCO WXVL_AK0073SB0441 [0,1,0,0,0,1|2,0,0]=4 2116 B16R1.1696 O=C(NCCCCl)NCc1ccccc1Br WXVL_AK1632YV0130 [0,1,0,0,0,1|2,0,0]=4 2117 B16R1.1696 O=C(NCCCCl)NCc1ccccc1Br WXVL_AK1632YV0130 [0,1,0,0,0,1|2,0,0]=4 2118 B16R1.1696 O=C(NCCCCl)NCc1ccccc1Cl WXVL_AK0038YV0130 [0,1,0,0,0,1|2,0,0]=4 2119 B16R1.1696 O=C(NCCCCl)NCc1ccccc1Cl WXVL_AK0038YV0130 [0,1,0,0,0,1|2,0,0]=4 2120 B16R1.1696 O=C(NCCCCl)NCc1ccccc1F WXVL_AK0037YV0130 [0,1,0,0,0,1|2,0,0]=4 2121 B16R1.1696 O=C(NCCCCl)NCc1ccccc1F WXVL_AK0037YV0130 [0,1,0,0,0,1|2,0,0]=4 2122 B16R1.1696 O=C(NCCCCl)NCc1ccccc1I WXVL_AK3923YV0130 [0,1,0,0,0,1|2,0,0]=4 2123 B16R1.1696 O=C(NCCCCl)NCc1ccccc1I WXVL_AK3923YV0130 [0,1,0,0,0,1|2,0,0]=4 2124 B16R1.1696 O=C(NCCCCl)NCc1ccccc1O WXVL_AK0963YV0130 [0,1,0,0,0,1|2,0,0]=4 2125 B16R1.1696 O=C(NCCCCl)NCc1ccccc1O WXVL_AK0963YV0130 [0,1,0,0,0,1|2,0,0]=4 2126 B16R1.20527 CCCCNS(=O)(=O)CCc1ccccc1 WXVL_AK00588HU0137 [0,1,0,0,0,1|2,0,0]=4 2127 B16R1.20527 CCCCNS(=O)(=O)CCc1ccccc1 WXVL_AK00588HU0137 [0,1,0,0,0,1|2,0,0]=4 2128 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)Br WXVL_AK00218SB0926 [0,2,0,0,0,0|1,0,1]=4 2129 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)Br WXVL_AK00218SB0926 [0,2,0,0,0,0|1,0,1]=4 2130 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)C WXVL_AK00218SB0112 [0,2,0,0,0,0|1,0,1]=4 2131 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)C WXVL_AK00218SB0112 [0,2,0,0,0,0|1,0,1]=4 2132 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK00218SB0107 [0,2,0,0,0,0|1,0,1]=4 2133 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK00218SB0107 [0,2,0,0,0,0|1,0,1]=4 2134 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)F WXVL_AK00218SB0106 [0,2,0,0,0,0|1,0,1]=4 2135 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)F WXVL_AK00218SB0106 [0,2,0,0,0,0|1,0,1]=4 2136 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)O WXVL_AK00218SB0110 [0,2,0,0,0,0|1,0,1]=4 2137 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)O WXVL_AK00218SB0110 [0,2,0,0,0,0|1,0,1]=4 2138 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)Br WXVL_AK0076SB0926 [0,2,0,0,0,0|1,0,0]=3 2139 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)Br WXVL_AK0076SB0926 [0,2,0,0,0,0|1,0,0]=3 2140 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)C WXVL_AK0076SB0112 [0,2,0,0,0,0|1,0,0]=3 2141 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)C WXVL_AK0076SB0112 [0,2,0,0,0,0|1,0,0]=3 2142 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK0076SB0107 [0,2,0,0,0,0|1,0,0]=3 2143 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK0076SB0107 [0,2,0,0,0,0|1,0,0]=3 2144 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)F WXVL_AK0076SB0106 [0,2,0,0,0,0|1,0,0]=3 2145 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)F WXVL_AK0076SB0106 [0,2,0,0,0,0|1,0,0]=3 2146 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)O WXVL_AK0076SB0110 [0,2,0,0,0,0|1,0,0]=3 2147 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)O WXVL_AK0076SB0110 [0,2,0,0,0,0|1,0,0]=3 2148 B16R1.54 CCCCCNC(=O)Cc1ccc(cn1)Br WXVL_AK0076SA0212 [0,2,0,0,0,0|2,0,0]=4 2149 B16R1.54 CCCCCNC(=O)Cc1ccc(cn1)Br WXVL_AK0076SA0212 [0,2,0,0,0,0|2,0,0]=4 2150 B16R1.54 CCCCCNC(=O)Cc1ccc(cn1)Cl WXVL_AK0076SA0537 [0,2,0,0,0,0|2,0,0]=4 2151 B16R1.54 CCCCCNC(=O)Cc1ccc(cn1)Cl WXVL_AK0076SA0537 [0,2,0,0,0,0|2,0,0]=4 2152 B16R1.54 CCCCCNC(=O)Cc1ccc(cn1)F WXVL_AK0076SA0011 [0,2,0,0,0,0|2,0,0]=4 2153 B16R1.54 CCCCCNC(=O)Cc1ccc(cn1)F WXVL_AK0076SA0011 [0,2,0,0,0,0|2,0,0]=4 2154 B16R1.54 CCCCCNC(=O)Cc1ccc(cn1)O WXVL_AK0076SA2976 [0,2,0,0,0,0|2,0,0]=4 2155 B16R1.54 CCCCCNC(=O)Cc1ccc(cn1)O WXVL_AK0076SA2976 [0,2,0,0,0,0|2,0,0]=4 2156 B16R1.54 CCCCCNC(=O)Cc1ccc(nc1)Br WXVL_AK0076SA00056 [0,2,0,0,0,0|2,0,0]=4 2157 B16R1.54 CCCCCNC(=O)Cc1ccc(nc1)Br WXVL_AK0076SA00056 [0,2,0,0,0,0|2,0,0]=4 2158 B16R1.54 CCCCCNC(=O)Cc1ccc(nc1)C WXVL_AK0076SA0250 [0,2,0,0,0,0|2,0,0]=4 2159 B16R1.54 CCCCCNC(=O)Cc1ccc(nc1)C WXVL_AK0076SA0250 [0,2,0,0,0,0|2,0,0]=4 2160 B16R1.54 CCCCCNC(=O)Nc1ccc(cc1)C WXVL_AK0076YV0026 [0,2,0,0,0,0|2,0,0]=4 2161 B16R1.54 CCCCCNC(=O)Nc1ccc(cc1)C WXVL_AK0076YV0026 [0,2,0,0,0,0|2,0,0]=4 2162 B16R1.54 CCCCCNC(=O)Nc1ccc(cc1)Cl WXVL_AK0076YV0023 [0,2,0,0,0,0|2,0,0]=4 2163 B16R1.54 CCCCCNC(=O)Nc1ccc(cc1)Cl WXVL_AK0076YV0023 [0,2,0,0,0,0|2,0,0]=4 2164 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)Br WXVL_AK00494SB0926 [0,2,0,0,0,0|1,0,0]=3 2165 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)Br WXVL_AK00494SB0926 [0,2,0,0,0,0|1,0,0]=3 2166 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)C WXVL_AK00494SB0112 [0,2,0,0,0,0|1,0,0]=3 2167 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)C WXVL_AK00494SB0112 [0,2,0,0,0,0|1,0,0]=3 2168 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK00494SB0107 [0,2,0,0,0,0|1,0,0]=3 2169 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK00494SB0107 [0,2,0,0,0,0|1,0,0]=3 2170 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)F WXVL_AK00494SB0106 [0,2,0,0,0,0|1,0,0]=3 2171 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)F WXVL_AK00494SB0106 [0,2,0,0,0,0|1,0,0]=3 2172 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)O WXVL_AK00494SB0110 [0,2,0,0,0,0|1,0,0]=3 2173 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)O WXVL_AK00494SB0110 [0,2,0,0,0,0|1,0,0]=3 2174 B16R1.54 CCSCCNC(=O)Cc1ccc(cn1)Br WXVL_AK00494SA0212 [0,2,0,0,0,0|2,0,0]=4 2175 B16R1.54 CCSCCNC(=O)Cc1ccc(cn1)Br WXVL_AK00494SA0212 [0,2,0,0,0,0|2,0,0]=4 2176 B16R1.54 CCSCCNC(=O)Cc1ccc(cn1)Cl WXVL_AK00494SA0537 [0,2,0,0,0,0|2,0,0]=4 2177 B16R1.54 CCSCCNC(=O)Cc1ccc(cn1)Cl WXVL_AK00494SA0537 [0,2,0,0,0,0|2,0,0]=4 2178 B16R1.54 CCSCCNC(=O)Cc1ccc(cn1)F WXVL_AK00494SA0011 [0,2,0,0,0,0|2,0,0]=4 2179 B16R1.54 CCSCCNC(=O)Cc1ccc(cn1)F WXVL_AK00494SA0011 [0,2,0,0,0,0|2,0,0]=4 2180 B16R1.54 CCSCCNC(=O)Cc1ccc(cn1)O WXVL_AK00494SA2976 [0,2,0,0,0,0|2,0,0]=4 2181 B16R1.54 CCSCCNC(=O)Cc1ccc(cn1)O WXVL_AK00494SA2976 [0,2,0,0,0,0|2,0,0]=4 2182 B16R1.54 CCSCCNC(=O)Cc1ccc(nc1)Br WXVL_AK00494SA00056 [0,2,0,0,0,0|2,0,0]=4 2183 B16R1.54 CCSCCNC(=O)Cc1ccc(nc1)Br WXVL_AK00494SA00056 [0,2,0,0,0,0|2,0,0]=4 2184 B16R1.54 CCSCCNC(=O)Cc1ccc(nc1)C WXVL_AK00494SA0250 [0,2,0,0,0,0|2,0,0]=4 2185 B16R1.54 CCSCCNC(=O)Cc1ccc(nc1)C WXVL_AK00494SA0250 [0,2,0,0,0,0|2,0,0]=4 2186 B16R1.54 CCSCCNC(=O)Nc1ccc(cc1)C WXVL_AK00494YV0026 [0,2,0,0,0,0|2,0,0]=4 2187 B16R1.54 CCSCCNC(=O)Nc1ccc(cc1)C WXVL_AK00494YV0026 [0,2,0,0,0,0|2,0,0]=4 2188 B16R1.54 CCSCCNC(=O)Nc1ccc(cc1)Cl WXVL_AK00494YV0023 [0,2,0,0,0,0|2,0,0]=4 2189 B16R1.54 CCSCCNC(=O)Nc1ccc(cc1)Cl WXVL_AK00494YV0023 [0,2,0,0,0,0|2,0,0]=4 2190 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)Br WXVL_AK00637SB0926 [0,2,0,0,0,0|1,0,0]=3 2191 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)Br WXVL_AK00637SB0926 [0,2,0,0,0,0|1,0,0]=3 2192 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)C WXVL_AK00637SB0112 [0,2,0,0,0,0|1,0,0]=3 2193 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)C WXVL_AK00637SB0112 [0,2,0,0,0,0|1,0,0]=3 2194 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK00637SB0107 [0,2,0,0,0,0|1,0,0]=3 2195 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK00637SB0107 [0,2,0,0,0,0|1,0,0]=3 2196 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)F WXVL_AK00637SB0106 [0,2,0,0,0,0|1,0,0]=3 2197 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)F WXVL_AK00637SB0106 [0,2,0,0,0,0|1,0,0]=3 2198 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)O WXVL_AK00637SB0110 [0,2,0,0,0,0|1,0,0]=3 2199 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)O WXVL_AK00637SB0110 [0,2,0,0,0,0|1,0,0]=3 2200 B16R1.54 COCCCNC(=O)Cc1ccc(cn1)Br WXVL_AK00637SA0212 [0,2,0,0,0,0|2,0,0]=4 2201 B16R1.54 COCCCNC(=O)Cc1ccc(cn1)Br WXVL_AK00637SA0212 [0,2,0,0,0,0|2,0,0]=4 2202 B16R1.54 COCCCNC(=O)Cc1ccc(cn1)Cl WXVL_AK00637SA0537 [0,2,0,0,0,0|2,0,0]=4 2203 B16R1.54 COCCCNC(=O)Cc1ccc(cn1)Cl WXVL_AK00637SA0537 [0,2,0,0,0,0|2,0,0]=4 2204 B16R1.54 COCCCNC(=O)Cc1ccc(cn1)F WXVL_AK00637SA0011 [0,2,0,0,0,0|2,0,0]=4 2205 B16R1.54 COCCCNC(=O)Cc1ccc(cn1)F WXVL_AK00637SA0011 [0,2,0,0,0,0|2,0,0]=4 2206 B16R1.54 COCCCNC(=O)Cc1ccc(cn1)O WXVL_AK00637SA2976 [0,2,0,0,0,0|2,0,0]=4 2207 B16R1.54 COCCCNC(=O)Cc1ccc(cn1)O WXVL_AK00637SA2976 [0,2,0,0,0,0|2,0,0]=4 2208 B16R1.54 COCCCNC(=O)Cc1ccc(nc1)Br WXVL_AK00637SA00056 [0,2,0,0,0,0|2,0,0]=4 2209 B16R1.54 COCCCNC(=O)Cc1ccc(nc1)Br WXVL_AK00637SA00056 [0,2,0,0,0,0|2,0,0]=4 2210 B16R1.54 COCCCNC(=O)Cc1ccc(nc1)C WXVL_AK00637SA0250 [0,2,0,0,0,0|2,0,0]=4 2211 B16R1.54 COCCCNC(=O)Cc1ccc(nc1)C WXVL_AK00637SA0250 [0,2,0,0,0,0|2,0,0]=4 2212 B16R1.54 COCCCNC(=O)Nc1ccc(cc1)C WXVL_AK00637YV0026 [0,2,0,0,0,0|2,0,0]=4 2213 B16R1.54 COCCCNC(=O)Nc1ccc(cc1)C WXVL_AK00637YV0026 [0,2,0,0,0,0|2,0,0]=4 2214 B16R1.54 COCCCNC(=O)Nc1ccc(cc1)Cl WXVL_AK00637YV0023 [0,2,0,0,0,0|2,0,0]=4 2215 B16R1.54 COCCCNC(=O)Nc1ccc(cc1)Cl WXVL_AK00637YV0023 [0,2,0,0,0,0|2,0,0]=4 2216 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0159 [0,2,0,0,0,0|2,0,0]=4 2217 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0159 [0,2,0,0,0,0|2,0,0]=4 2218 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0159 [0,2,0,0,0,0|2,0,0]=4 2219 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0159 [0,2,0,0,0,0|2,0,0]=4 2220 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)Br WXVL_AK0965SB0926 [0,2,0,0,0,0|1,0,0]=3 2221 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)Br WXVL_AK0965SB0926 [0,2,0,0,0,0|1,0,0]=3 2222 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)C WXVL_AK0965SB0112 [0,2,0,0,0,0|1,0,0]=3 2223 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)C WXVL_AK0965SB0112 [0,2,0,0,0,0|1,0,0]=3 2224 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK0965SB0107 [0,2,0,0,0,0|1,0,0]=3 2225 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)Cl WXVL_AK0965SB0107 [0,2,0,0,0,0|1,0,0]=3 2226 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)F WXVL_AK0965SB0106 [0,2,0,0,0,0|1,0,0]=3 2227 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)F WXVL_AK0965SB0106 [0,2,0,0,0,0|1,0,0]=3 2228 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)O WXVL_AK0965SB0110 [0,2,0,0,0,0|1,0,0]=3 2229 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)O WXVL_AK0965SB0110 [0,2,0,0,0,0|1,0,0]=3 2230 B16R1.54 CSCCCNC(=O)Cc1ccc(cn1)Br WXVL_AK0965SA0212 [0,2,0,0,0,0|2,0,0]=4 2231 B16R1.54 CSCCCNC(=O)Cc1ccc(cn1)Br WXVL_AK0965SA0212 [0,2,0,0,0,0|2,0,0]=4 2232 B16R1.54 CSCCCNC(=O)Cc1ccc(cn1)Cl WXVL_AK0965SA0537 [0,2,0,0,0,0|2,0,0]=4 2233 B16R1.54 CSCCCNC(=O)Cc1ccc(cn1)Cl WXVL_AK0965SA0537 [0,2,0,0,0,0|2,0,0]=4 2234 B16R1.54 CSCCCNC(=O)Cc1ccc(cn1)F WXVL_AK0965SA0011 [0,2,0,0,0,0|2,0,0]=4 2235 B16R1.54 CSCCCNC(=O)Cc1ccc(cn1)F WXVL_AK0965SA0011 [0,2,0,0,0,0|2,0,0]=4 2236 B16R1.54 CSCCCNC(=O)Cc1ccc(cn1)O WXVL_AK0965SA2976 [0,2,0,0,0,0|2,0,0]=4 2237 B16R1.54 CSCCCNC(=O)Cc1ccc(cn1)O WXVL_AK0965SA2976 [0,2,0,0,0,0|2,0,0]=4 2238 B16R1.54 CSCCCNC(=O)Cc1ccc(nc1)Br WXVL_AK0965SA00056 [0,2,0,0,0,0|2,0,0]=4 2239 B16R1.54 CSCCCNC(=O)Cc1ccc(nc1)Br WXVL_AK0965SA00056 [0,2,0,0,0,0|2,0,0]=4 2240 B16R1.54 CSCCCNC(=O)Cc1ccc(nc1)C WXVL_AK0965SA0250 [0,2,0,0,0,0|2,0,0]=4 2241 B16R1.54 CSCCCNC(=O)Cc1ccc(nc1)C WXVL_AK0965SA0250 [0,2,0,0,0,0|2,0,0]=4 2242 B16R1.54 CSCCCNC(=O)Nc1ccc(cc1)C WXVL_AK0965YV0026 [0,2,0,0,0,0|2,0,0]=4 2243 B16R1.54 CSCCCNC(=O)Nc1ccc(cc1)C WXVL_AK0965YV0026 [0,2,0,0,0,0|2,0,0]=4 2244 B16R1.54 CSCCCNC(=O)Nc1ccc(cc1)Cl WXVL_AK0965YV0023 [0,2,0,0,0,0|2,0,0]=4 2245 B16R1.54 CSCCCNC(=O)Nc1ccc(cc1)Cl WXVL_AK0965YV0023 [0,2,0,0,0,0|2,0,0]=4 2246 B16R1.54 Cc1ccc(cc1)CC(=O)NCCCCO WXVL_AK0075SB0112 [0,2,0,0,0,0|1,0,0]=3 2247 B16R1.54 Cc1ccc(cc1)CC(=O)NCCCCO WXVL_AK0075SB0112 [0,2,0,0,0,0|1,0,0]=3 2248 B16R1.54 Cc1ccc(cc1)NC(=O)NCCCCO WXVL_AK0075YV0026 [0,2,0,0,0,0|2,0,0]=4 2249 B16R1.54 Cc1ccc(cc1)NC(=O)NCCCCO WXVL_AK0075YV0026 [0,2,0,0,0,0|2,0,0]=4 2250 B16R1.54 Cc1ccc(cn1)CC(=O)NCCCCO WXVL_AK0075SA0250 [0,2,0,0,0,0|2,0,0]=4 2251 B16R1.54 Cc1ccc(cn1)CC(=O)NCCCCO WXVL_AK0075SA0250 [0,2,0,0,0,0|2,0,0]=4 2252 B16R1.54 O=C(CCCCCBr)Nc1ccc(cc1)Cl WXVL_AG0062SB2192 [0,2,0,0,0,0|2,0,0]=4 2253 B16R1.54 O=C(CCCCCBr)Nc1ccc(cc1)Cl WXVL_AG0062SB2192 [0,2,0,0,0,0|2,0,0]=4 2254 B16R1.54 O=C(CCCCCBr)Nc1ccc(cc1)I WXVL_AG1742SB2192 [0,2,0,0,0,0|2,0,0]=4 2255 B16R1.54 O=C(CCCCCBr)Nc1ccc(cc1)I WXVL_AG1742SB2192 [0,2,0,0,0,0|2,0,0]=4 2256 B16R1.54 O=C(CCCCCO)Nc1ccc(cc1)Cl WXVL_AG0062SB2973 [0,2,0,0,0,0|2,0,0]=4 2257 B16R1.54 O=C(CCCCCO)Nc1ccc(cc1)Cl WXVL_AG0062SB2973 [0,2,0,0,0,0|2,0,0]=4 2258 B16R1.54 O=C(CCCCCO)Nc1ccc(cc1)I WXVL_AG1742SB2973 [0,2,0,0,0,0|2,0,0]=4 2259 B16R1.54 O=C(CCCCCO)Nc1ccc(cc1)I WXVL_AG1742SB2973 [0,2,0,0,0,0|2,0,0]=4 2260 B16R1.54 O=C(Cc1ccc(cc1)Br)NCCCCO WXVL_AK0075SB0926 [0,2,0,0,0,0|1,0,0]=3 2261 B16R1.54 O=C(Cc1ccc(cc1)Br)NCCCCO WXVL_AK0075SB0926 [0,2,0,0,0,0|1,0,0]=3 2262 B16R1.54 O=C(Cc1ccc(cc1)Cl)NCCCCO WXVL_AK0075SB0107 [0,2,0,0,0,0|1,0,0]=3 2263 B16R1.54 O=C(Cc1ccc(cc1)Cl)NCCCCO WXVL_AK0075SB0107 [0,2,0,0,0,0|1,0,0]=3 2264 B16R1.54 O=C(Cc1ccc(cc1)F)NCCCCO WXVL_AK0075SB0106 [0,2,0,0,0,0|1,0,0]=3 2265 B16R1.54 O=C(Cc1ccc(cc1)F)NCCCCO WXVL_AK0075SB0106 [0,2,0,0,0,0|1,0,0]=3 2266 B16R1.54 O=C(Cc1ccc(cc1)O)NCCCCO WXVL_AK0075SB0110 [0,2,0,0,0,0|1,0,0]=3 2267 B16R1.54 O=C(Cc1ccc(cc1)O)NCCCCO WXVL_AK0075SB0110 [0,2,0,0,0,0|1,0,0]=3 2268 B16R1.54 O=C(Cc1ccc(cn1)Br)NCCCCO WXVL_AK0075SA0212 [0,2,0,0,0,0|2,0,0]=4 2269 B16R1.54 O=C(Cc1ccc(cn1)Br)NCCCCO WXVL_AK0075SA0212 [0,2,0,0,0,0|2,0,0]=4 2270 B16R1.54 O=C(Cc1ccc(cn1)Cl)NCCCCO WXVL_AK0075SA0537 [0,2,0,0,0,0|2,0,0]=4 2271 B16R1.54 O=C(Cc1ccc(cn1)Cl)NCCCCO WXVL_AK0075SA0537 [0,2,0,0,0,0|2,0,0]=4 2272 B16R1.54 O=C(Cc1ccc(cn1)F)NCCCCO WXVL_AK0075SA0011 [0,2,0,0,0,0|2,0,0]=4 2273 B16R1.54 O=C(Cc1ccc(cn1)F)NCCCCO WXVL_AK0075SA0011 [0,2,0,0,0,0|2,0,0]=4 2274 B16R1.54 O=C(Cc1ccc(cn1)O)NCCCCO WXVL_AK0075SA2976 [0,2,0,0,0,0|2,0,0]=4 2275 B16R1.54 O=C(Cc1ccc(cn1)O)NCCCCO WXVL_AK0075SA2976 [0,2,0,0,0,0|2,0,0]=4 2276 B16R1.54 O=C(Cc1ccc(nc1)Br)NCCCCO WXVL_AK0075SA00056 [0,2,0,0,0,0|2,0,0]=4 2277 B16R1.54 O=C(Cc1ccc(nc1)Br)NCCCCO WXVL_AK0075SA00056 [0,2,0,0,0,0|2,0,0]=4 2278 B16R1.54 O=C(NCCCCO)Nc1ccc(cc1)Cl WXVL_AK0075YV0023 [0,2,0,0,0,0|2,0,0]=4 2279 B16R1.54 O=C(NCCCCO)Nc1ccc(cc1)Cl WXVL_AK0075YV0023 [0,2,0,0,0,0|2,0,0]=4 2280 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)Br WXVL_AK00218SB0099 [0,2,0,0,0,0|1,0,1]=4 2281 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)Br WXVL_AK00218SB0099 [0,2,0,0,0,0|1,0,1]=4 2282 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)C WXVL_AK00218SB0105 [0,2,0,0,0,0|1,0,1]=4 2283 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)C WXVL_AK00218SB0105 [0,2,0,0,0,0|1,0,1]=4 2284 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)Cl WXVL_AK00218SB0101 [0,2,0,0,0,0|1,0,1]=4 2285 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)Cl WXVL_AK00218SB0101 [0,2,0,0,0,0|1,0,1]=4 2286 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)F WXVL_AK00218SB0100 [0,2,0,0,0,0|1,0,1]=4 2287 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)F WXVL_AK00218SB0100 [0,2,0,0,0,0|1,0,1]=4 2288 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)O WXVL_AK00218SB0104 [0,2,0,0,0,0|1,0,1]=4 2289 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)O WXVL_AK00218SB0104 [0,2,0,0,0,0|1,0,1]=4 2290 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)Br WXVL_AK0076SB0099 [0,2,0,0,0,0|1,0,0]=3 2291 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)Br WXVL_AK0076SB0099 [0,2,0,0,0,0|1,0,0]=3 2292 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)C WXVL_AK0076SB0105 [0,2,0,0,0,0|1,0,0]=3 2293 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)C WXVL_AK0076SB0105 [0,2,0,0,0,0|1,0,0]=3 2294 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)Cl WXVL_AK0076SB0101 [0,2,0,0,0,0|1,0,0]=3 2295 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)Cl WXVL_AK0076SB0101 [0,2,0,0,0,0|1,0,0]=3 2296 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)F WXVL_AK0076SB0100 [0,2,0,0,0,0|1,0,0]=3 2297 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)F WXVL_AK0076SB0100 [0,2,0,0,0,0|1,0,0]=3 2298 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)O WXVL_AK0076SB0104 [0,2,0,0,0,0|1,0,0]=3 2299 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)O WXVL_AK0076SB0104 [0,2,0,0,0,0|1,0,0]=3 2300 B16R1.55 CCCCCNC(=O)Cc1cccc(n1)C WXVL_AK0076SA0399 [0,2,0,0,0,0|2,0,0]=4 2301 B16R1.55 CCCCCNC(=O)Cc1cccc(n1)C WXVL_AK0076SA0399 [0,2,0,0,0,0|2,0,0]=4 2302 B16R1.55 CCCCCNC(=O)Cc1cccc(n1)Cl WXVL_AK0076SA0313 [0,2,0,0,0,0|2,0,0]=4 2303 B16R1.55 CCCCCNC(=O)Cc1cccc(n1)Cl WXVL_AK0076SA0313 [0,2,0,0,0,0|2,0,0]=4 2304 B16R1.55 CCCCCNC(=O)Cc1ccnc(c1)Br WXVL_AK0076SA0520 [0,2,0,0,0,0|2,0,0]=4 2305 B16R1.55 CCCCCNC(=O)Cc1ccnc(c1)Br WXVL_AK0076SA0520 [0,2,0,0,0,0|2,0,0]=4 2306 B16R1.55 CCCCCNC(=O)Nc1cccc(c1)Br WXVL_AK0076YV0098 [0,2,0,0,0,0|2,0,0]=4 2307 B16R1.55 CCCCCNC(=O)Nc1cccc(c1)Br WXVL_AK0076YV0098 [0,2,0,0,0,0|2,0,0]=4 2308 B16R1.55 CCCCCNC(=O)Nc1cccc(c1)C WXVL_AK0076YV0020 [0,2,0,0,0,0|2,0,0]=4 2309 B16R1.55 CCCCCNC(=O)Nc1cccc(c1)C WXVL_AK0076YV0020 [0,2,0,0,0,0|2,0,0]=4 2310 B16R1.55 CCCCCNC(=O)Nc1cccc(c1)Cl WXVL_AK0076YV0016 [0,2,0,0,0,0|2,0,0]=4 2311 B16R1.55 CCCCCNC(=O)Nc1cccc(c1)Cl WXVL_AK0076YV0016 [0,2,0,0,0,0|2,0,0]=4 2312 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)Br WXVL_AK00494SB0099 [0,2,0,0,0,0|1,0,0]=3 2313 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)Br WXVL_AK00494SB0099 [0,2,0,0,0,0|1,0,0]=3 2314 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)C WXVL_AK00494SB0105 [0,2,0,0,0,0|1,0,0]=3 2315 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)C WXVL_AK00494SB0105 [0,2,0,0,0,0|1,0,0]=3 2316 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)Cl WXVL_AK00494SB0101 [0,2,0,0,0,0|1,0,0]=3 2317 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)Cl WXVL_AK00494SB0101 [0,2,0,0,0,0|1,0,0]=3 2318 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)F WXVL_AK00494SB0100 [0,2,0,0,0,0|1,0,0]=3 2319 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)F WXVL_AK00494SB0100 [0,2,0,0,0,0|1,0,0]=3 2320 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)O WXVL_AK00494SB0104 [0,2,0,0,0,0|1,0,0]=3 2321 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)O WXVL_AK00494SB0104 [0,2,0,0,0,0|1,0,0]=3 2322 B16R1.55 CCSCCNC(=O)Cc1cccc(n1)C WXVL_AK00494SA0399 [0,2,0,0,0,0|2,0,0]=4 2323 B16R1.55 CCSCCNC(=O)Cc1cccc(n1)C WXVL_AK00494SA0399 [0,2,0,0,0,0|2,0,0]=4 2324 B16R1.55 CCSCCNC(=O)Cc1cccc(n1)Cl WXVL_AK00494SA0313 [0,2,0,0,0,0|2,0,0]=4 2325 B16R1.55 CCSCCNC(=O)Cc1cccc(n1)Cl WXVL_AK00494SA0313 [0,2,0,0,0,0|2,0,0]=4 2326 B16R1.55 CCSCCNC(=O)Cc1ccnc(c1)Br WXVL_AK00494SA0520 [0,2,0,0,0,0|2,0,0]=4 2327 B16R1.55 CCSCCNC(=O)Cc1ccnc(c1)Br WXVL_AK00494SA0520 [0,2,0,0,0,0|2,0,0]=4 2328 B16R1.55 CCSCCNC(=O)Nc1cccc(c1)Br WXVL_AK00494YV0098 [0,2,0,0,0,0|2,0,0]=4 2329 B16R1.55 CCSCCNC(=O)Nc1cccc(c1)Br WXVL_AK00494YV0098 [0,2,0,0,0,0|2,0,0]=4 2330 B16R1.55 CCSCCNC(=O)Nc1cccc(c1)C WXVL_AK00494YV0020 [0,2,0,0,0,0|2,0,0]=4 2331 B16R1.55 CCSCCNC(=O)Nc1cccc(c1)C WXVL_AK00494YV0020 [0,2,0,0,0,0|2,0,0]=4 2332 B16R1.55 CCSCCNC(=O)Nc1cccc(c1)Cl WXVL_AK00494YV0016 [0,2,0,0,0,0|2,0,0]=4 2333 B16R1.55 CCSCCNC(=O)Nc1cccc(c1)Cl WXVL_AK00494YV0016 [0,2,0,0,0,0|2,0,0]=4 2334 B16R1.55 COCCCNC(=O)Cc1cccc(c1)Br WXVL_AK00637SB0099 [0,2,0,0,0,0|1,0,0]=3 2335 B16R1.55 COCCCNC(=O)Cc1cccc(c1)Br WXVL_AK00637SB0099 [0,2,0,0,0,0|1,0,0]=3 2336 B16R1.55 COCCCNC(=O)Cc1cccc(c1)C WXVL_AK00637SB0105 [0,2,0,0,0,0|1,0,0]=3 2337 B16R1.55 COCCCNC(=O)Cc1cccc(c1)C WXVL_AK00637SB0105 [0,2,0,0,0,0|1,0,0]=3 2338 B16R1.55 COCCCNC(=O)Cc1cccc(c1)Cl WXVL_AK00637SB0101 [0,2,0,0,0,0|1,0,0]=3 2339 B16R1.55 COCCCNC(=O)Cc1cccc(c1)Cl WXVL_AK00637SB0101 [0,2,0,0,0,0|1,0,0]=3 2340 B16R1.55 COCCCNC(=O)Cc1cccc(c1)F WXVL_AK00637SB0100 [0,2,0,0,0,0|1,0,0]=3 2341 B16R1.55 COCCCNC(=O)Cc1cccc(c1)F WXVL_AK00637SB0100 [0,2,0,0,0,0|1,0,0]=3 2342 B16R1.55 COCCCNC(=O)Cc1cccc(c1)O WXVL_AK00637SB0104 [0,2,0,0,0,0|1,0,0]=3 2343 B16R1.55 COCCCNC(=O)Cc1cccc(c1)O WXVL_AK00637SB0104 [0,2,0,0,0,0|1,0,0]=3 2344 B16R1.55 COCCCNC(=O)Cc1cccc(n1)C WXVL_AK00637SA0399 [0,2,0,0,0,0|2,0,0]=4 2345 B16R1.55 COCCCNC(=O)Cc1cccc(n1)C WXVL_AK00637SA0399 [0,2,0,0,0,0|2,0,0]=4 2346 B16R1.55 COCCCNC(=O)Cc1cccc(n1)Cl WXVL_AK00637SA0313 [0,2,0,0,0,0|2,0,0]=4 2347 B16R1.55 COCCCNC(=O)Cc1cccc(n1)Cl WXVL_AK00637SA0313 [0,2,0,0,0,0|2,0,0]=4 2348 B16R1.55 COCCCNC(=O)Cc1ccnc(c1)Br WXVL_AK00637SA0520 [0,2,0,0,0,0|2,0,0]=4 2349 B16R1.55 COCCCNC(=O)Cc1ccnc(c1)Br WXVL_AK00637SA0520 [0,2,0,0,0,0|2,0,0]=4 2350 B16R1.55 COCCCNC(=O)Nc1cccc(c1)Br WXVL_AK00637YV0098 [0,2,0,0,0,0|2,0,0]=4 2351 B16R1.55 COCCCNC(=O)Nc1cccc(c1)Br WXVL_AK00637YV0098 [0,2,0,0,0,0|2,0,0]=4 2352 B16R1.55 COCCCNC(=O)Nc1cccc(c1)C WXVL_AK00637YV0020 [0,2,0,0,0,0|2,0,0]=4 2353 B16R1.55 COCCCNC(=O)Nc1cccc(c1)C WXVL_AK00637YV0020 [0,2,0,0,0,0|2,0,0]=4 2354 B16R1.55 COCCCNC(=O)Nc1cccc(c1)Cl WXVL_AK00637YV0016 [0,2,0,0,0,0|2,0,0]=4 2355 B16R1.55 COCCCNC(=O)Nc1cccc(c1)Cl WXVL_AK00637YV0016 [0,2,0,0,0,0|2,0,0]=4 2356 B16R1.55 COCCOCC(=O)Nc1cccc(c1)C WXVL_AG0052SB0159 [0,2,0,0,0,0|2,0,0]=4 2357 B16R1.55 COCCOCC(=O)Nc1cccc(c1)C WXVL_AG0052SB0159 [0,2,0,0,0,0|2,0,0]=4 2358 B16R1.55 COCCOCC(=O)Nc1cccc(c1)I WXVL_AG0649SB0159 [0,2,0,0,0,0|2,0,0]=4 2359 B16R1.55 COCCOCC(=O)Nc1cccc(c1)I WXVL_AG0649SB0159 [0,2,0,0,0,0|2,0,0]=4 2360 B16R1.55 COCCOCC(=O)Nc1cccc(c1)O WXVL_AG00200SB0159 [0,2,0,0,0,0|2,0,0]=4 2361 B16R1.55 COCCOCC(=O)Nc1cccc(c1)O WXVL_AG00200SB0159 [0,2,0,0,0,0|2,0,0]=4 2362 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)Br WXVL_AK0965SB0099 [0,2,0,0,0,0|1,0,0]=3 2363 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)Br WXVL_AK0965SB0099 [0,2,0,0,0,0|1,0,0]=3 2364 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)C WXVL_AK0965SB0105 [0,2,0,0,0,0|1,0,0]=3 2365 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)C WXVL_AK0965SB0105 [0,2,0,0,0,0|1,0,0]=3 2366 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)Cl WXVL_AK0965SB0101 [0,2,0,0,0,0|1,0,0]=3 2367 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)Cl WXVL_AK0965SB0101 [0,2,0,0,0,0|1,0,0]=3 2368 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)F WXVL_AK0965SB0100 [0,2,0,0,0,0|1,0,0]=3 2369 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)F WXVL_AK0965SB0100 [0,2,0,0,0,0|1,0,0]=3 2370 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)O WXVL_AK0965SB0104 [0,2,0,0,0,0|1,0,0]=3 2371 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)O WXVL_AK0965SB0104 [0,2,0,0,0,0|1,0,0]=3 2372 B16R1.55 CSCCCNC(=O)Cc1cccc(n1)C WXVL_AK0965SA0399 [0,2,0,0,0,0|2,0,0]=4 2373 B16R1.55 CSCCCNC(=O)Cc1cccc(n1)C WXVL_AK0965SA0399 [0,2,0,0,0,0|2,0,0]=4 2374 B16R1.55 CSCCCNC(=O)Cc1cccc(n1)Cl WXVL_AK0965SA0313 [0,2,0,0,0,0|2,0,0]=4 2375 B16R1.55 CSCCCNC(=O)Cc1cccc(n1)Cl WXVL_AK0965SA0313 [0,2,0,0,0,0|2,0,0]=4 2376 B16R1.55 CSCCCNC(=O)Cc1ccnc(c1)Br WXVL_AK0965SA0520 [0,2,0,0,0,0|2,0,0]=4 2377 B16R1.55 CSCCCNC(=O)Cc1ccnc(c1)Br WXVL_AK0965SA0520 [0,2,0,0,0,0|2,0,0]=4 2378 B16R1.55 CSCCCNC(=O)Nc1cccc(c1)Br WXVL_AK0965YV0098 [0,2,0,0,0,0|2,0,0]=4 2379 B16R1.55 CSCCCNC(=O)Nc1cccc(c1)Br WXVL_AK0965YV0098 [0,2,0,0,0,0|2,0,0]=4 2380 B16R1.55 CSCCCNC(=O)Nc1cccc(c1)C WXVL_AK0965YV0020 [0,2,0,0,0,0|2,0,0]=4 2381 B16R1.55 CSCCCNC(=O)Nc1cccc(c1)C WXVL_AK0965YV0020 [0,2,0,0,0,0|2,0,0]=4 2382 B16R1.55 CSCCCNC(=O)Nc1cccc(c1)Cl WXVL_AK0965YV0016 [0,2,0,0,0,0|2,0,0]=4 2383 B16R1.55 CSCCCNC(=O)Nc1cccc(c1)Cl WXVL_AK0965YV0016 [0,2,0,0,0,0|2,0,0]=4 2384 B16R1.55 Cc1cccc(c1)CC(=O)NCCCCO WXVL_AK0075SB0105 [0,2,0,0,0,0|1,0,0]=3 2385 B16R1.55 Cc1cccc(c1)CC(=O)NCCCCO WXVL_AK0075SB0105 [0,2,0,0,0,0|1,0,0]=3 2386 B16R1.55 Cc1cccc(c1)NC(=O)CCCCCBr WXVL_AG0052SB2192 [0,2,0,0,0,0|2,0,0]=4 2387 B16R1.55 Cc1cccc(c1)NC(=O)CCCCCBr WXVL_AG0052SB2192 [0,2,0,0,0,0|2,0,0]=4 2388 B16R1.55 Cc1cccc(c1)NC(=O)CCCCCO WXVL_AG0052SB2973 [0,2,0,0,0,0|2,0,0]=4 2389 B16R1.55 Cc1cccc(c1)NC(=O)CCCCCO WXVL_AG0052SB2973 [0,2,0,0,0,0|2,0,0]=4 2390 B16R1.55 Cc1cccc(c1)NC(=O)NCCCCO WXVL_AK0075YV0020 [0,2,0,0,0,0|2,0,0]=4 2391 B16R1.55 Cc1cccc(c1)NC(=O)NCCCCO WXVL_AK0075YV0020 [0,2,0,0,0,0|2,0,0]=4 2392 B16R1.55 Cc1cccc(n1)CC(=O)NCCCCO WXVL_AK0075SA0399 [0,2,0,0,0,0|2,0,0]=4 2393 B16R1.55 Cc1cccc(n1)CC(=O)NCCCCO WXVL_AK0075SA0399 [0,2,0,0,0,0|2,0,0]=4 2394 B16R1.55 O=C(CCCCCBr)Nc1cccc(c1)I WXVL_AG0649SB2192 [0,2,0,0,0,0|2,0,0]=4 2395 B16R1.55 O=C(CCCCCBr)Nc1cccc(c1)I WXVL_AG0649SB2192 [0,2,0,0,0,0|2,0,0]=4 2396 B16R1.55 O=C(CCCCCBr)Nc1cccc(c1)O WXVL_AG00200SB2192 [0,2,0,0,0,0|2,0,0]=4 2397 B16R1.55 O=C(CCCCCBr)Nc1cccc(c1)O WXVL_AG00200SB2192 [0,2,0,0,0,0|2,0,0]=4 2398 B16R1.55 O=C(CCCCCO)Nc1cccc(c1)I WXVL_AG0649SB2973 [0,2,0,0,0,0|2,0,0]=4 2399 B16R1.55 O=C(CCCCCO)Nc1cccc(c1)I WXVL_AG0649SB2973 [0,2,0,0,0,0|2,0,0]=4 2400 B16R1.55 O=C(CCCCCO)Nc1cccc(c1)O WXVL_AG00200SB2973 [0,2,0,0,0,0|2,0,0]=4 2401 B16R1.55 O=C(CCCCCO)Nc1cccc(c1)O WXVL_AG00200SB2973 [0,2,0,0,0,0|2,0,0]=4 2402 B16R1.55 O=C(Cc1cccc(c1)Br)NCCCCO WXVL_AK0075SB0099 [0,2,0,0,0,0|1,0,0]=3 2403 B16R1.55 O=C(Cc1cccc(c1)Br)NCCCCO WXVL_AK0075SB0099 [0,2,0,0,0,0|1,0,0]=3 2404 B16R1.55 O=C(Cc1cccc(c1)Cl)NCCCCO WXVL_AK0075SB0101 [0,2,0,0,0,0|1,0,0]=3 2405 B16R1.55 O=C(Cc1cccc(c1)Cl)NCCCCO WXVL_AK0075SB0101 [0,2,0,0,0,0|1,0,0]=3 2406 B16R1.55 O=C(Cc1cccc(c1)F)NCCCCO WXVL_AK0075SB0100 [0,2,0,0,0,0|1,0,0]=3 2407 B16R1.55 O=C(Cc1cccc(c1)F)NCCCCO WXVL_AK0075SB0100 [0,2,0,0,0,0|1,0,0]=3 2408 B16R1.55 O=C(Cc1cccc(c1)O)NCCCCO WXVL_AK0075SB0104 [0,2,0,0,0,0|1,0,0]=3 2409 B16R1.55 O=C(Cc1cccc(c1)O)NCCCCO WXVL_AK0075SB0104 [0,2,0,0,0,0|1,0,0]=3 2410 B16R1.55 O=C(Cc1cccc(n1)Cl)NCCCCO WXVL_AK0075SA0313 [0,2,0,0,0,0|2,0,0]=4 2411 B16R1.55 O=C(Cc1cccc(n1)Cl)NCCCCO WXVL_AK0075SA0313 [0,2,0,0,0,0|2,0,0]=4 2412 B16R1.55 O=C(Cc1ccnc(c1)Br)NCCCCO WXVL_AK0075SA0520 [0,2,0,0,0,0|2,0,0]=4 2413 B16R1.55 O=C(Cc1ccnc(c1)Br)NCCCCO WXVL_AK0075SA0520 [0,2,0,0,0,0|2,0,0]=4 2414 B16R1.55 O=C(NCCCCO)Nc1cccc(c1)Br WXVL_AK0075YV0098 [0,2,0,0,0,0|2,0,0]=4 2415 B16R1.55 O=C(NCCCCO)Nc1cccc(c1)Br WXVL_AK0075YV0098 [0,2,0,0,0,0|2,0,0]=4 2416 B16R1.55 O=C(NCCCCO)Nc1cccc(c1)Cl WXVL_AK0075YV0016 [0,2,0,0,0,0|2,0,0]=4 2417 B16R1.55 O=C(NCCCCO)Nc1cccc(c1)Cl WXVL_AK0075YV0016 [0,2,0,0,0,0|2,0,0]=4 2418 B16R1.610 CC(=O)NCCNC(=O)Cc1ccccc1 WXVL_AK0057SB0092 [0,2,0,0,0,0|1,0,1]=4 2419 B16R1.610 CC(=O)NCCNC(=O)Cc1ccccc1 WXVL_AK0057SB0092 [0,2,0,0,0,0|1,0,1]=4 2420 B16R1.610 CC(C)OCCNC(=O)Cc1ccccc1 WXVL_AK0128SB0092 [0,2,0,0,0,0|1,0,0]=3 2421 B16R1.610 CC(C)OCCNC(=O)Cc1ccccc1 WXVL_AK0128SB0092 [0,2,0,0,0,0|1,0,0]=3 2422 B16R1.610 CC(C)OCCNC(=O)Cc1ccccn1 WXVL_AK0128SA0032 [0,2,0,0,0,0|2,0,0]=4 2423 B16R1.610 CC(C)OCCNC(=O)Cc1ccccn1 WXVL_AK0128SA0032 [0,2,0,0,0,0|2,0,0]=4 2424 B16R1.610 CC(C)OCCNC(=O)Cc1cccnc1 WXVL_AK0128SA0029 [0,2,0,0,0,0|2,0,0]=4 2425 B16R1.610 CC(C)OCCNC(=O)Cc1cccnc1 WXVL_AK0128SA0029 [0,2,0,0,0,0|2,0,0]=4 2426 B16R1.610 CC(C)OCCNC(=O)Cc1cccnc1 WXVL_AK0128SB00049 [0,2,0,0,0,0|2,0,0]=4 2427 B16R1.610 CC(C)OCCNC(=O)Cc1cccnc1 WXVL_AK0128SB00049 [0,2,0,0,0,0|2,0,0]=4 2428 B16R1.610 CC(C)OCCNC(=O)Cc1ccncc1 WXVL_AK0128SA00106 [0,2,0,0,0,0|2,0,0]=4 2429 B16R1.610 CC(C)OCCNC(=O)Cc1ccncc1 WXVL_AK0128SA00106 [0,2,0,0,0,0|2,0,0]=4 2430 B16R1.693 C#CCCCCNC(=O)Cc1ccccc1 WXVL_AK00614SB0092 [0,2,0,0,0,0|1,0,0]=3 2431 B16R1.693 C#CCCCCNC(=O)Cc1ccccc1 WXVL_AK00614SB0092 [0,2,0,0,0,0|1,0,0]=3 2432 B16R1.693 C#CCCCCNC(=O)Cc1ccccn1 WXVL_AK00614SA0032 [0,2,0,0,0,0|2,0,0]=4 2433 B16R1.693 C#CCCCCNC(=O)Cc1ccccn1 WXVL_AK00614SA0032 [0,2,0,0,0,0|2,0,0]=4 2434 B16R1.693 C#CCCCCNC(=O)Cc1cccnc1 WXVL_AK00614SA0029 [0,2,0,0,0,0|2,0,0]=4 2435 B16R1.693 C#CCCCCNC(=O)Cc1cccnc1 WXVL_AK00614SA0029 [0,2,0,0,0,0|2,0,0]=4 2436 B16R1.693 C#CCCCCNC(=O)Cc1cccnc1 WXVL_AK00614SB00049 [0,2,0,0,0,0|2,0,0]=4 2437 B16R1.693 C#CCCCCNC(=O)Cc1cccnc1 WXVL_AK00614SB00049 [0,2,0,0,0,0|2,0,0]=4 2438 B16R1.693 C#CCCCCNC(=O)Cc1ccncc1 WXVL_AK00614SA00106 [0,2,0,0,0,0|2,0,0]=4 2439 B16R1.693 C#CCCCCNC(=O)Cc1ccncc1 WXVL_AK00614SA00106 [0,2,0,0,0,0|2,0,0]=4 2440 B16R1.693 C#CCOCCNC(=O)Cc1ccccc1 WXVL_AK00687SB0092 [0,2,0,0,0,0|1,0,1]=4 2441 B16R1.693 C#CCOCCNC(=O)Cc1ccccc1 WXVL_AK00687SB0092 [0,2,0,0,0,0|1,0,1]=4 2442 B16R1.693 C=COCCCNC(=O)Cc1ccccc1 WXVL_AK7221SB0092 [0,2,0,0,0,0|1,0,1]=4 2443 B16R1.693 C=COCCCNC(=O)Cc1ccccc1 WXVL_AK7221SB0092 [0,2,0,0,0,0|1,0,1]=4 2444 B16R1.693 CCCCC/C=C/C(=O)Nc1ccccc1 WXVL_AG00183SB3331 [0,2,0,0,0,0|2,0,0]=4 2445 B16R1.693 CCCCC/C=C/C(=O)Nc1ccccc1 WXVL_AG00183SB3331 [0,2,0,0,0,0|2,0,0]=4 2446 B16R1.693 CCCCCCCC(=O)Nc1ccccc1 WXVL_AG00183SB0393 [0,2,0,0,0,0|2,0,0]=4 2447 B16R1.693 CCCCCCCC(=O)Nc1ccccc1 WXVL_AG00183SB0393 [0,2,0,0,0,0|2,0,0]=4 2448 B16R1.693 CCCCCCNC(=O)Cc1ccccc1 WXVL_AK0286SB0092 [0,2,0,0,0,0|1,0,0]=3 2449 B16R1.693 CCCCCCNC(=O)Cc1ccccc1 WXVL_AK0286SB0092 [0,2,0,0,0,0|1,0,0]=3 2450 B16R1.693 CCCCCCNC(=O)Cc1ccccn1 WXVL_AK0286SA0032 [0,2,0,0,0,0|2,0,0]=4 2451 B16R1.693 CCCCCCNC(=O)Cc1ccccn1 WXVL_AK0286SA0032 [0,2,0,0,0,0|2,0,0]=4 2452 B16R1.693 CCCCCCNC(=O)Cc1cccnc1 WXVL_AK0286SA0029 [0,2,0,0,0,0|2,0,0]=4 2453 B16R1.693 CCCCCCNC(=O)Cc1cccnc1 WXVL_AK0286SA0029 [0,2,0,0,0,0|2,0,0]=4 2454 B16R1.693 CCCCCCNC(=O)Cc1cccnc1 WXVL_AK0286SB00049 [0,2,0,0,0,0|2,0,0]=4 2455 B16R1.693 CCCCCCNC(=O)Cc1cccnc1 WXVL_AK0286SB00049 [0,2,0,0,0,0|2,0,0]=4 2456 B16R1.693 CCCCCCNC(=O)Cc1ccncc1 WXVL_AK0286SA00106 [0,2,0,0,0,0|2,0,0]=4 2457 B16R1.693 CCCCCCNC(=O)Cc1ccncc1 WXVL_AK0286SA00106 [0,2,0,0,0,0|2,0,0]=4 2458 B16R1.693 CCOCCCNC(=O)Cc1ccccc1 WXVL_AK0072SB0092 [0,2,0,0,0,0|1,0,0]=3 2459 B16R1.693 CCOCCCNC(=O)Cc1ccccc1 WXVL_AK0072SB0092 [0,2,0,0,0,0|1,0,0]=3 2460 B16R1.693 CCOCCCNC(=O)Cc1ccccn1 WXVL_AK0072SA0032 [0,2,0,0,0,0|2,0,0]=4 2461 B16R1.693 CCOCCCNC(=O)Cc1ccccn1 WXVL_AK0072SA0032 [0,2,0,0,0,0|2,0,0]=4 2462 B16R1.693 CCOCCCNC(=O)Cc1cccnc1 WXVL_AK0072SA0029 [0,2,0,0,0,0|2,0,0]=4 2463 B16R1.693 CCOCCCNC(=O)Cc1cccnc1 WXVL_AK0072SA0029 [0,2,0,0,0,0|2,0,0]=4 2464 B16R1.693 CCOCCCNC(=O)Cc1cccnc1 WXVL_AK0072SB00049 [0,2,0,0,0,0|2,0,0]=4 2465 B16R1.693 CCOCCCNC(=O)Cc1cccnc1 WXVL_AK0072SB00049 [0,2,0,0,0,0|2,0,0]=4 2466 B16R1.693 CCOCCCNC(=O)Cc1ccncc1 WXVL_AK0072SA00106 [0,2,0,0,0,0|2,0,0]=4 2467 B16R1.693 CCOCCCNC(=O)Cc1ccncc1 WXVL_AK0072SA00106 [0,2,0,0,0,0|2,0,0]=4 2468 B16R1.693 O=C(CCCCCCBr)Nc1ccccc1 WXVL_AG00183SB1386 [0,2,0,0,0,0|2,0,0]=4 2469 B16R1.693 O=C(CCCCCCBr)Nc1ccccc1 WXVL_AG00183SB1386 [0,2,0,0,0,0|2,0,0]=4 2470 B16R1.693 O=C(Cc1ccccc1)NCCCCCO WXVL_AK0077SB0092 [0,2,0,0,0,0|1,0,0]=3 2471 B16R1.693 O=C(Cc1ccccc1)NCCCCCO WXVL_AK0077SB0092 [0,2,0,0,0,0|1,0,0]=3 2472 B16R1.693 O=C(Cc1ccccc1)NCCNCCO WXVL_AK0954SB0092 [0,2,0,0,0,0|1,0,0]=3 2473 B16R1.693 O=C(Cc1ccccc1)NCCNCCO WXVL_AK0954SB0092 [0,2,0,0,0,0|1,0,0]=3 2474 B16R1.693 O=C(Cc1ccccn1)NCCCCCO WXVL_AK0077SA0032 [0,2,0,0,0,0|2,0,0]=4 2475 B16R1.693 O=C(Cc1ccccn1)NCCCCCO WXVL_AK0077SA0032 [0,2,0,0,0,0|2,0,0]=4 2476 B16R1.693 O=C(Cc1ccccn1)NCCNCCO WXVL_AK0954SA0032 [0,2,0,0,0,0|2,0,0]=4 2477 B16R1.693 O=C(Cc1ccccn1)NCCNCCO WXVL_AK0954SA0032 [0,2,0,0,0,0|2,0,0]=4 2478 B16R1.693 O=C(Cc1cccnc1)NCCCCCO WXVL_AK0077SA0029 [0,2,0,0,0,0|2,0,0]=4 2479 B16R1.693 O=C(Cc1cccnc1)NCCCCCO WXVL_AK0077SA0029 [0,2,0,0,0,0|2,0,0]=4 2480 B16R1.693 O=C(Cc1cccnc1)NCCCCCO WXVL_AK0077SB00049 [0,2,0,0,0,0|2,0,0]=4 2481 B16R1.693 O=C(Cc1cccnc1)NCCCCCO WXVL_AK0077SB00049 [0,2,0,0,0,0|2,0,0]=4 2482 B16R1.693 O=C(Cc1cccnc1)NCCNCCO WXVL_AK0954SA0029 [0,2,0,0,0,0|2,0,0]=4 2483 B16R1.693 O=C(Cc1cccnc1)NCCNCCO WXVL_AK0954SA0029 [0,2,0,0,0,0|2,0,0]=4 2484 B16R1.693 O=C(Cc1cccnc1)NCCNCCO WXVL_AK0954SB00049 [0,2,0,0,0,0|2,0,0]=4 2485 B16R1.693 O=C(Cc1cccnc1)NCCNCCO WXVL_AK0954SB00049 [0,2,0,0,0,0|2,0,0]=4 2486 B16R1.693 O=C(Cc1ccncc1)NCCCCCO WXVL_AK0077SA00106 [0,2,0,0,0,0|2,0,0]=4 2487 B16R1.693 O=C(Cc1ccncc1)NCCCCCO WXVL_AK0077SA00106 [0,2,0,0,0,0|2,0,0]=4 2488 B16R1.693 O=C(Cc1ccncc1)NCCNCCO WXVL_AK0954SA00106 [0,2,0,0,0,0|2,0,0]=4 2489 B16R1.693 O=C(Cc1ccncc1)NCCNCCO WXVL_AK0954SA00106 [0,2,0,0,0,0|2,0,0]=4 2490 B16R1.705 C#CCCCNC(=O)C(C)c1ccccc1 WXVL_AK00218SB2326 [0,2,0,0,0,0|1,0,1]=4 2491 B16R1.705 C#CCCCNC(=O)C(C)c1ccccc1 WXVL_AK00218SB2326 [0,2,0,0,0,0|1,0,1]=4 2492 B16R1.705 C#CCCCNC(=O)C(O)c1ccccc1 WXVL_AK00218SB0168 [0,2,0,0,0,0|1,0,1]=4 2493 B16R1.705 C#CCCCNC(=O)C(O)c1ccccc1 WXVL_AK00218SB0168 [0,2,0,0,0,0|1,0,1]=4 2494 B16R1.705 CC(C(=O)NCCCCO)c1ccccc1 WXVL_AK0075SB2326 [0,2,0,0,0,0|1,0,0]=3 2495 B16R1.705 CC(C(=O)NCCCCO)c1ccccc1 WXVL_AK0075SB2326 [0,2,0,0,0,0|1,0,0]=3 2496 B16R1.705 CCCCCNC(=O)C(=O)c1ccccc1 WXVL_AK0076SB0050 [0,2,0,0,0,0|1,0,1]=4 2497 B16R1.705 CCCCCNC(=O)C(=O)c1ccccc1 WXVL_AK0076SB0050 [0,2,0,0,0,0|1,0,1]=4 2498 B16R1.705 CCCCCNC(=O)C(C)c1ccccc1 WXVL_AK0076SB2326 [0,2,0,0,0,0|1,0,0]=3 2499 B16R1.705 CCCCCNC(=O)C(C)c1ccccc1 WXVL_AK0076SB2326 [0,2,0,0,0,0|1,0,0]=3 2500 B16R1.705 CCCCCNC(=O)C(O)c1ccccc1 WXVL_AK0076SB0168 [0,2,0,0,0,0|1,0,0]=3 2501 B16R1.705 CCCCCNC(=O)C(O)c1ccccc1 WXVL_AK0076SB0168 [0,2,0,0,0,0|1,0,0]=3 2502 B16R1.705 CCSCCNC(=O)C(=O)c1ccccc1 WXVL_AK00494SB0050 [0,2,0,0,0,0|1,0,1]=4 2503 B16R1.705 CCSCCNC(=O)C(=O)c1ccccc1 WXVL_AK00494SB0050 [0,2,0,0,0,0|1,0,1]=4 2504 B16R1.705 CCSCCNC(=O)C(C)c1ccccc1 WXVL_AK00494SB2326 [0,2,0,0,0,0|1,0,0]=3 2505 B16R1.705 CCSCCNC(=O)C(C)c1ccccc1 WXVL_AK00494SB2326 [0,2,0,0,0,0|1,0,0]=3 2506 B16R1.705 CCSCCNC(=O)C(O)c1ccccc1 WXVL_AK00494SB0168 [0,2,0,0,0,0|1,0,0]=3 2507 B16R1.705 CCSCCNC(=O)C(O)c1ccccc1 WXVL_AK00494SB0168 [0,2,0,0,0,0|1,0,0]=3 2508 B16R1.705 COCCCNC(=O)C(=O)c1ccccc1 WXVL_AK00637SB0050 [0,2,0,0,0,0|1,0,1]=4 2509 B16R1.705 COCCCNC(=O)C(=O)c1ccccc1 WXVL_AK00637SB0050 [0,2,0,0,0,0|1,0,1]=4 2510 B16R1.705 COCCCNC(=O)C(C)c1ccccc1 WXVL_AK00637SB2326 [0,2,0,0,0,0|1,0,0]=3 2511 B16R1.705 COCCCNC(=O)C(C)c1ccccc1 WXVL_AK00637SB2326 [0,2,0,0,0,0|1,0,0]=3 2512 B16R1.705 COCCCNC(=O)C(O)c1ccccc1 WXVL_AK00637SB0168 [0,2,0,0,0,0|1,0,0]=3 2513 B16R1.705 COCCCNC(=O)C(O)c1ccccc1 WXVL_AK00637SB0168 [0,2,0,0,0,0|1,0,0]=3 2514 B16R1.705 CSCCCNC(=O)C(=O)c1ccccc1 WXVL_AK0965SB0050 [0,2,0,0,0,0|1,0,1]=4 2515 B16R1.705 CSCCCNC(=O)C(=O)c1ccccc1 WXVL_AK0965SB0050 [0,2,0,0,0,0|1,0,1]=4 2516 B16R1.705 CSCCCNC(=O)C(C)c1ccccc1 WXVL_AK0965SB2326 [0,2,0,0,0,0|1,0,0]=3 2517 B16R1.705 CSCCCNC(=O)C(C)c1ccccc1 WXVL_AK0965SB2326 [0,2,0,0,0,0|1,0,0]=3 2518 B16R1.705 CSCCCNC(=O)C(O)c1ccccc1 WXVL_AK0965SB0168 [0,2,0,0,0,0|1,0,0]=3 2519 B16R1.705 CSCCCNC(=O)C(O)c1ccccc1 WXVL_AK0965SB0168 [0,2,0,0,0,0|1,0,0]=3 2520 B16R1.705 O=C(NCCCCO)C(=O)c1ccccc1 WXVL_AK0075SB0050 [0,2,0,0,0,0|1,0,1]=4 2521 B16R1.705 O=C(NCCCCO)C(=O)c1ccccc1 WXVL_AK0075SB0050 [0,2,0,0,0,0|1,0,1]=4 2522 B16R1.705 O=C(NCCCCO)C(O)c1ccccc1 WXVL_AK0075SB0168 [0,2,0,0,0,0|1,0,0]=3 2523 B16R1.705 O=C(NCCCCO)C(O)c1ccccc1 WXVL_AK0075SB0168 [0,2,0,0,0,0|1,0,0]=3 2524 B16R1.934 CCNC(=O)CNC(=O)Cc1ccccc1 WXVL_AK00476SB2135 [0,2,0,0,0,0|1,0,1]=4 2525 B16R1.934 CCNC(=O)CNC(=O)Cc1ccccc1 WXVL_AK00476SB2135 [0,2,0,0,0,0|1,0,1]=4 2526 B16R1.1329 CC(CO)CCNC(=O)Cc1ccccc1 WXVL_AK4143SB0092 [0,2,0,0,0,0|1,0,0]=3 2527 B16R1.1329 CC(CO)CCNC(=O)Cc1ccccc1 WXVL_AK4143SB0092 [0,2,0,0,0,0|1,0,0]=3 2528 B16R1.1329 CC(CO)CCNC(=O)Cc1ccccn1 WXVL_AK4143SA0032 [0,2,0,0,0,0|2,0,0]=4 2529 B16R1.1329 CC(CO)CCNC(=O)Cc1ccccn1 WXVL_AK4143SA0032 [0,2,0,0,0,0|2,0,0]=4 2530 B16R1.1329 CC(CO)CCNC(=O)Cc1cccnc1 WXVL_AK4143SA0029 [0,2,0,0,0,0|2,0,0]=4 2531 B16R1.1329 CC(CO)CCNC(=O)Cc1cccnc1 WXVL_AK4143SA0029 [0,2,0,0,0,0|2,0,0]=4 2532 B16R1.1329 CC(CO)CCNC(=O)Cc1cccnc1 WXVL_AK4143SB00049 [0,2,0,0,0,0|2,0,0]=4 2533 B16R1.1329 CC(CO)CCNC(=O)Cc1cccnc1 WXVL_AK4143SB00049 [0,2,0,0,0,0|2,0,0]=4 2534 B16R1.1329 CC(CO)CCNC(=O)Cc1ccncc1 WXVL_AK4143SA00106 [0,2,0,0,0,0|2,0,0]=4 2535 B16R1.1329 CC(CO)CCNC(=O)Cc1ccncc1 WXVL_AK4143SA00106 [0,2,0,0,0,0|2,0,0]=4 2536 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1Br WXVL_AK00218SB0093 [0,2,0,0,0,0|1,0,1]=4 2537 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1Br WXVL_AK00218SB0093 [0,2,0,0,0,0|1,0,1]=4 2538 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1C WXVL_AK00218SB0098 [0,2,0,0,0,0|1,0,1]=4 2539 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1C WXVL_AK00218SB0098 [0,2,0,0,0,0|1,0,1]=4 2540 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1Cl WXVL_AK00218SB0095 [0,2,0,0,0,0|1,0,1]=4 2541 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1Cl WXVL_AK00218SB0095 [0,2,0,0,0,0|1,0,1]=4 2542 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1F WXVL_AK00218SB0094 [0,2,0,0,0,0|1,0,1]=4 2543 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1F WXVL_AK00218SB0094 [0,2,0,0,0,0|1,0,1]=4 2544 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1I WXVL_AK00218SB1145 [0,2,0,0,0,0|1,0,1]=4 2545 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1I WXVL_AK00218SB1145 [0,2,0,0,0,0|1,0,1]=4 2546 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1O WXVL_AK00218SB0400 [0,2,0,0,0,0|1,0,1]=4 2547 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1O WXVL_AK00218SB0400 [0,2,0,0,0,0|1,0,1]=4 2548 B16R1.4621 CCCCCNC(=O)Cc1ccccc1Br WXVL_AK0076SB0093 [0,2,0,0,0,0|1,0,0]=3 2549 B16R1.4621 CCCCCNC(=O)Cc1ccccc1Br WXVL_AK0076SB0093 [0,2,0,0,0,0|1,0,0]=3 2550 B16R1.4621 CCCCCNC(=O)Cc1ccccc1C WXVL_AK0076SB0098 [0,2,0,0,0,0|1,0,0]=3 2551 B16R1.4621 CCCCCNC(=O)Cc1ccccc1C WXVL_AK0076SB0098 [0,2,0,0,0,0|1,0,0]=3 2552 B16R1.4621 CCCCCNC(=O)Cc1ccccc1Cl WXVL_AK0076SB0095 [0,2,0,0,0,0|1,0,0]=3 2553 B16R1.4621 CCCCCNC(=O)Cc1ccccc1Cl WXVL_AK0076SB0095 [0,2,0,0,0,0|1,0,0]=3 2554 B16R1.4621 CCCCCNC(=O)Cc1ccccc1F WXVL_AK0076SB0094 [0,2,0,0,0,0|1,0,0]=3 2555 B16R1.4621 CCCCCNC(=O)Cc1ccccc1F WXVL_AK0076SB0094 [0,2,0,0,0,0|1,0,0]=3 2556 B16R1.4621 CCCCCNC(=O)Cc1ccccc1I WXVL_AK0076SB1145 [0,2,0,0,0,0|1,0,0]=3 2557 B16R1.4621 CCCCCNC(=O)Cc1ccccc1I WXVL_AK0076SB1145 [0,2,0,0,0,0|1,0,0]=3 2558 B16R1.4621 CCCCCNC(=O)Cc1ccccc1O WXVL_AK0076SB0400 [0,2,0,0,0,0|1,0,0]=3 2559 B16R1.4621 CCCCCNC(=O)Cc1ccccc1O WXVL_AK0076SB0400 [0,2,0,0,0,0|1,0,0]=3 2560 B16R1.4621 CCCCCNC(=O)Cc1cccnc1Cl WXVL_AK0076SA0056 [0,2,0,0,0,0|2,0,0]=4 2561 B16R1.4621 CCCCCNC(=O)Cc1cccnc1Cl WXVL_AK0076SA0056 [0,2,0,0,0,0|2,0,0]=4 2562 B16R1.4621 CCCCCNC(=O)Nc1ccccc1Br WXVL_AK0076YV0003 [0,2,0,0,0,0|2,0,0]=4 2563 B16R1.4621 CCCCCNC(=O)Nc1ccccc1Br WXVL_AK0076YV0003 [0,2,0,0,0,0|2,0,0]=4 2564 B16R1.4621 CCCCCNC(=O)Nc1ccccc1C WXVL_AK0076YV0013 [0,2,0,0,0,0|2,0,0]=4 2565 B16R1.4621 CCCCCNC(=O)Nc1ccccc1C WXVL_AK0076YV0013 [0,2,0,0,0,0|2,0,0]=4 2566 B16R1.4621 CCCCCNC(=O)Nc1ccccc1Cl WXVL_AK0076YV0007 [0,2,0,0,0,0|2,0,0]=4 2567 B16R1.4621 CCCCCNC(=O)Nc1ccccc1Cl WXVL_AK0076YV0007 [0,2,0,0,0,0|2,0,0]=4 2568 B16R1.4621 CCSCCNC(=O)Cc1ccccc1Br WXVL_AK00494SB0093 [0,2,0,0,0,0|1,0,0]=3 2569 B16R1.4621 CCSCCNC(=O)Cc1ccccc1Br WXVL_AK00494SB0093 [0,2,0,0,0,0|1,0,0]=3 2570 B16R1.4621 CCSCCNC(=O)Cc1ccccc1C WXVL_AK00494SB0098 [0,2,0,0,0,0|1,0,0]=3 2571 B16R1.4621 CCSCCNC(=O)Cc1ccccc1C WXVL_AK00494SB0098 [0,2,0,0,0,0|1,0,0]=3 2572 B16R1.4621 CCSCCNC(=O)Cc1ccccc1Cl WXVL_AK00494SB0095 [0,2,0,0,0,0|1,0,0]=3 2573 B16R1.4621 CCSCCNC(=O)Cc1ccccc1Cl WXVL_AK00494SB0095 [0,2,0,0,0,0|1,0,0]=3 2574 B16R1.4621 CCSCCNC(=O)Cc1ccccc1F WXVL_AK00494SB0094 [0,2,0,0,0,0|1,0,0]=3 2575 B16R1.4621 CCSCCNC(=O)Cc1ccccc1F WXVL_AK00494SB0094 [0,2,0,0,0,0|1,0,0]=3 2576 B16R1.4621 CCSCCNC(=O)Cc1ccccc1I WXVL_AK00494SB1145 [0,2,0,0,0,0|1,0,0]=3 2577 B16R1.4621 CCSCCNC(=O)Cc1ccccc1I WXVL_AK00494SB1145 [0,2,0,0,0,0|1,0,0]=3 2578 B16R1.4621 CCSCCNC(=O)Cc1ccccc1O WXVL_AK00494SB0400 [0,2,0,0,0,0|1,0,0]=3 2579 B16R1.4621 CCSCCNC(=O)Cc1ccccc1O WXVL_AK00494SB0400 [0,2,0,0,0,0|1,0,0]=3 2580 B16R1.4621 CCSCCNC(=O)Cc1cccnc1Cl WXVL_AK00494SA0056 [0,2,0,0,0,0|2,0,0]=4 2581 B16R1.4621 CCSCCNC(=O)Cc1cccnc1Cl WXVL_AK00494SA0056 [0,2,0,0,0,0|2,0,0]=4 2582 B16R1.4621 CCSCCNC(=O)Nc1ccccc1Br WXVL_AK00494YV0003 [0,2,0,0,0,0|2,0,0]=4 2583 B16R1.4621 CCSCCNC(=O)Nc1ccccc1Br WXVL_AK00494YV0003 [0,2,0,0,0,0|2,0,0]=4 2584 B16R1.4621 CCSCCNC(=O)Nc1ccccc1C WXVL_AK00494YV0013 [0,2,0,0,0,0|2,0,0]=4 2585 B16R1.4621 CCSCCNC(=O)Nc1ccccc1C WXVL_AK00494YV0013 [0,2,0,0,0,0|2,0,0]=4 2586 B16R1.4621 CCSCCNC(=O)Nc1ccccc1Cl WXVL_AK00494YV0007 [0,2,0,0,0,0|2,0,0]=4 2587 B16R1.4621 CCSCCNC(=O)Nc1ccccc1Cl WXVL_AK00494YV0007 [0,2,0,0,0,0|2,0,0]=4 2588 B16R1.4621 COCCCNC(=O)Cc1ccccc1Br WXVL_AK00637SB0093 [0,2,0,0,0,0|1,0,0]=3 2589 B16R1.4621 COCCCNC(=O)Cc1ccccc1Br WXVL_AK00637SB0093 [0,2,0,0,0,0|1,0,0]=3 2590 B16R1.4621 COCCCNC(=O)Cc1ccccc1C WXVL_AK00637SB0098 [0,2,0,0,0,0|1,0,0]=3 2591 B16R1.4621 COCCCNC(=O)Cc1ccccc1C WXVL_AK00637SB0098 [0,2,0,0,0,0|1,0,0]=3 2592 B16R1.4621 COCCCNC(=O)Cc1ccccc1Cl WXVL_AK00637SB0095 [0,2,0,0,0,0|1,0,0]=3 2593 B16R1.4621 COCCCNC(=O)Cc1ccccc1Cl WXVL_AK00637SB0095 [0,2,0,0,0,0|1,0,0]=3 2594 B16R1.4621 COCCCNC(=O)Cc1ccccc1F WXVL_AK00637SB0094 [0,2,0,0,0,0|1,0,0]=3 2595 B16R1.4621 COCCCNC(=O)Cc1ccccc1F WXVL_AK00637SB0094 [0,2,0,0,0,0|1,0,0]=3 2596 B16R1.4621 COCCCNC(=O)Cc1ccccc1I WXVL_AK00637SB1145 [0,2,0,0,0,0|1,0,0]=3 2597 B16R1.4621 COCCCNC(=O)Cc1ccccc1I WXVL_AK00637SB1145 [0,2,0,0,0,0|1,0,0]=3 2598 B16R1.4621 COCCCNC(=O)Cc1ccccc1O WXVL_AK00637SB0400 [0,2,0,0,0,0|1,0,0]=3 2599 B16R1.4621 COCCCNC(=O)Cc1ccccc1O WXVL_AK00637SB0400 [0,2,0,0,0,0|1,0,0]=3 2600 B16R1.4621 COCCCNC(=O)Cc1cccnc1Cl WXVL_AK00637SA0056 [0,2,0,0,0,0|2,0,0]=4 2601 B16R1.4621 COCCCNC(=O)Cc1cccnc1Cl WXVL_AK00637SA0056 [0,2,0,0,0,0|2,0,0]=4 2602 B16R1.4621 COCCCNC(=O)Nc1ccccc1Br WXVL_AK00637YV0003 [0,2,0,0,0,0|2,0,0]=4 2603 B16R1.4621 COCCCNC(=O)Nc1ccccc1Br WXVL_AK00637YV0003 [0,2,0,0,0,0|2,0,0]=4 2604 B16R1.4621 COCCCNC(=O)Nc1ccccc1C WXVL_AK00637YV0013 [0,2,0,0,0,0|2,0,0]=4 2605 B16R1.4621 COCCCNC(=O)Nc1ccccc1C WXVL_AK00637YV0013 [0,2,0,0,0,0|2,0,0]=4 2606 B16R1.4621 COCCCNC(=O)Nc1ccccc1Cl WXVL_AK00637YV0007 [0,2,0,0,0,0|2,0,0]=4 2607 B16R1.4621 COCCCNC(=O)Nc1ccccc1Cl WXVL_AK00637YV0007 [0,2,0,0,0,0|2,0,0]=4 2608 B16R1.4621 COCCOCC(=O)Nc1ccccc1Br WXVL_AG00180SB0159 [0,2,0,0,0,0|2,0,0]=4 2609 B16R1.4621 COCCOCC(=O)Nc1ccccc1Br WXVL_AG00180SB0159 [0,2,0,0,0,0|2,0,0]=4 2610 B16R1.4621 COCCOCC(=O)Nc1ccccc1C WXVL_AG0027SB0159 [0,2,0,0,0,0|2,0,0]=4 2611 B16R1.4621 COCCOCC(=O)Nc1ccccc1C WXVL_AG0027SB0159 [0,2,0,0,0,0|2,0,0]=4 2612 B16R1.4621 COCCOCC(=O)Nc1ccccc1Cl WXVL_AG00129SB0159 [0,2,0,0,0,0|2,0,0]=4 2613 B16R1.4621 COCCOCC(=O)Nc1ccccc1Cl WXVL_AG00129SB0159 [0,2,0,0,0,0|2,0,0]=4 2614 B16R1.4621 COCCOCC(=O)Nc1ccccc1I WXVL_AG0385SB0159 [0,2,0,0,0,0|2,0,0]=4 2615 B16R1.4621 COCCOCC(=O)Nc1ccccc1I WXVL_AG0385SB0159 [0,2,0,0,0,0|2,0,0]=4 2616 B16R1.4621 CSCCCNC(=O)Cc1ccccc1Br WXVL_AK0965SB0093 [0,2,0,0,0,0|1,0,0]=3 2617 B16R1.4621 CSCCCNC(=O)Cc1ccccc1Br WXVL_AK0965SB0093 [0,2,0,0,0,0|1,0,0]=3 2618 B16R1.4621 CSCCCNC(=O)Cc1ccccc1C WXVL_AK0965SB0098 [0,2,0,0,0,0|1,0,0]=3 2619 B16R1.4621 CSCCCNC(=O)Cc1ccccc1C WXVL_AK0965SB0098 [0,2,0,0,0,0|1,0,0]=3 2620 B16R1.4621 CSCCCNC(=O)Cc1ccccc1Cl WXVL_AK0965SB0095 [0,2,0,0,0,0|1,0,0]=3 2621 B16R1.4621 CSCCCNC(=O)Cc1ccccc1Cl WXVL_AK0965SB0095 [0,2,0,0,0,0|1,0,0]=3 2622 B16R1.4621 CSCCCNC(=O)Cc1ccccc1F WXVL_AK0965SB0094 [0,2,0,0,0,0|1,0,0]=3 2623 B16R1.4621 CSCCCNC(=O)Cc1ccccc1F WXVL_AK0965SB0094 [0,2,0,0,0,0|1,0,0]=3 2624 B16R1.4621 CSCCCNC(=O)Cc1ccccc1I WXVL_AK0965SB1145 [0,2,0,0,0,0|1,0,0]=3 2625 B16R1.4621 CSCCCNC(=O)Cc1ccccc1I WXVL_AK0965SB1145 [0,2,0,0,0,0|1,0,0]=3 2626 B16R1.4621 CSCCCNC(=O)Cc1ccccc1O WXVL_AK0965SB0400 [0,2,0,0,0,0|1,0,0]=3 2627 B16R1.4621 CSCCCNC(=O)Cc1ccccc1O WXVL_AK0965SB0400 [0,2,0,0,0,0|1,0,0]=3 2628 B16R1.4621 CSCCCNC(=O)Cc1cccnc1Cl WXVL_AK0965SA0056 [0,2,0,0,0,0|2,0,0]=4 2629 B16R1.4621 CSCCCNC(=O)Cc1cccnc1Cl WXVL_AK0965SA0056 [0,2,0,0,0,0|2,0,0]=4 2630 B16R1.4621 CSCCCNC(=O)Nc1ccccc1Br WXVL_AK0965YV0003 [0,2,0,0,0,0|2,0,0]=4 2631 B16R1.4621 CSCCCNC(=O)Nc1ccccc1Br WXVL_AK0965YV0003 [0,2,0,0,0,0|2,0,0]=4 2632 B16R1.4621 CSCCCNC(=O)Nc1ccccc1C WXVL_AK0965YV0013 [0,2,0,0,0,0|2,0,0]=4 2633 B16R1.4621 CSCCCNC(=O)Nc1ccccc1C WXVL_AK0965YV0013 [0,2,0,0,0,0|2,0,0]=4 2634 B16R1.4621 CSCCCNC(=O)Nc1ccccc1Cl WXVL_AK0965YV0007 [0,2,0,0,0,0|2,0,0]=4 2635 B16R1.4621 CSCCCNC(=O)Nc1ccccc1Cl WXVL_AK0965YV0007 [0,2,0,0,0,0|2,0,0]=4 2636 B16R1.4621 Cc1ccccc1CC(=O)NCCCCO WXVL_AK0075SB0098 [0,2,0,0,0,0|1,0,0]=3 2637 B16R1.4621 Cc1ccccc1CC(=O)NCCCCO WXVL_AK0075SB0098 [0,2,0,0,0,0|1,0,0]=3 2638 B16R1.4621 Cc1ccccc1NC(=O)CCCCCBr WXVL_AG0027SB2192 [0,2,0,0,0,0|2,0,0]=4 2639 B16R1.4621 Cc1ccccc1NC(=O)CCCCCBr WXVL_AG0027SB2192 [0,2,0,0,0,0|2,0,0]=4 2640 B16R1.4621 Cc1ccccc1NC(=O)CCCCCO WXVL_AG0027SB2973 [0,2,0,0,0,0|2,0,0]=4 2641 B16R1.4621 Cc1ccccc1NC(=O)CCCCCO WXVL_AG0027SB2973 [0,2,0,0,0,0|2,0,0]=4 2642 B16R1.4621 Cc1ccccc1NC(=O)NCCCCO WXVL_AK0075YV0013 [0,2,0,0,0,0|2,0,0]=4 2643 B16R1.4621 Cc1ccccc1NC(=O)NCCCCO WXVL_AK0075YV0013 [0,2,0,0,0,0|2,0,0]=4 2644 B16R1.4621 O=C(CCCCCBr)Nc1ccccc1Br WXVL_AG00180SB2192 [0,2,0,0,0,0|2,0,0]=4 2645 B16R1.4621 O=C(CCCCCBr)Nc1ccccc1Br WXVL_AG00180SB2192 [0,2,0,0,0,0|2,0,0]=4 2646 B16R1.4621 O=C(CCCCCBr)Nc1ccccc1Cl WXVL_AG00129SB2192 [0,2,0,0,0,0|2,0,0]=4 2647 B16R1.4621 O=C(CCCCCBr)Nc1ccccc1Cl WXVL_AG00129SB2192 [0,2,0,0,0,0|2,0,0]=4 2648 B16R1.4621 O=C(CCCCCBr)Nc1ccccc1I WXVL_AG0385SB2192 [0,2,0,0,0,0|2,0,0]=4 2649 B16R1.4621 O=C(CCCCCBr)Nc1ccccc1I WXVL_AG0385SB2192 [0,2,0,0,0,0|2,0,0]=4 2650 B16R1.4621 O=C(CCCCCO)Nc1ccccc1Br WXVL_AG00180SB2973 [0,2,0,0,0,0|2,0,0]=4 2651 B16R1.4621 O=C(CCCCCO)Nc1ccccc1Br WXVL_AG00180SB2973 [0,2,0,0,0,0|2,0,0]=4 2652 B16R1.4621 O=C(CCCCCO)Nc1ccccc1Cl WXVL_AG00129SB2973 [0,2,0,0,0,0|2,0,0]=4 2653 B16R1.4621 O=C(CCCCCO)Nc1ccccc1Cl WXVL_AG00129SB2973 [0,2,0,0,0,0|2,0,0]=4 2654 B16R1.4621 O=C(CCCCCO)Nc1ccccc1I WXVL_AG0385SB2973 [0,2,0,0,0,0|2,0,0]=4 2655 B16R1.4621 O=C(CCCCCO)Nc1ccccc1I WXVL_AG0385SB2973 [0,2,0,0,0,0|2,0,0]=4 2656 B16R1.4621 O=C(Cc1ccccc1Br)NCCCCO WXVL_AK0075SB0093 [0,2,0,0,0,0|1,0,0]=3 2657 B16R1.4621 O=C(Cc1ccccc1Br)NCCCCO WXVL_AK0075SB0093 [0,2,0,0,0,0|1,0,0]=3 2658 B16R1.4621 O=C(Cc1ccccc1Cl)NCCCCO WXVL_AK0075SB0095 [0,2,0,0,0,0|1,0,0]=3 2659 B16R1.4621 O=C(Cc1ccccc1Cl)NCCCCO WXVL_AK0075SB0095 [0,2,0,0,0,0|1,0,0]=3 2660 B16R1.4621 O=C(Cc1ccccc1F)NCCCCO WXVL_AK0075SB0094 [0,2,0,0,0,0|1,0,0]=3 2661 B16R1.4621 O=C(Cc1ccccc1F)NCCCCO WXVL_AK0075SB0094 [0,2,0,0,0,0|1,0,0]=3 2662 B16R1.4621 O=C(Cc1ccccc1I)NCCCCO WXVL_AK0075SB1145 [0,2,0,0,0,0|1,0,0]=3 2663 B16R1.4621 O=C(Cc1ccccc1I)NCCCCO WXVL_AK0075SB1145 [0,2,0,0,0,0|1,0,0]=3 2664 B16R1.4621 O=C(Cc1ccccc1O)NCCCCO WXVL_AK0075SB0400 [0,2,0,0,0,0|1,0,0]=3 2665 B16R1.4621 O=C(Cc1ccccc1O)NCCCCO WXVL_AK0075SB0400 [0,2,0,0,0,0|1,0,0]=3 2666 B16R1.4621 O=C(Cc1cccnc1Cl)NCCCCO WXVL_AK0075SA0056 [0,2,0,0,0,0|2,0,0]=4 2667 B16R1.4621 O=C(Cc1cccnc1Cl)NCCCCO WXVL_AK0075SA0056 [0,2,0,0,0,0|2,0,0]=4 2668 B16R1.4621 O=C(NCCCCO)Nc1ccccc1Br WXVL_AK0075YV0003 [0,2,0,0,0,0|2,0,0]=4 2669 B16R1.4621 O=C(NCCCCO)Nc1ccccc1Br WXVL_AK0075YV0003 [0,2,0,0,0,0|2,0,0]=4 2670 B16R1.4621 O=C(NCCCCO)Nc1ccccc1Cl WXVL_AK0075YV0007 [0,2,0,0,0,0|2,0,0]=4 2671 B16R1.4621 O=C(NCCCCO)Nc1ccccc1Cl WXVL_AK0075YV0007 [0,2,0,0,0,0|2,0,0]=4 2672 B16R1.8504 CCCCCNS(=O)(=O)Cc1ccccc1 WXVL_AK0076HU0025 [0,2,0,0,0,0|2,0,0]=4 2673 B16R1.8504 CCCCCNS(=O)(=O)Cc1ccccc1 WXVL_AK0076HU0025 [0,2,0,0,0,0|2,0,0]=4 2674 B16R1.8504 CCSCCNS(=O)(=O)Cc1ccccc1 WXVL_AK00494HU0025 [0,2,0,0,0,0|2,0,0]=4 2675 B16R1.8504 CCSCCNS(=O)(=O)Cc1ccccc1 WXVL_AK00494HU0025 [0,2,0,0,0,0|2,0,0]=4 2676 B16R1.8504 COCCCNS(=O)(=O)Cc1ccccc1 WXVL_AK00637HU0025 [0,2,0,0,0,0|2,0,0]=4 2677 B16R1.8504 COCCCNS(=O)(=O)Cc1ccccc1 WXVL_AK00637HU0025 [0,2,0,0,0,0|2,0,0]=4 2678 B16R1.8504 CSCCCNS(=O)(=O)Cc1ccccc1 WXVL_AK0965HU0025 [0,2,0,0,0,0|2,0,0]=4 2679 B16R1.8504 CSCCCNS(=O)(=O)Cc1ccccc1 WXVL_AK0965HU0025 [0,2,0,0,0,0|2,0,0]=4 2680 B16R1.8504 O=S(=O)(Cc1ccccc1)NCCCCO WXVL_AK0075HU0025 [0,2,0,0,0,0|2,0,0]=4 2681 B16R1.8504 O=S(=O)(Cc1ccccc1)NCCCCO WXVL_AK0075HU0025 [0,2,0,0,0,0|2,0,0]=4 2682 B16R1.61 CC(C(=O)NCCCO)c1ccc(cc1)Cl WXVL_AK0073SB0484 [0,2,0,0,0,0|2,0,0]=4 2683 B16R1.61 CC(C(=O)NCCCO)c1ccc(cc1)Cl WXVL_AK0073SB0484 [0,2,0,0,0,0|2,0,0]=4 2684 B16R1.61 CC(C(=O)NCCCO)c1ccc(cc1)O WXVL_AK0073SB5200 [0,2,0,0,0,0|2,0,0]=4 2685 B16R1.61 CC(C(=O)NCCCO)c1ccc(cc1)O WXVL_AK0073SB5200 [0,2,0,0,0,0|2,0,0]=4 2686 B16R1.61 CCCCNC(=O)C(=O)c1ccc(cc1)C WXVL_AK00588SB7750 [0,2,0,0,0,0|1,0,1]=4 2687 B16R1.61 CCCCNC(=O)C(=O)c1ccc(cc1)C WXVL_AK00588SB7750 [0,2,0,0,0,0|1,0,1]=4 2688 B16R1.61 CCCCNC(=O)C(=O)c1ccc(cc1)Cl WXVL_AK00588SB3791 [0,2,0,0,0,0|1,0,1]=4 2689 B16R1.61 CCCCNC(=O)C(=O)c1ccc(cc1)Cl WXVL_AK00588SB3791 [0,2,0,0,0,0|1,0,1]=4 2690 B16R1.61 CCCCNC(=O)C(C)c1ccc(cc1)C WXVL_AK00588SB0423 [0,2,0,0,0,0|1,0,0]=3 2691 B16R1.61 CCCCNC(=O)C(C)c1ccc(cc1)C WXVL_AK00588SB0423 [0,2,0,0,0,0|1,0,0]=3 2692 B16R1.61 CCCCNC(=O)C(C)c1ccc(cc1)Cl WXVL_AK00588SB0484 [0,2,0,0,0,0|1,0,0]=3 2693 B16R1.61 CCCCNC(=O)C(C)c1ccc(cc1)Cl WXVL_AK00588SB0484 [0,2,0,0,0,0|1,0,0]=3 2694 B16R1.61 CCCCNC(=O)C(C)c1ccc(cc1)O WXVL_AK00588SB5200 [0,2,0,0,0,0|1,0,0]=3 2695 B16R1.61 CCCCNC(=O)C(C)c1ccc(cc1)O WXVL_AK00588SB5200 [0,2,0,0,0,0|1,0,0]=3 2696 B16R1.61 CSCCNC(=O)C(C)c1ccc(cc1)C WXVL_AK00440SB0423 [0,2,0,0,0,0|2,0,0]=4 2697 B16R1.61 CSCCNC(=O)C(C)c1ccc(cc1)C WXVL_AK00440SB0423 [0,2,0,0,0,0|2,0,0]=4 2698 B16R1.61 CSCCNC(=O)C(C)c1ccc(cc1)Cl WXVL_AK00440SB0484 [0,2,0,0,0,0|2,0,0]=4 2699 B16R1.61 CSCCNC(=O)C(C)c1ccc(cc1)Cl WXVL_AK00440SB0484 [0,2,0,0,0,0|2,0,0]=4 2700 B16R1.61 CSCCNC(=O)C(C)c1ccc(cc1)O WXVL_AK00440SB5200 [0,2,0,0,0,0|2,0,0]=4 2701 B16R1.61 CSCCNC(=O)C(C)c1ccc(cc1)O WXVL_AK00440SB5200 [0,2,0,0,0,0|2,0,0]=4 2702 B16R1.61 Cc1ccc(cc1)C(C)C(=O)NCCCO WXVL_AK0073SB0423 [0,2,0,0,0,0|2,0,0]=4 2703 B16R1.61 Cc1ccc(cc1)C(C)C(=O)NCCCO WXVL_AK0073SB0423 [0,2,0,0,0,0|2,0,0]=4 2704 B16R1.62 CCCCNC(=O)C(O)c1cccc(c1)Br WXVL_AK00588SA00095 [0,2,0,0,0,0|1,0,0]=3 2705 B16R1.62 CCCCNC(=O)C(O)c1cccc(c1)Br WXVL_AK00588SA00095 [0,2,0,0,0,0|1,0,0]=3 2706 B16R1.62 CSCCNC(=O)C(O)c1cccc(c1)Br WXVL_AK00440SA00095 [0,2,0,0,0,0|2,0,0]=4 2707 B16R1.62 CSCCNC(=O)C(O)c1cccc(c1)Br WXVL_AK00440SA00095 [0,2,0,0,0,0|2,0,0]=4 2708 B16R1.62 O=C(NCCCO)C(O)c1cccc(c1)Br WXVL_AK0073SA00095 [0,2,0,0,0,0|2,0,0]=4 2709 B16R1.62 O=C(NCCCO)C(O)c1cccc(c1)Br WXVL_AK0073SA00095 [0,2,0,0,0,0|2,0,0]=4 2710 B16R1.613 CC(C(=O)NCCN(C)C)c1ccccc1 WXVL_AK0058SB2326 [0,2,0,0,0,0|2,0,0]=4 2711 B16R1.613 CC(C(=O)NCCN(C)C)c1ccccc1 WXVL_AK0058SB2326 [0,2,0,0,0,0|2,0,0]=4 2712 B16R1.613 CC(C)CCNC(=O)C(=O)c1ccccc1 WXVL_AK0068SB0050 [0,2,0,0,0,0|1,0,1]=4 2713 B16R1.613 CC(C)CCNC(=O)C(=O)c1ccccc1 WXVL_AK0068SB0050 [0,2,0,0,0,0|1,0,1]=4 2714 B16R1.613 CC(C)CCNC(=O)C(C)c1ccccc1 WXVL_AK0068SB2326 [0,2,0,0,0,0|1,0,0]=3 2715 B16R1.613 CC(C)CCNC(=O)C(C)c1ccccc1 WXVL_AK0068SB2326 [0,2,0,0,0,0|1,0,0]=3 2716 B16R1.613 CC(C)CCNC(=O)C(O)c1ccccc1 WXVL_AK0068SB0168 [0,2,0,0,0,0|1,0,0]=3 2717 B16R1.613 CC(C)CCNC(=O)C(O)c1ccccc1 WXVL_AK0068SB0168 [0,2,0,0,0,0|1,0,0]=3 2718 B16R1.613 CN(C)CCNC(=O)C(O)c1ccccc1 WXVL_AK0058SB0168 [0,2,0,0,0,0|2,0,0]=4 2719 B16R1.613 CN(C)CCNC(=O)C(O)c1ccccc1 WXVL_AK0058SB0168 [0,2,0,0,0,0|2,0,0]=4 2720 B16R1.915 CC(CCO)NC(=O)C(C)c1ccccc1 WXVL_AK1288SB2326 [0,2,0,0,0,0|2,0,0]=4 2721 B16R1.915 CC(CCO)NC(=O)C(C)c1ccccc1 WXVL_AK1288SB2326 [0,2,0,0,0,0|2,0,0]=4 2722 B16R1.915 CC(CCO)NC(=O)C(O)c1ccccc1 WXVL_AK1288SB0168 [0,2,0,0,0,0|2,0,0]=4 2723 B16R1.915 CC(CCO)NC(=O)C(O)c1ccccc1 WXVL_AK1288SB0168 [0,2,0,0,0,0|2,0,0]=4 2724 B16R1.915 CCC[C@H](C)NC(=O)C(=O)c1ccccc1 WXVL_AK00682SB0050 [0,2,0,0,0,0|1,0,1]=4 2725 B16R1.915 CCC[C@H](C)NC(=O)C(=O)c1ccccc1 WXVL_AK00682SB0050 [0,2,0,0,0,0|1,0,1]=4 2726 B16R1.915 CCC[C@H](C)NC(=O)C(C)c1ccccc1 WXVL_AK00682SB2326 [0,2,0,0,0,0|1,0,0]=3 2727 B16R1.915 CCC[C@H](C)NC(=O)C(C)c1ccccc1 WXVL_AK00682SB2326 [0,2,0,0,0,0|1,0,0]=3 2728 B16R1.915 CCC[C@H](C)NC(=O)C(O)c1ccccc1 WXVL_AK00682SB0168 [0,2,0,0,0,0|1,0,0]=3 2729 B16R1.915 CCC[C@H](C)NC(=O)C(O)c1ccccc1 WXVL_AK00682SB0168 [0,2,0,0,0,0|1,0,0]=3 2730 B16R1.915 COC[C@@H](C)NC(=O)C(C)c1ccccc1 WXVL_AK00613SB2326 [0,2,0,0,0,0|2,0,0]=4 2731 B16R1.915 COC[C@@H](C)NC(=O)C(C)c1ccccc1 WXVL_AK00613SB2326 [0,2,0,0,0,0|2,0,0]=4 2732 B16R1.915 COC[C@@H](C)NC(=O)C(O)c1ccccc1 WXVL_AK00613SB0168 [0,2,0,0,0,0|2,0,0]=4 2733 B16R1.915 COC[C@@H](C)NC(=O)C(O)c1ccccc1 WXVL_AK00613SB0168 [0,2,0,0,0,0|2,0,0]=4 2734 B16R1.915 COC[C@H](C)NC(=O)C(C)c1ccccc1 WXVL_AK0137SB2326 [0,2,0,0,0,0|2,0,0]=4 2735 B16R1.915 COC[C@H](C)NC(=O)C(C)c1ccccc1 WXVL_AK0137SB2326 [0,2,0,0,0,0|2,0,0]=4 2736 B16R1.915 COC[C@H](C)NC(=O)C(O)c1ccccc1 WXVL_AK0137SB0168 [0,2,0,0,0,0|2,0,0]=4 2737 B16R1.915 COC[C@H](C)NC(=O)C(O)c1ccccc1 WXVL_AK0137SB0168 [0,2,0,0,0,0|2,0,0]=4 2738 B16R1.1244 COCCN(C)C(=O)C(C)c1ccccc1 WXVL_AN0085SB2326 [0,2,0,0,0,0|2,0,0]=4 2739 B16R1.1244 COCCN(C)C(=O)C(C)c1ccccc1 WXVL_AN0085SB2326 [0,2,0,0,0,0|2,0,0]=4 2740 B16R1.1244 COCCN(C)C(=O)C(O)c1ccccc1 WXVL_AN0085SB0168 [0,2,0,0,0,0|2,0,0]=4 2741 B16R1.1244 COCCN(C)C(=O)C(O)c1ccccc1 WXVL_AN0085SB0168 [0,2,0,0,0,0|2,0,0]=4 2742 B16R1.1701 CC(C)(C(=O)NCCCO)c1ccccc1 WXVL_AK0073SB0135 [0,2,0,0,0,0|2,0,0]=4 2743 B16R1.1701 CC(C)(C(=O)NCCCO)c1ccccc1 WXVL_AK0073SB0135 [0,2,0,0,0,0|2,0,0]=4 2744 B16R1.1701 CCCCNC(=O)C(C)(C)c1ccccc1 WXVL_AK00588SB0135 [0,2,0,0,0,0|1,0,0]=3 2745 B16R1.1701 CCCCNC(=O)C(C)(C)c1ccccc1 WXVL_AK00588SB0135 [0,2,0,0,0,0|1,0,0]=3 2746 B16R1.1701 CCCCNC(=O)C(F)(F)c1ccccc1 WXVL_AK00588SB1457 [0,2,0,0,0,0|1,0,0]=3 2747 B16R1.1701 CCCCNC(=O)C(F)(F)c1ccccc1 WXVL_AK00588SB1457 [0,2,0,0,0,0|1,0,0]=3 2748 B16R1.1701 CSCCNC(=O)C(C)(C)c1ccccc1 WXVL_AK00440SB0135 [0,2,0,0,0,0|2,0,0]=4 2749 B16R1.1701 CSCCNC(=O)C(C)(C)c1ccccc1 WXVL_AK00440SB0135 [0,2,0,0,0,0|2,0,0]=4 2750 B16R1.1701 CSCCNC(=O)C(F)(F)c1ccccc1 WXVL_AK00440SB1457 [0,2,0,0,0,0|2,0,0]=4 2751 B16R1.1701 CSCCNC(=O)C(F)(F)c1ccccc1 WXVL_AK00440SB1457 [0,2,0,0,0,0|2,0,0]=4 2752 B16R1.1701 O=C(NCCCO)C(F)(F)c1ccccc1 WXVL_AK0073SB1457 [0,2,0,0,0,0|2,0,0]=4 2753 B16R1.1701 O=C(NCCCO)C(F)(F)c1ccccc1 WXVL_AK0073SB1457 [0,2,0,0,0,0|2,0,0]=4 2754 B16R1.1705 CCC(C(=O)NCCCO)c1ccccc1 WXVL_AK0073SB0053 [0,2,0,0,0,0|2,0,0]=4 2755 B16R1.1705 CCC(C(=O)NCCCO)c1ccccc1 WXVL_AK0073SB0053 [0,2,0,0,0,0|2,0,0]=4 2756 B16R1.1705 CCC(C(=O)NCCSC)c1ccccc1 WXVL_AK00440SB0053 [0,2,0,0,0,0|2,0,0]=4 2757 B16R1.1705 CCC(C(=O)NCCSC)c1ccccc1 WXVL_AK00440SB0053 [0,2,0,0,0,0|2,0,0]=4 2758 B16R1.1705 CCCCNC(=O)C(CC)c1ccccc1 WXVL_AK00588SB0053 [0,2,0,0,0,0|1,0,0]=3 2759 B16R1.1705 CCCCNC(=O)C(CC)c1ccccc1 WXVL_AK00588SB0053 [0,2,0,0,0,0|1,0,0]=3 2760 B16R1.1705 CCCCNC(=O)C(CO)c1ccccc1 WXVL_AK00588SB3228 [0,2,0,0,0,0|1,0,0]=3 2761 B16R1.1705 CCCCNC(=O)C(CO)c1ccccc1 WXVL_AK00588SB3228 [0,2,0,0,0,0|1,0,0]=3 2762 B16R1.1705 CCCCNC(=O)[C@H](OC)c1ccccc1 WXVL_AK00588SB0081 [0,2,0,0,0,0|1,0,0]=3 2763 B16R1.1705 CCCCNC(=O)[C@H](OC)c1ccccc1 WXVL_AK00588SB0081 [0,2,0,0,0,0|1,0,0]=3 2764 B16R1.1705 CO[C@@H](C(=O)NCCCO)c1ccccc1 WXVL_AK0073SB0081 [0,2,0,0,0,0|2,0,0]=4 2765 B16R1.1705 CO[C@@H](C(=O)NCCCO)c1ccccc1 WXVL_AK0073SB0081 [0,2,0,0,0,0|2,0,0]=4 2766 B16R1.1705 CO[C@@H](C(=O)NCCSC)c1ccccc1 WXVL_AK00440SB0081 [0,2,0,0,0,0|2,0,0]=4 2767 B16R1.1705 CO[C@@H](C(=O)NCCSC)c1ccccc1 WXVL_AK00440SB0081 [0,2,0,0,0,0|2,0,0]=4 2768 B16R1.1705 CSCCNC(=O)C(CO)c1ccccc1 WXVL_AK00440SB3228 [0,2,0,0,0,0|2,0,0]=4 2769 B16R1.1705 CSCCNC(=O)C(CO)c1ccccc1 WXVL_AK00440SB3228 [0,2,0,0,0,0|2,0,0]=4 2770 B16R1.1705 O=C(NCCCO)C(CO)c1ccccc1 WXVL_AK0073SB3228 [0,2,0,0,0,0|2,0,0]=4 2771 B16R1.1705 O=C(NCCCO)C(CO)c1ccccc1 WXVL_AK0073SB3228 [0,2,0,0,0,0|2,0,0]=4 2772 B16R1.2925 CC(C(=O)NC[C@@H](F)CO)c1ccccc1 WXVL_AK00590SB2326 [0,2,0,0,0,0|2,0,0]=4 2773 B16R1.2925 CC(C(=O)NC[C@@H](F)CO)c1ccccc1 WXVL_AK00590SB2326 [0,2,0,0,0,0|2,0,0]=4 2774 B16R1.2925 CC(C(=O)NC[C@H](O)CO)c1ccccc1 WXVL_AK00483SB2326 [0,2,0,0,0,0|2,0,0]=4 2775 B16R1.2925 CC(C(=O)NC[C@H](O)CO)c1ccccc1 WXVL_AK00483SB2326 [0,2,0,0,0,0|2,0,0]=4 2776 B16R1.2925 CO[C@H](C)CNC(=O)C(C)c1ccccc1 WXVL_AK00704SB2326 [0,2,0,0,0,0|2,0,0]=4 2777 B16R1.2925 CO[C@H](C)CNC(=O)C(C)c1ccccc1 WXVL_AK00704SB2326 [0,2,0,0,0,0|2,0,0]=4 2778 B16R1.2925 CO[C@H](C)CNC(=O)C(O)c1ccccc1 WXVL_AK00704SB0168 [0,2,0,0,0,0|2,0,0]=4 2779 B16R1.2925 CO[C@H](C)CNC(=O)C(O)c1ccccc1 WXVL_AK00704SB0168 [0,2,0,0,0,0|2,0,0]=4 2780 B16R1.2925 O=C(NC[C@@H](F)CO)C(O)c1ccccc1 WXVL_AK00590SB0168 [0,2,0,0,0,0|2,0,0]=4 2781 B16R1.2925 O=C(NC[C@@H](F)CO)C(O)c1ccccc1 WXVL_AK00590SB0168 [0,2,0,0,0,0|2,0,0]=4 2782 B16R1.2925 O=C(NC[C@H](O)CO)C(O)c1ccccc1 WXVL_AK00483SB0168 [0,2,0,0,0,0|2,0,0]=4 2783 B16R1.2925 O=C(NC[C@H](O)CO)C(O)c1ccccc1 WXVL_AK00483SB0168 [0,2,0,0,0,0|2,0,0]=4 2784 B16R1.5684 CCCCNC(=O)[C@H](O)c1ccccc1Cl WXVL_AK00588SB3309 [0,2,0,0,0,0|1,0,0]=3 2785 B16R1.5684 CCCCNC(=O)[C@H](O)c1ccccc1Cl WXVL_AK00588SB3309 [0,2,0,0,0,0|1,0,0]=3 2786 B16R1.5684 CSCCNC(=O)[C@H](O)c1ccccc1Cl WXVL_AK00440SB3309 [0,2,0,0,0,0|2,0,0]=4 2787 B16R1.5684 CSCCNC(=O)[C@H](O)c1ccccc1Cl WXVL_AK00440SB3309 [0,2,0,0,0,0|2,0,0]=4 2788 B16R1.5684 O=C(NCCCO)[C@H](O)c1ccccc1Cl WXVL_AK0073SB3309 [0,2,0,0,0,0|2,0,0]=4 2789 B16R1.5684 O=C(NCCCO)[C@H](O)c1ccccc1Cl WXVL_AK0073SB3309 [0,2,0,0,0,0|2,0,0]=4 2790 B16R1.658 CCCCC(O)C(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB3429 [0,2,0,0,0,0|2,0,0]=4 2791 B16R1.658 CCCCC(O)C(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB3429 [0,2,0,0,0,0|2,0,0]=4 2792 B16R1.658 CCCCC(O)C(=O)Nc1ccc(cc1)I WXVL_AG1742SB3429 [0,2,0,0,0,0|2,0,0]=4 2793 B16R1.658 CCCCC(O)C(=O)Nc1ccc(cc1)I WXVL_AG1742SB3429 [0,2,0,0,0,0|2,0,0]=4 2794 B16R1.658 CCCNC(=O)C(=O)Cc1ccc(cc1)O WXVL_AK00504SB2710 [0,2,0,0,0,0|2,0,0]=4 2795 B16R1.658 CCCNC(=O)C(=O)Cc1ccc(cc1)O WXVL_AK00504SB2710 [0,2,0,0,0,0|2,0,0]=4 2796 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)Br WXVL_AN0085SB0926 [0,2,0,0,0,0|2,0,0]=4 2797 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)Br WXVL_AN0085SB0926 [0,2,0,0,0,0|2,0,0]=4 2798 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)C WXVL_AN0085SB0112 [0,2,0,0,0,0|2,0,0]=4 2799 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)C WXVL_AN0085SB0112 [0,2,0,0,0,0|2,0,0]=4 2800 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)Cl WXVL_AN0085SB0107 [0,2,0,0,0,0|2,0,0]=4 2801 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)Cl WXVL_AN0085SB0107 [0,2,0,0,0,0|2,0,0]=4 2802 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)F WXVL_AN0085SB0106 [0,2,0,0,0,0|2,0,0]=4 2803 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)F WXVL_AN0085SB0106 [0,2,0,0,0,0|2,0,0]=4 2804 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)O WXVL_AN0085SB0110 [0,2,0,0,0,0|2,0,0]=4 2805 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)O WXVL_AN0085SB0110 [0,2,0,0,0,0|2,0,0]=4 2806 B16R1.955 CC(CCO)NC(=O)Cc1ccc(cc1)Br WXVL_AK1288SB0926 [0,2,0,0,0,0|2,0,0]=4 2807 B16R1.955 CC(CCO)NC(=O)Cc1ccc(cc1)Br WXVL_AK1288SB0926 [0,2,0,0,0,0|2,0,0]=4 2808 B16R1.955 CC(CCO)NC(=O)Cc1ccc(cc1)Cl WXVL_AK1288SB0107 [0,2,0,0,0,0|2,0,0]=4 2809 B16R1.955 CC(CCO)NC(=O)Cc1ccc(cc1)Cl WXVL_AK1288SB0107 [0,2,0,0,0,0|2,0,0]=4 2810 B16R1.955 CC(CCO)NC(=O)Cc1ccc(cc1)F WXVL_AK1288SB0106 [0,2,0,0,0,0|2,0,0]=4 2811 B16R1.955 CC(CCO)NC(=O)Cc1ccc(cc1)F WXVL_AK1288SB0106 [0,2,0,0,0,0|2,0,0]=4 2812 B16R1.955 CC(CCO)NC(=O)Cc1ccc(cc1)O WXVL_AK1288SB0110 [0,2,0,0,0,0|2,0,0]=4 2813 B16R1.955 CC(CCO)NC(=O)Cc1ccc(cc1)O WXVL_AK1288SB0110 [0,2,0,0,0,0|2,0,0]=4 2814 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(cc1)Br WXVL_AK00682SB0926 [0,2,0,0,0,0|1,0,0]=3 2815 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(cc1)Br WXVL_AK00682SB0926 [0,2,0,0,0,0|1,0,0]=3 2816 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(cc1)C WXVL_AK00682SB0112 [0,2,0,0,0,0|1,0,0]=3 2817 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(cc1)C WXVL_AK00682SB0112 [0,2,0,0,0,0|1,0,0]=3 2818 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(cc1)Cl WXVL_AK00682SB0107 [0,2,0,0,0,0|1,0,0]=3 2819 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(cc1)Cl WXVL_AK00682SB0107 [0,2,0,0,0,0|1,0,0]=3 2820 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(cc1)F WXVL_AK00682SB0106 [0,2,0,0,0,0|1,0,0]=3 2821 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(cc1)F WXVL_AK00682SB0106 [0,2,0,0,0,0|1,0,0]=3 2822 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(cc1)O WXVL_AK00682SB0110 [0,2,0,0,0,0|1,0,0]=3 2823 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(cc1)O WXVL_AK00682SB0110 [0,2,0,0,0,0|1,0,0]=3 2824 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(cn1)Br WXVL_AK00682SA0212 [0,2,0,0,0,0|2,0,0]=4 2825 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(cn1)Br WXVL_AK00682SA0212 [0,2,0,0,0,0|2,0,0]=4 2826 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(cn1)Cl WXVL_AK00682SA0537 [0,2,0,0,0,0|2,0,0]=4 2827 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(cn1)Cl WXVL_AK00682SA0537 [0,2,0,0,0,0|2,0,0]=4 2828 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(cn1)F WXVL_AK00682SA0011 [0,2,0,0,0,0|2,0,0]=4 2829 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(cn1)F WXVL_AK00682SA0011 [0,2,0,0,0,0|2,0,0]=4 2830 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(cn1)O WXVL_AK00682SA2976 [0,2,0,0,0,0|2,0,0]=4 2831 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(cn1)O WXVL_AK00682SA2976 [0,2,0,0,0,0|2,0,0]=4 2832 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(nc1)Br WXVL_AK00682SA00056 [0,2,0,0,0,0|2,0,0]=4 2833 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(nc1)Br WXVL_AK00682SA00056 [0,2,0,0,0,0|2,0,0]=4 2834 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(nc1)C WXVL_AK00682SA0250 [0,2,0,0,0,0|2,0,0]=4 2835 B16R1.955 CCC[C@H](C)NC(=O)Cc1ccc(nc1)C WXVL_AK00682SA0250 [0,2,0,0,0,0|2,0,0]=4 2836 B16R1.955 CCC[C@H](C)NC(=O)Nc1ccc(cc1)C WXVL_AK00682YV0026 [0,2,0,0,0,0|2,0,0]=4 2837 B16R1.955 CCC[C@H](C)NC(=O)Nc1ccc(cc1)C WXVL_AK00682YV0026 [0,2,0,0,0,0|2,0,0]=4 2838 B16R1.955 CCC[C@H](C)NC(=O)Nc1ccc(cc1)Cl WXVL_AK00682YV0023 [0,2,0,0,0,0|2,0,0]=4 2839 B16R1.955 CCC[C@H](C)NC(=O)Nc1ccc(cc1)Cl WXVL_AK00682YV0023 [0,2,0,0,0,0|2,0,0]=4 2840 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)Br WXVL_AK00613SB0926 [0,2,0,0,0,0|2,0,0]=4 2841 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)Br WXVL_AK00613SB0926 [0,2,0,0,0,0|2,0,0]=4 2842 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)C WXVL_AK00613SB0112 [0,2,0,0,0,0|2,0,0]=4 2843 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)C WXVL_AK00613SB0112 [0,2,0,0,0,0|2,0,0]=4 2844 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)Cl WXVL_AK00613SB0107 [0,2,0,0,0,0|2,0,0]=4 2845 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)Cl WXVL_AK00613SB0107 [0,2,0,0,0,0|2,0,0]=4 2846 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)F WXVL_AK00613SB0106 [0,2,0,0,0,0|2,0,0]=4 2847 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)F WXVL_AK00613SB0106 [0,2,0,0,0,0|2,0,0]=4 2848 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)O WXVL_AK00613SB0110 [0,2,0,0,0,0|2,0,0]=4 2849 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)O WXVL_AK00613SB0110 [0,2,0,0,0,0|2,0,0]=4 2850 B16R1.955 COC[C@H](C)NC(=O)Cc1ccc(cc1)Br WXVL_AK0137SB0926 [0,2,0,0,0,0|2,0,0]=4 2851 B16R1.955 COC[C@H](C)NC(=O)Cc1ccc(cc1)Br WXVL_AK0137SB0926 [0,2,0,0,0,0|2,0,0]=4 2852 B16R1.955 COC[C@H](C)NC(=O)Cc1ccc(cc1)C WXVL_AK0137SB0112 [0,2,0,0,0,0|2,0,0]=4 2853 B16R1.955 COC[C@H](C)NC(=O)Cc1ccc(cc1)C WXVL_AK0137SB0112 [0,2,0,0,0,0|2,0,0]=4 2854 B16R1.955 COC[C@H](C)NC(=O)Cc1ccc(cc1)Cl WXVL_AK0137SB0107 [0,2,0,0,0,0|2,0,0]=4 2855 B16R1.955 COC[C@H](C)NC(=O)Cc1ccc(cc1)Cl WXVL_AK0137SB0107 [0,2,0,0,0,0|2,0,0]=4 2856 B16R1.955 COC[C@H](C)NC(=O)Cc1ccc(cc1)F WXVL_AK0137SB0106 [0,2,0,0,0,0|2,0,0]=4 2857 B16R1.955 COC[C@H](C)NC(=O)Cc1ccc(cc1)F WXVL_AK0137SB0106 [0,2,0,0,0,0|2,0,0]=4 2858 B16R1.955 COC[C@H](C)NC(=O)Cc1ccc(cc1)O WXVL_AK0137SB0110 [0,2,0,0,0,0|2,0,0]=4 2859 B16R1.955 COC[C@H](C)NC(=O)Cc1ccc(cc1)O WXVL_AK0137SB0110 [0,2,0,0,0,0|2,0,0]=4 2860 B16R1.955 Cc1ccc(cc1)CC(=O)NC(C)CCO WXVL_AK1288SB0112 [0,2,0,0,0,0|2,0,0]=4 2861 B16R1.955 Cc1ccc(cc1)CC(=O)NC(C)CCO WXVL_AK1288SB0112 [0,2,0,0,0,0|2,0,0]=4 2862 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB1301 [0,2,0,0,0,0|2,0,0]=4 2863 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB1301 [0,2,0,0,0,0|2,0,0]=4 2864 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)I WXVL_AG1742SB1301 [0,2,0,0,0,0|2,0,0]=4 2865 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)I WXVL_AG1742SB1301 [0,2,0,0,0,0|2,0,0]=4 2866 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)Br WXVL_AK0068SB0926 [0,2,0,0,0,0|1,0,0]=3 2867 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)Br WXVL_AK0068SB0926 [0,2,0,0,0,0|1,0,0]=3 2868 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)Cl WXVL_AK0068SB0107 [0,2,0,0,0,0|1,0,0]=3 2869 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)Cl WXVL_AK0068SB0107 [0,2,0,0,0,0|1,0,0]=3 2870 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)F WXVL_AK0068SB0106 [0,2,0,0,0,0|1,0,0]=3 2871 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)F WXVL_AK0068SB0106 [0,2,0,0,0,0|1,0,0]=3 2872 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)O WXVL_AK0068SB0110 [0,2,0,0,0,0|1,0,0]=3 2873 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)O WXVL_AK0068SB0110 [0,2,0,0,0,0|1,0,0]=3 2874 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cn1)Br WXVL_AK0068SA0212 [0,2,0,0,0,0|2,0,0]=4 2875 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cn1)Br WXVL_AK0068SA0212 [0,2,0,0,0,0|2,0,0]=4 2876 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cn1)Cl WXVL_AK0068SA0537 [0,2,0,0,0,0|2,0,0]=4 2877 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cn1)Cl WXVL_AK0068SA0537 [0,2,0,0,0,0|2,0,0]=4 2878 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cn1)F WXVL_AK0068SA0011 [0,2,0,0,0,0|2,0,0]=4 2879 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cn1)F WXVL_AK0068SA0011 [0,2,0,0,0,0|2,0,0]=4 2880 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cn1)O WXVL_AK0068SA2976 [0,2,0,0,0,0|2,0,0]=4 2881 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cn1)O WXVL_AK0068SA2976 [0,2,0,0,0,0|2,0,0]=4 2882 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(nc1)Br WXVL_AK0068SA00056 [0,2,0,0,0,0|2,0,0]=4 2883 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(nc1)Br WXVL_AK0068SA00056 [0,2,0,0,0,0|2,0,0]=4 2884 B16R1.1067 CC(C)CCNC(=O)Nc1ccc(cc1)Cl WXVL_AK0068YV0023 [0,2,0,0,0,0|2,0,0]=4 2885 B16R1.1067 CC(C)CCNC(=O)Nc1ccc(cc1)Cl WXVL_AK0068YV0023 [0,2,0,0,0,0|2,0,0]=4 2886 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)Br WXVL_AK0058SB0926 [0,2,0,0,0,0|2,0,0]=4 2887 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)Br WXVL_AK0058SB0926 [0,2,0,0,0,0|2,0,0]=4 2888 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)Cl WXVL_AK0058SB0107 [0,2,0,0,0,0|2,0,0]=4 2889 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)Cl WXVL_AK0058SB0107 [0,2,0,0,0,0|2,0,0]=4 2890 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)F WXVL_AK0058SB0106 [0,2,0,0,0,0|2,0,0]=4 2891 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)F WXVL_AK0058SB0106 [0,2,0,0,0,0|2,0,0]=4 2892 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)O WXVL_AK0058SB0110 [0,2,0,0,0,0|2,0,0]=4 2893 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)O WXVL_AK0058SB0110 [0,2,0,0,0,0|2,0,0]=4 2894 B16R1.1067 Cc1ccc(cc1)CC(=O)NCCC(C)C WXVL_AK0068SB0112 [0,2,0,0,0,0|1,0,0]=3 2895 B16R1.1067 Cc1ccc(cc1)CC(=O)NCCC(C)C WXVL_AK0068SB0112 [0,2,0,0,0,0|1,0,0]=3 2896 B16R1.1067 Cc1ccc(cc1)CC(=O)NCCN(C)C WXVL_AK0058SB0112 [0,2,0,0,0,0|2,0,0]=4 2897 B16R1.1067 Cc1ccc(cc1)CC(=O)NCCN(C)C WXVL_AK0058SB0112 [0,2,0,0,0,0|2,0,0]=4 2898 B16R1.1067 Cc1ccc(cc1)NC(=O)NCCC(C)C WXVL_AK0068YV0026 [0,2,0,0,0,0|2,0,0]=4 2899 B16R1.1067 Cc1ccc(cc1)NC(=O)NCCC(C)C WXVL_AK0068YV0026 [0,2,0,0,0,0|2,0,0]=4 2900 B16R1.1067 Cc1ccc(cn1)CC(=O)NCCC(C)C WXVL_AK0068SA0250 [0,2,0,0,0,0|2,0,0]=4 2901 B16R1.1067 Cc1ccc(cn1)CC(=O)NCCC(C)C WXVL_AK0068SA0250 [0,2,0,0,0,0|2,0,0]=4 2902 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)Br WXVL_AK00704SB0926 [0,2,0,0,0,0|2,0,0]=4 2903 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)Br WXVL_AK00704SB0926 [0,2,0,0,0,0|2,0,0]=4 2904 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)C WXVL_AK00704SB0112 [0,2,0,0,0,0|2,0,0]=4 2905 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)C WXVL_AK00704SB0112 [0,2,0,0,0,0|2,0,0]=4 2906 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)Cl WXVL_AK00704SB0107 [0,2,0,0,0,0|2,0,0]=4 2907 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)Cl WXVL_AK00704SB0107 [0,2,0,0,0,0|2,0,0]=4 2908 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)F WXVL_AK00704SB0106 [0,2,0,0,0,0|2,0,0]=4 2909 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)F WXVL_AK00704SB0106 [0,2,0,0,0,0|2,0,0]=4 2910 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)O WXVL_AK00704SB0110 [0,2,0,0,0,0|2,0,0]=4 2911 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)O WXVL_AK00704SB0110 [0,2,0,0,0,0|2,0,0]=4 2912 B16R1.1147 Cc1ccc(cc1)CC(=O)NC[C@@H](F)CO WXVL_AK00590SB0112 [0,2,0,0,0,0|2,0,0]=4 2913 B16R1.1147 Cc1ccc(cc1)CC(=O)NC[C@@H](F)CO WXVL_AK00590SB0112 [0,2,0,0,0,0|2,0,0]=4 2914 B16R1.1147 Cc1ccc(cc1)CC(=O)NC[C@H](O)CO WXVL_AK00483SB0112 [0,2,0,0,0,0|2,0,0]=4 2915 B16R1.1147 Cc1ccc(cc1)CC(=O)NC[C@H](O)CO WXVL_AK00483SB0112 [0,2,0,0,0,0|2,0,0]=4 2916 B16R1.1147 O=C(Cc1ccc(cc1)Br)NC[C@@H](F)CO WXVL_AK00590SB0926 [0,2,0,0,0,0|2,0,0]=4 2917 B16R1.1147 O=C(Cc1ccc(cc1)Br)NC[C@@H](F)CO WXVL_AK00590SB0926 [0,2,0,0,0,0|2,0,0]=4 2918 B16R1.1147 O=C(Cc1ccc(cc1)Br)NC[C@H](O)CO WXVL_AK00483SB0926 [0,2,0,0,0,0|2,0,0]=4 2919 B16R1.1147 O=C(Cc1ccc(cc1)Br)NC[C@H](O)CO WXVL_AK00483SB0926 [0,2,0,0,0,0|2,0,0]=4 2920 B16R1.1147 O=C(Cc1ccc(cc1)Cl)NC[C@@H](F)CO WXVL_AK00590SB0107 [0,2,0,0,0,0|2,0,0]=4 2921 B16R1.1147 O=C(Cc1ccc(cc1)Cl)NC[C@@H](F)CO WXVL_AK00590SB0107 [0,2,0,0,0,0|2,0,0]=4 2922 B16R1.1147 O=C(Cc1ccc(cc1)Cl)NC[C@H](O)CO WXVL_AK00483SB0107 [0,2,0,0,0,0|2,0,0]=4 2923 B16R1.1147 O=C(Cc1ccc(cc1)Cl)NC[C@H](O)CO WXVL_AK00483SB0107 [0,2,0,0,0,0|2,0,0]=4 2924 B16R1.1147 O=C(Cc1ccc(cc1)F)NC[C@@H](F)CO WXVL_AK00590SB0106 [0,2,0,0,0,0|2,0,0]=4 2925 B16R1.1147 O=C(Cc1ccc(cc1)F)NC[C@@H](F)CO WXVL_AK00590SB0106 [0,2,0,0,0,0|2,0,0]=4 2926 B16R1.1147 O=C(Cc1ccc(cc1)F)NC[C@H](O)CO WXVL_AK00483SB0106 [0,2,0,0,0,0|2,0,0]=4 2927 B16R1.1147 O=C(Cc1ccc(cc1)F)NC[C@H](O)CO WXVL_AK00483SB0106 [0,2,0,0,0,0|2,0,0]=4 2928 B16R1.1147 O=C(Cc1ccc(cc1)O)NC[C@@H](F)CO WXVL_AK00590SB0110 [0,2,0,0,0,0|2,0,0]=4 2929 B16R1.1147 O=C(Cc1ccc(cc1)O)NC[C@@H](F)CO WXVL_AK00590SB0110 [0,2,0,0,0,0|2,0,0]=4 2930 B16R1.1147 O=C(Cc1ccc(cc1)O)NC[C@H](O)CO WXVL_AK00483SB0110 [0,2,0,0,0,0|2,0,0]=4 2931 B16R1.1147 O=C(Cc1ccc(cc1)O)NC[C@H](O)CO WXVL_AK00483SB0110 [0,2,0,0,0,0|2,0,0]=4 2932 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)C#N WXVL_AK00588SB0205 [0,2,0,0,0,0|1,0,0]=3 2933 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)C#N WXVL_AK00588SB0205 [0,2,0,0,0,0|1,0,0]=3 2934 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)OC WXVL_AK00588SB0108 [0,2,0,0,0,0|1,0,0]=3 2935 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)OC WXVL_AK00588SB0108 [0,2,0,0,0,0|1,0,0]=3 2936 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)SC WXVL_AK00588SB3213 [0,2,0,0,0,0|1,0,0]=3 2937 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)SC WXVL_AK00588SB3213 [0,2,0,0,0,0|1,0,0]=3 2938 B16R1.7382 CCCCNC(=O)Nc1ccc(cc1)C#N WXVL_AK00588YV0057 [0,2,0,0,0,0|2,0,0]=4 2939 B16R1.7382 CCCCNC(=O)Nc1ccc(cc1)C#N WXVL_AK00588YV0057 [0,2,0,0,0,0|2,0,0]=4 2940 B16R1.7382 CCCCNC(=O)Nc1ccc(cc1)CC WXVL_AK00588YV0051 [0,2,0,0,0,0|2,0,0]=4 2941 B16R1.7382 CCCCNC(=O)Nc1ccc(cc1)CC WXVL_AK00588YV0051 [0,2,0,0,0,0|2,0,0]=4 2942 B16R1.7382 CCCCNC(=O)Nc1ccc(cc1)OC WXVL_AK00588YV0024 [0,2,0,0,0,0|2,0,0]=4 2943 B16R1.7382 CCCCNC(=O)Nc1ccc(cc1)OC WXVL_AK00588YV0024 [0,2,0,0,0,0|2,0,0]=4 2944 B16R1.7382 CCCCNC(=O)Nc1ccc(cc1)SC WXVL_AK00588YV0109 [0,2,0,0,0,0|2,0,0]=4 2945 B16R1.7382 CCCCNC(=O)Nc1ccc(cc1)SC WXVL_AK00588YV0109 [0,2,0,0,0,0|2,0,0]=4 2946 B16R1.7382 COc1ccc(cc1)CC(=O)NCCCO WXVL_AK0073SB0108 [0,2,0,0,0,0|2,0,0]=4 2947 B16R1.7382 COc1ccc(cc1)CC(=O)NCCCO WXVL_AK0073SB0108 [0,2,0,0,0,0|2,0,0]=4 2948 B16R1.7382 COc1ccc(cc1)CC(=O)NCCSC WXVL_AK00440SB0108 [0,2,0,0,0,0|2,0,0]=4 2949 B16R1.7382 COc1ccc(cc1)CC(=O)NCCSC WXVL_AK00440SB0108 [0,2,0,0,0,0|2,0,0]=4 2950 B16R1.7382 CSCCNC(=O)Cc1ccc(cc1)C#N WXVL_AK00440SB0205 [0,2,0,0,0,0|2,0,0]=4 2951 B16R1.7382 CSCCNC(=O)Cc1ccc(cc1)C#N WXVL_AK00440SB0205 [0,2,0,0,0,0|2,0,0]=4 2952 B16R1.7382 CSCCNC(=O)Cc1ccc(cc1)SC WXVL_AK00440SB3213 [0,2,0,0,0,0|2,0,0]=4 2953 B16R1.7382 CSCCNC(=O)Cc1ccc(cc1)SC WXVL_AK00440SB3213 [0,2,0,0,0,0|2,0,0]=4 2954 B16R1.7382 CSc1ccc(cc1)CC(=O)NCCCO WXVL_AK0073SB3213 [0,2,0,0,0,0|2,0,0]=4 2955 B16R1.7382 CSc1ccc(cc1)CC(=O)NCCCO WXVL_AK0073SB3213 [0,2,0,0,0,0|2,0,0]=4 2956 B16R1.7382 N#Cc1ccc(cc1)CC(=O)NCCCO WXVL_AK0073SB0205 [0,2,0,0,0,0|2,0,0]=4 2957 B16R1.7382 N#Cc1ccc(cc1)CC(=O)NCCCO WXVL_AK0073SB0205 [0,2,0,0,0,0|2,0,0]=4 2958 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Br)F WXVL_AK00588SB1198 [0,2,0,0,0,0|1,0,0]=3 2959 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Br)F WXVL_AK00588SB1198 [0,2,0,0,0,0|1,0,0]=3 2960 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)C)C WXVL_AK00588SB1486 [0,2,0,0,0,0|1,0,0]=3 2961 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)C)C WXVL_AK00588SB1486 [0,2,0,0,0,0|1,0,0]=3 2962 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Cl)Cl WXVL_AK00588SB0102 [0,2,0,0,0,0|1,0,0]=3 2963 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Cl)Cl WXVL_AK00588SB0102 [0,2,0,0,0,0|1,0,0]=3 2964 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)Br WXVL_AK00588SB0282 [0,2,0,0,0,0|1,0,0]=3 2965 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)Br WXVL_AK00588SB0282 [0,2,0,0,0,0|1,0,0]=3 2966 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)Cl WXVL_AK00588SB0499 [0,2,0,0,0,0|1,0,0]=3 2967 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)Cl WXVL_AK00588SB0499 [0,2,0,0,0,0|1,0,0]=3 2968 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)F WXVL_AK00588SB0131 [0,2,0,0,0,0|1,0,0]=3 2969 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)F WXVL_AK00588SB0131 [0,2,0,0,0,0|1,0,0]=3 2970 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)O)O WXVL_AK00588SB1141 [0,2,0,0,0,0|1,0,0]=3 2971 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)O)O WXVL_AK00588SB1141 [0,2,0,0,0,0|1,0,0]=3 2972 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)C)C WXVL_AK00588YV0045 [0,2,0,0,0,0|2,0,0]=4 2973 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)C)C WXVL_AK00588YV0045 [0,2,0,0,0,0|2,0,0]=4 2974 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)C)Cl WXVL_AK00588YV0199 [0,2,0,0,0,0|2,0,0]=4 2975 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)C)Cl WXVL_AK00588YV0199 [0,2,0,0,0,0|2,0,0]=4 2976 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)Cl)F WXVL_AK00588YV0102 [0,2,0,0,0,0|2,0,0]=4 2977 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)Cl)F WXVL_AK00588YV0102 [0,2,0,0,0,0|2,0,0]=4 2978 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Br)F WXVL_AK00440SB1198 [0,2,0,0,0,0|2,0,0]=4 2979 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Br)F WXVL_AK00440SB1198 [0,2,0,0,0,0|2,0,0]=4 2980 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)C)C WXVL_AK00440SB1486 [0,2,0,0,0,0|2,0,0]=4 2981 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)C)C WXVL_AK00440SB1486 [0,2,0,0,0,0|2,0,0]=4 2982 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Cl)Cl WXVL_AK00440SB0102 [0,2,0,0,0,0|2,0,0]=4 2983 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Cl)Cl WXVL_AK00440SB0102 [0,2,0,0,0,0|2,0,0]=4 2984 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)Br WXVL_AK00440SB0282 [0,2,0,0,0,0|2,0,0]=4 2985 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)Br WXVL_AK00440SB0282 [0,2,0,0,0,0|2,0,0]=4 2986 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)Cl WXVL_AK00440SB0499 [0,2,0,0,0,0|2,0,0]=4 2987 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)Cl WXVL_AK00440SB0499 [0,2,0,0,0,0|2,0,0]=4 2988 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)F WXVL_AK00440SB0131 [0,2,0,0,0,0|2,0,0]=4 2989 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)F WXVL_AK00440SB0131 [0,2,0,0,0,0|2,0,0]=4 2990 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)O)O WXVL_AK00440SB1141 [0,2,0,0,0,0|2,0,0]=4 2991 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)O)O WXVL_AK00440SB1141 [0,2,0,0,0,0|2,0,0]=4 2992 B16R1.7393 Cc1ccc(cc1C)CC(=O)NCCCO WXVL_AK0073SB1486 [0,2,0,0,0,0|2,0,0]=4 2993 B16R1.7393 Cc1ccc(cc1C)CC(=O)NCCCO WXVL_AK0073SB1486 [0,2,0,0,0,0|2,0,0]=4 2994 B16R1.7393 O=C(Cc1ccc(c(c1)Br)F)NCCCO WXVL_AK0073SB1198 [0,2,0,0,0,0|2,0,0]=4 2995 B16R1.7393 O=C(Cc1ccc(c(c1)Br)F)NCCCO WXVL_AK0073SB1198 [0,2,0,0,0,0|2,0,0]=4 2996 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)Cl)NCCCO WXVL_AK0073SB0102 [0,2,0,0,0,0|2,0,0]=4 2997 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)Cl)NCCCO WXVL_AK0073SB0102 [0,2,0,0,0,0|2,0,0]=4 2998 B16R1.7393 O=C(Cc1ccc(c(c1)F)Br)NCCCO WXVL_AK0073SB0282 [0,2,0,0,0,0|2,0,0]=4 2999 B16R1.7393 O=C(Cc1ccc(c(c1)F)Br)NCCCO WXVL_AK0073SB0282 [0,2,0,0,0,0|2,0,0]=4 3000 B16R1.7393 O=C(Cc1ccc(c(c1)F)Cl)NCCCO WXVL_AK0073SB0499 [0,2,0,0,0,0|2,0,0]=4 3001 B16R1.7393 O=C(Cc1ccc(c(c1)F)Cl)NCCCO WXVL_AK0073SB0499 [0,2,0,0,0,0|2,0,0]=4 3002 B16R1.7393 O=C(Cc1ccc(c(c1)F)F)NCCCO WXVL_AK0073SB0131 [0,2,0,0,0,0|2,0,0]=4 3003 B16R1.7393 O=C(Cc1ccc(c(c1)F)F)NCCCO WXVL_AK0073SB0131 [0,2,0,0,0,0|2,0,0]=4 3004 B16R1.7393 O=C(Cc1ccc(c(c1)O)O)NCCCO WXVL_AK0073SB1141 [0,2,0,0,0,0|2,0,0]=4 3005 B16R1.7393 O=C(Cc1ccc(c(c1)O)O)NCCCO WXVL_AK0073SB1141 [0,2,0,0,0,0|2,0,0]=4 3006 B16R1.20522 CCCCNS(=O)(=O)Cc1ccc(cc1)Br WXVL_AK00588HU0657 [0,2,0,0,0,0|2,0,0]=4 3007 B16R1.20522 CCCCNS(=O)(=O)Cc1ccc(cc1)Br WXVL_AK00588HU0657 [0,2,0,0,0,0|2,0,0]=4 3008 B16R1.20522 CCCCNS(=O)(=O)Cc1ccc(cc1)C WXVL_AK00588HU0096 [0,2,0,0,0,0|2,0,0]=4 3009 B16R1.20522 CCCCNS(=O)(=O)Cc1ccc(cc1)C WXVL_AK00588HU0096 [0,2,0,0,0,0|2,0,0]=4 3010 B16R1.20522 CCCCNS(=O)(=O)Cc1ccc(cc1)Cl WXVL_AK00588HU0094 [0,2,0,0,0,0|2,0,0]=4 3011 B16R1.20522 CCCCNS(=O)(=O)Cc1ccc(cc1)Cl WXVL_AK00588HU0094 [0,2,0,0,0,0|2,0,0]=4 3012 B16R1.20522 CCCCNS(=O)(=O)Cc1ccc(cc1)F WXVL_AK00588HU0095 [0,2,0,0,0,0|2,0,0]=4 3013 B16R1.20522 CCCCNS(=O)(=O)Cc1ccc(cc1)F WXVL_AK00588HU0095 [0,2,0,0,0,0|2,0,0]=4 3014 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)Br WXVL_AK00588SB4290 [0,2,0,0,0,0|1,0,0]=3 3015 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)Br WXVL_AK00588SB4290 [0,2,0,0,0,0|1,0,0]=3 3016 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)F WXVL_AK00588SB1181 [0,2,0,0,0,0|1,0,0]=3 3017 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)F WXVL_AK00588SB1181 [0,2,0,0,0,0|1,0,0]=3 3018 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)Br WXVL_AK00588SB5365 [0,2,0,0,0,0|1,0,0]=3 3019 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)Br WXVL_AK00588SB5365 [0,2,0,0,0,0|1,0,0]=3 3020 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)Br WXVL_AK00588SB2522 [0,2,0,0,0,0|1,0,0]=3 3021 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)Br WXVL_AK00588SB2522 [0,2,0,0,0,0|1,0,0]=3 3022 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)F WXVL_AK00588SB1409 [0,2,0,0,0,0|1,0,0]=3 3023 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)F WXVL_AK00588SB1409 [0,2,0,0,0,0|1,0,0]=3 3024 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)Br WXVL_AK00588SB0280 [0,2,0,0,0,0|1,0,0]=3 3025 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)Br WXVL_AK00588SB0280 [0,2,0,0,0,0|1,0,0]=3 3026 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)Cl WXVL_AK00588SB1401 [0,2,0,0,0,0|1,0,0]=3 3027 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)Cl WXVL_AK00588SB1401 [0,2,0,0,0,0|1,0,0]=3 3028 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)F WXVL_AK00588SB0445 [0,2,0,0,0,0|1,0,0]=3 3029 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)F WXVL_AK00588SB0445 [0,2,0,0,0,0|1,0,0]=3 3030 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1I)Br WXVL_AK00588SA00082 [0,2,0,0,0,0|1,0,0]=3 3031 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1I)Br WXVL_AK00588SA00082 [0,2,0,0,0,0|1,0,0]=3 3032 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1C)Br WXVL_AK00588YV0058 [0,2,0,0,0,0|2,0,0]=4 3033 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1C)Br WXVL_AK00588YV0058 [0,2,0,0,0,0|2,0,0]=4 3034 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1C)C WXVL_AK00588YV0041 [0,2,0,0,0,0|2,0,0]=4 3035 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1C)C WXVL_AK00588YV0041 [0,2,0,0,0,0|2,0,0]=4 3036 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Cl)Cl WXVL_AK00588YV0008 [0,2,0,0,0,0|2,0,0]=4 3037 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Cl)Cl WXVL_AK00588YV0008 [0,2,0,0,0,0|2,0,0]=4 3038 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Br)Br WXVL_AK00440SB4290 [0,2,0,0,0,0|2,0,0]=4 3039 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Br)Br WXVL_AK00440SB4290 [0,2,0,0,0,0|2,0,0]=4 3040 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Br)F WXVL_AK00440SB1181 [0,2,0,0,0,0|2,0,0]=4 3041 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Br)F WXVL_AK00440SB1181 [0,2,0,0,0,0|2,0,0]=4 3042 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1C)Br WXVL_AK00440SB5365 [0,2,0,0,0,0|2,0,0]=4 3043 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1C)Br WXVL_AK00440SB5365 [0,2,0,0,0,0|2,0,0]=4 3044 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Cl)Br WXVL_AK00440SB2522 [0,2,0,0,0,0|2,0,0]=4 3045 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Cl)Br WXVL_AK00440SB2522 [0,2,0,0,0,0|2,0,0]=4 3046 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Cl)F WXVL_AK00440SB1409 [0,2,0,0,0,0|2,0,0]=4 3047 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Cl)F WXVL_AK00440SB1409 [0,2,0,0,0,0|2,0,0]=4 3048 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)Br WXVL_AK00440SB0280 [0,2,0,0,0,0|2,0,0]=4 3049 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)Br WXVL_AK00440SB0280 [0,2,0,0,0,0|2,0,0]=4 3050 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)Cl WXVL_AK00440SB1401 [0,2,0,0,0,0|2,0,0]=4 3051 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)Cl WXVL_AK00440SB1401 [0,2,0,0,0,0|2,0,0]=4 3052 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)F WXVL_AK00440SB0445 [0,2,0,0,0,0|2,0,0]=4 3053 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)F WXVL_AK00440SB0445 [0,2,0,0,0,0|2,0,0]=4 3054 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1I)Br WXVL_AK00440SA00082 [0,2,0,0,0,0|2,0,0]=4 3055 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1I)Br WXVL_AK00440SA00082 [0,2,0,0,0,0|2,0,0]=4 3056 B16R1.22955 Cc1cc(ccc1CC(=O)NCCCO)Br WXVL_AK0073SB5365 [0,2,0,0,0,0|2,0,0]=4 3057 B16R1.22955 Cc1cc(ccc1CC(=O)NCCCO)Br WXVL_AK0073SB5365 [0,2,0,0,0,0|2,0,0]=4 3058 B16R1.22955 O=C(Cc1ccc(cc1Br)Br)NCCCO WXVL_AK0073SB4290 [0,2,0,0,0,0|2,0,0]=4 3059 B16R1.22955 O=C(Cc1ccc(cc1Br)Br)NCCCO WXVL_AK0073SB4290 [0,2,0,0,0,0|2,0,0]=4 3060 B16R1.22955 O=C(Cc1ccc(cc1Br)F)NCCCO WXVL_AK0073SB1181 [0,2,0,0,0,0|2,0,0]=4 3061 B16R1.22955 O=C(Cc1ccc(cc1Br)F)NCCCO WXVL_AK0073SB1181 [0,2,0,0,0,0|2,0,0]=4 3062 B16R1.22955 O=C(Cc1ccc(cc1Cl)Br)NCCCO WXVL_AK0073SB2522 [0,2,0,0,0,0|2,0,0]=4 3063 B16R1.22955 O=C(Cc1ccc(cc1Cl)Br)NCCCO WXVL_AK0073SB2522 [0,2,0,0,0,0|2,0,0]=4 3064 B16R1.22955 O=C(Cc1ccc(cc1Cl)F)NCCCO WXVL_AK0073SB1409 [0,2,0,0,0,0|2,0,0]=4 3065 B16R1.22955 O=C(Cc1ccc(cc1Cl)F)NCCCO WXVL_AK0073SB1409 [0,2,0,0,0,0|2,0,0]=4 3066 B16R1.22955 O=C(Cc1ccc(cc1F)Br)NCCCO WXVL_AK0073SB0280 [0,2,0,0,0,0|2,0,0]=4 3067 B16R1.22955 O=C(Cc1ccc(cc1F)Br)NCCCO WXVL_AK0073SB0280 [0,2,0,0,0,0|2,0,0]=4 3068 B16R1.22955 O=C(Cc1ccc(cc1F)Cl)NCCCO WXVL_AK0073SB1401 [0,2,0,0,0,0|2,0,0]=4 3069 B16R1.22955 O=C(Cc1ccc(cc1F)Cl)NCCCO WXVL_AK0073SB1401 [0,2,0,0,0,0|2,0,0]=4 3070 B16R1.22955 O=C(Cc1ccc(cc1F)F)NCCCO WXVL_AK0073SB0445 [0,2,0,0,0,0|2,0,0]=4 3071 B16R1.22955 O=C(Cc1ccc(cc1F)F)NCCCO WXVL_AK0073SB0445 [0,2,0,0,0,0|2,0,0]=4 3072 B16R1.22955 O=C(Cc1ccc(cc1I)Br)NCCCO WXVL_AK0073SA00082 [0,2,0,0,0,0|2,0,0]=4 3073 B16R1.22955 O=C(Cc1ccc(cc1I)Br)NCCCO WXVL_AK0073SA00082 [0,2,0,0,0,0|2,0,0]=4 3074 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)Br WXVL_AK00588SB2348 [0,2,0,0,0,0|1,0,0]=3 3075 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)Br WXVL_AK00588SB2348 [0,2,0,0,0,0|1,0,0]=3 3076 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)Cl WXVL_AK00588SB1338 [0,2,0,0,0,0|1,0,0]=3 3077 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)Cl WXVL_AK00588SB1338 [0,2,0,0,0,0|1,0,0]=3 3078 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)F WXVL_AK00588SB0446 [0,2,0,0,0,0|1,0,0]=3 3079 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)F WXVL_AK00588SB0446 [0,2,0,0,0,0|1,0,0]=3 3080 B16R1.88 CCCCNC(=O)Nc1cccc(c1C)C WXVL_AK00588YV0039 [0,2,0,0,0,0|2,0,0]=4 3081 B16R1.88 CCCCNC(=O)Nc1cccc(c1C)C WXVL_AK00588YV0039 [0,2,0,0,0,0|2,0,0]=4 3082 B16R1.88 CCCCNC(=O)Nc1cccc(c1C)F WXVL_AK00588YV0129 [0,2,0,0,0,0|2,0,0]=4 3083 B16R1.88 CCCCNC(=O)Nc1cccc(c1C)F WXVL_AK00588YV0129 [0,2,0,0,0,0|2,0,0]=4 3084 B16R1.88 CCCCNC(=O)Nc1cccc(c1Cl)Cl WXVL_AK00588YV0134 [0,2,0,0,0,0|2,0,0]=4 3085 B16R1.88 CCCCNC(=O)Nc1cccc(c1Cl)Cl WXVL_AK00588YV0134 [0,2,0,0,0,0|2,0,0]=4 3086 B16R1.88 CCCCNC(=O)Nc1cccc(c1F)Cl WXVL_AK00588YV0116 [0,2,0,0,0,0|2,0,0]=4 3087 B16R1.88 CCCCNC(=O)Nc1cccc(c1F)Cl WXVL_AK00588YV0116 [0,2,0,0,0,0|2,0,0]=4 3088 B16R1.88 CSCCNC(=O)Cc1cccc(c1F)Br WXVL_AK00440SB2348 [0,2,0,0,0,0|2,0,0]=4 3089 B16R1.88 CSCCNC(=O)Cc1cccc(c1F)Br WXVL_AK00440SB2348 [0,2,0,0,0,0|2,0,0]=4 3090 B16R1.88 CSCCNC(=O)Cc1cccc(c1F)Cl WXVL_AK00440SB1338 [0,2,0,0,0,0|2,0,0]=4 3091 B16R1.88 CSCCNC(=O)Cc1cccc(c1F)Cl WXVL_AK00440SB1338 [0,2,0,0,0,0|2,0,0]=4 3092 B16R1.88 CSCCNC(=O)Cc1cccc(c1F)F WXVL_AK00440SB0446 [0,2,0,0,0,0|2,0,0]=4 3093 B16R1.88 CSCCNC(=O)Cc1cccc(c1F)F WXVL_AK00440SB0446 [0,2,0,0,0,0|2,0,0]=4 3094 B16R1.88 O=C(Cc1cccc(c1F)Br)NCCCO WXVL_AK0073SB2348 [0,2,0,0,0,0|2,0,0]=4 3095 B16R1.88 O=C(Cc1cccc(c1F)Br)NCCCO WXVL_AK0073SB2348 [0,2,0,0,0,0|2,0,0]=4 3096 B16R1.88 O=C(Cc1cccc(c1F)Cl)NCCCO WXVL_AK0073SB1338 [0,2,0,0,0,0|2,0,0]=4 3097 B16R1.88 O=C(Cc1cccc(c1F)Cl)NCCCO WXVL_AK0073SB1338 [0,2,0,0,0,0|2,0,0]=4 3098 B16R1.88 O=C(Cc1cccc(c1F)F)NCCCO WXVL_AK0073SB0446 [0,2,0,0,0,0|2,0,0]=4 3099 B16R1.88 O=C(Cc1cccc(c1F)F)NCCCO WXVL_AK0073SB0446 [0,2,0,0,0,0|2,0,0]=4 3100 B16R1.659 CCCCC(O)C(=O)Nc1cccc(c1)C WXVL_AG0052SB3429 [0,2,0,0,0,0|2,0,0]=4 3101 B16R1.659 CCCCC(O)C(=O)Nc1cccc(c1)C WXVL_AG0052SB3429 [0,2,0,0,0,0|2,0,0]=4 3102 B16R1.659 CCCCC(O)C(=O)Nc1cccc(c1)I WXVL_AG0649SB3429 [0,2,0,0,0,0|2,0,0]=4 3103 B16R1.659 CCCCC(O)C(=O)Nc1cccc(c1)I WXVL_AG0649SB3429 [0,2,0,0,0,0|2,0,0]=4 3104 B16R1.659 CCCCC(O)C(=O)Nc1cccc(c1)O WXVL_AG00200SB3429 [0,2,0,0,0,0|2,0,0]=4 3105 B16R1.659 CCCCC(O)C(=O)Nc1cccc(c1)O WXVL_AG00200SB3429 [0,2,0,0,0,0|2,0,0]=4 3106 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)Br WXVL_AN0085SB0099 [0,2,0,0,0,0|2,0,0]=4 3107 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)Br WXVL_AN0085SB0099 [0,2,0,0,0,0|2,0,0]=4 3108 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)C WXVL_AN0085SB0105 [0,2,0,0,0,0|2,0,0]=4 3109 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)C WXVL_AN0085SB0105 [0,2,0,0,0,0|2,0,0]=4 3110 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)Cl WXVL_AN0085SB0101 [0,2,0,0,0,0|2,0,0]=4 3111 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)Cl WXVL_AN0085SB0101 [0,2,0,0,0,0|2,0,0]=4 3112 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)F WXVL_AN0085SB0100 [0,2,0,0,0,0|2,0,0]=4 3113 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)F WXVL_AN0085SB0100 [0,2,0,0,0,0|2,0,0]=4 3114 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)O WXVL_AN0085SB0104 [0,2,0,0,0,0|2,0,0]=4 3115 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)O WXVL_AN0085SB0104 [0,2,0,0,0,0|2,0,0]=4 3116 B16R1.956 CC(CCO)NC(=O)Cc1cccc(c1)Br WXVL_AK1288SB0099 [0,2,0,0,0,0|2,0,0]=4 3117 B16R1.956 CC(CCO)NC(=O)Cc1cccc(c1)Br WXVL_AK1288SB0099 [0,2,0,0,0,0|2,0,0]=4 3118 B16R1.956 CC(CCO)NC(=O)Cc1cccc(c1)Cl WXVL_AK1288SB0101 [0,2,0,0,0,0|2,0,0]=4 3119 B16R1.956 CC(CCO)NC(=O)Cc1cccc(c1)Cl WXVL_AK1288SB0101 [0,2,0,0,0,0|2,0,0]=4 3120 B16R1.956 CC(CCO)NC(=O)Cc1cccc(c1)F WXVL_AK1288SB0100 [0,2,0,0,0,0|2,0,0]=4 3121 B16R1.956 CC(CCO)NC(=O)Cc1cccc(c1)F WXVL_AK1288SB0100 [0,2,0,0,0,0|2,0,0]=4 3122 B16R1.956 CC(CCO)NC(=O)Cc1cccc(c1)O WXVL_AK1288SB0104 [0,2,0,0,0,0|2,0,0]=4 3123 B16R1.956 CC(CCO)NC(=O)Cc1cccc(c1)O WXVL_AK1288SB0104 [0,2,0,0,0,0|2,0,0]=4 3124 B16R1.956 CCC[C@H](C)NC(=O)Cc1cccc(c1)Br WXVL_AK00682SB0099 [0,2,0,0,0,0|1,0,0]=3 3125 B16R1.956 CCC[C@H](C)NC(=O)Cc1cccc(c1)Br WXVL_AK00682SB0099 [0,2,0,0,0,0|1,0,0]=3 3126 B16R1.956 CCC[C@H](C)NC(=O)Cc1cccc(c1)C WXVL_AK00682SB0105 [0,2,0,0,0,0|1,0,0]=3 3127 B16R1.956 CCC[C@H](C)NC(=O)Cc1cccc(c1)C WXVL_AK00682SB0105 [0,2,0,0,0,0|1,0,0]=3 3128 B16R1.956 CCC[C@H](C)NC(=O)Cc1cccc(c1)Cl WXVL_AK00682SB0101 [0,2,0,0,0,0|1,0,0]=3 3129 B16R1.956 CCC[C@H](C)NC(=O)Cc1cccc(c1)Cl WXVL_AK00682SB0101 [0,2,0,0,0,0|1,0,0]=3 3130 B16R1.956 CCC[C@H](C)NC(=O)Cc1cccc(c1)F WXVL_AK00682SB0100 [0,2,0,0,0,0|1,0,0]=3 3131 B16R1.956 CCC[C@H](C)NC(=O)Cc1cccc(c1)F WXVL_AK00682SB0100 [0,2,0,0,0,0|1,0,0]=3 3132 B16R1.956 CCC[C@H](C)NC(=O)Cc1cccc(c1)O WXVL_AK00682SB0104 [0,2,0,0,0,0|1,0,0]=3 3133 B16R1.956 CCC[C@H](C)NC(=O)Cc1cccc(c1)O WXVL_AK00682SB0104 [0,2,0,0,0,0|1,0,0]=3 3134 B16R1.956 CCC[C@H](C)NC(=O)Cc1cccc(n1)C WXVL_AK00682SA0399 [0,2,0,0,0,0|2,0,0]=4 3135 B16R1.956 CCC[C@H](C)NC(=O)Cc1cccc(n1)C WXVL_AK00682SA0399 [0,2,0,0,0,0|2,0,0]=4 3136 B16R1.956 CCC[C@H](C)NC(=O)Cc1cccc(n1)Cl WXVL_AK00682SA0313 [0,2,0,0,0,0|2,0,0]=4 3137 B16R1.956 CCC[C@H](C)NC(=O)Cc1cccc(n1)Cl WXVL_AK00682SA0313 [0,2,0,0,0,0|2,0,0]=4 3138 B16R1.956 CCC[C@H](C)NC(=O)Cc1ccnc(c1)Br WXVL_AK00682SA0520 [0,2,0,0,0,0|2,0,0]=4 3139 B16R1.956 CCC[C@H](C)NC(=O)Cc1ccnc(c1)Br WXVL_AK00682SA0520 [0,2,0,0,0,0|2,0,0]=4 3140 B16R1.956 CCC[C@H](C)NC(=O)Nc1cccc(c1)Br WXVL_AK00682YV0098 [0,2,0,0,0,0|2,0,0]=4 3141 B16R1.956 CCC[C@H](C)NC(=O)Nc1cccc(c1)Br WXVL_AK00682YV0098 [0,2,0,0,0,0|2,0,0]=4 3142 B16R1.956 CCC[C@H](C)NC(=O)Nc1cccc(c1)C WXVL_AK00682YV0020 [0,2,0,0,0,0|2,0,0]=4 3143 B16R1.956 CCC[C@H](C)NC(=O)Nc1cccc(c1)C WXVL_AK00682YV0020 [0,2,0,0,0,0|2,0,0]=4 3144 B16R1.956 CCC[C@H](C)NC(=O)Nc1cccc(c1)Cl WXVL_AK00682YV0016 [0,2,0,0,0,0|2,0,0]=4 3145 B16R1.956 CCC[C@H](C)NC(=O)Nc1cccc(c1)Cl WXVL_AK00682YV0016 [0,2,0,0,0,0|2,0,0]=4 3146 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)Br WXVL_AK00613SB0099 [0,2,0,0,0,0|2,0,0]=4 3147 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)Br WXVL_AK00613SB0099 [0,2,0,0,0,0|2,0,0]=4 3148 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)C WXVL_AK00613SB0105 [0,2,0,0,0,0|2,0,0]=4 3149 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)C WXVL_AK00613SB0105 [0,2,0,0,0,0|2,0,0]=4 3150 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)Cl WXVL_AK00613SB0101 [0,2,0,0,0,0|2,0,0]=4 3151 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)Cl WXVL_AK00613SB0101 [0,2,0,0,0,0|2,0,0]=4 3152 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)F WXVL_AK00613SB0100 [0,2,0,0,0,0|2,0,0]=4 3153 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)F WXVL_AK00613SB0100 [0,2,0,0,0,0|2,0,0]=4 3154 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)O WXVL_AK00613SB0104 [0,2,0,0,0,0|2,0,0]=4 3155 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)O WXVL_AK00613SB0104 [0,2,0,0,0,0|2,0,0]=4 3156 B16R1.956 COC[C@H](C)NC(=O)Cc1cccc(c1)Br WXVL_AK0137SB0099 [0,2,0,0,0,0|2,0,0]=4 3157 B16R1.956 COC[C@H](C)NC(=O)Cc1cccc(c1)Br WXVL_AK0137SB0099 [0,2,0,0,0,0|2,0,0]=4 3158 B16R1.956 COC[C@H](C)NC(=O)Cc1cccc(c1)C WXVL_AK0137SB0105 [0,2,0,0,0,0|2,0,0]=4 3159 B16R1.956 COC[C@H](C)NC(=O)Cc1cccc(c1)C WXVL_AK0137SB0105 [0,2,0,0,0,0|2,0,0]=4 3160 B16R1.956 COC[C@H](C)NC(=O)Cc1cccc(c1)Cl WXVL_AK0137SB0101 [0,2,0,0,0,0|2,0,0]=4 3161 B16R1.956 COC[C@H](C)NC(=O)Cc1cccc(c1)Cl WXVL_AK0137SB0101 [0,2,0,0,0,0|2,0,0]=4 3162 B16R1.956 COC[C@H](C)NC(=O)Cc1cccc(c1)F WXVL_AK0137SB0100 [0,2,0,0,0,0|2,0,0]=4 3163 B16R1.956 COC[C@H](C)NC(=O)Cc1cccc(c1)F WXVL_AK0137SB0100 [0,2,0,0,0,0|2,0,0]=4 3164 B16R1.956 COC[C@H](C)NC(=O)Cc1cccc(c1)O WXVL_AK0137SB0104 [0,2,0,0,0,0|2,0,0]=4 3165 B16R1.956 COC[C@H](C)NC(=O)Cc1cccc(c1)O WXVL_AK0137SB0104 [0,2,0,0,0,0|2,0,0]=4 3166 B16R1.956 Cc1cccc(c1)CC(=O)NC(C)CCO WXVL_AK1288SB0105 [0,2,0,0,0,0|2,0,0]=4 3167 B16R1.956 Cc1cccc(c1)CC(=O)NC(C)CCO WXVL_AK1288SB0105 [0,2,0,0,0,0|2,0,0]=4 3168 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)Br WXVL_AK00704SB0099 [0,2,0,0,0,0|2,0,0]=4 3169 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)Br WXVL_AK00704SB0099 [0,2,0,0,0,0|2,0,0]=4 3170 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)C WXVL_AK00704SB0105 [0,2,0,0,0,0|2,0,0]=4 3171 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)C WXVL_AK00704SB0105 [0,2,0,0,0,0|2,0,0]=4 3172 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)Cl WXVL_AK00704SB0101 [0,2,0,0,0,0|2,0,0]=4 3173 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)Cl WXVL_AK00704SB0101 [0,2,0,0,0,0|2,0,0]=4 3174 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)F WXVL_AK00704SB0100 [0,2,0,0,0,0|2,0,0]=4 3175 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)F WXVL_AK00704SB0100 [0,2,0,0,0,0|2,0,0]=4 3176 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)O WXVL_AK00704SB0104 [0,2,0,0,0,0|2,0,0]=4 3177 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)O WXVL_AK00704SB0104 [0,2,0,0,0,0|2,0,0]=4 3178 B16R1.1148 Cc1cccc(c1)CC(=O)NC[C@@H](F)CO WXVL_AK00590SB0105 [0,2,0,0,0,0|2,0,0]=4 3179 B16R1.1148 Cc1cccc(c1)CC(=O)NC[C@@H](F)CO WXVL_AK00590SB0105 [0,2,0,0,0,0|2,0,0]=4 3180 B16R1.1148 Cc1cccc(c1)CC(=O)NC[C@H](O)CO WXVL_AK00483SB0105 [0,2,0,0,0,0|2,0,0]=4 3181 B16R1.1148 Cc1cccc(c1)CC(=O)NC[C@H](O)CO WXVL_AK00483SB0105 [0,2,0,0,0,0|2,0,0]=4 3182 B16R1.1148 O=C(Cc1cccc(c1)Br)NC[C@@H](F)CO WXVL_AK00590SB0099 [0,2,0,0,0,0|2,0,0]=4 3183 B16R1.1148 O=C(Cc1cccc(c1)Br)NC[C@@H](F)CO WXVL_AK00590SB0099 [0,2,0,0,0,0|2,0,0]=4 3184 B16R1.1148 O=C(Cc1cccc(c1)Br)NC[C@H](O)CO WXVL_AK00483SB0099 [0,2,0,0,0,0|2,0,0]=4 3185 B16R1.1148 O=C(Cc1cccc(c1)Br)NC[C@H](O)CO WXVL_AK00483SB0099 [0,2,0,0,0,0|2,0,0]=4 3186 B16R1.1148 O=C(Cc1cccc(c1)Cl)NC[C@@H](F)CO WXVL_AK00590SB0101 [0,2,0,0,0,0|2,0,0]=4 3187 B16R1.1148 O=C(Cc1cccc(c1)Cl)NC[C@@H](F)CO WXVL_AK00590SB0101 [0,2,0,0,0,0|2,0,0]=4 3188 B16R1.1148 O=C(Cc1cccc(c1)Cl)NC[C@H](O)CO WXVL_AK00483SB0101 [0,2,0,0,0,0|2,0,0]=4 3189 B16R1.1148 O=C(Cc1cccc(c1)Cl)NC[C@H](O)CO WXVL_AK00483SB0101 [0,2,0,0,0,0|2,0,0]=4 3190 B16R1.1148 O=C(Cc1cccc(c1)F)NC[C@@H](F)CO WXVL_AK00590SB0100 [0,2,0,0,0,0|2,0,0]=4 3191 B16R1.1148 O=C(Cc1cccc(c1)F)NC[C@@H](F)CO WXVL_AK00590SB0100 [0,2,0,0,0,0|2,0,0]=4 3192 B16R1.1148 O=C(Cc1cccc(c1)F)NC[C@H](O)CO WXVL_AK00483SB0100 [0,2,0,0,0,0|2,0,0]=4 3193 B16R1.1148 O=C(Cc1cccc(c1)F)NC[C@H](O)CO WXVL_AK00483SB0100 [0,2,0,0,0,0|2,0,0]=4 3194 B16R1.1148 O=C(Cc1cccc(c1)O)NC[C@@H](F)CO WXVL_AK00590SB0104 [0,2,0,0,0,0|2,0,0]=4 3195 B16R1.1148 O=C(Cc1cccc(c1)O)NC[C@@H](F)CO WXVL_AK00590SB0104 [0,2,0,0,0,0|2,0,0]=4 3196 B16R1.1148 O=C(Cc1cccc(c1)O)NC[C@H](O)CO WXVL_AK00483SB0104 [0,2,0,0,0,0|2,0,0]=4 3197 B16R1.1148 O=C(Cc1cccc(c1)O)NC[C@H](O)CO WXVL_AK00483SB0104 [0,2,0,0,0,0|2,0,0]=4 3198 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)Br WXVL_AK00588SB2266 [0,2,0,0,0,0|1,0,0]=3 3199 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)Br WXVL_AK00588SB2266 [0,2,0,0,0,0|1,0,0]=3 3200 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)Cl WXVL_AK00588SB0306 [0,2,0,0,0,0|1,0,0]=3 3201 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)Cl WXVL_AK00588SB0306 [0,2,0,0,0,0|1,0,0]=3 3202 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)F WXVL_AK00588SB1418 [0,2,0,0,0,0|1,0,0]=3 3203 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)F WXVL_AK00588SB1418 [0,2,0,0,0,0|1,0,0]=3 3204 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)Br WXVL_AK00588SB2430 [0,2,0,0,0,0|1,0,0]=3 3205 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)Br WXVL_AK00588SB2430 [0,2,0,0,0,0|1,0,0]=3 3206 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)C WXVL_AK00588SB0420 [0,2,0,0,0,0|1,0,0]=3 3207 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)C WXVL_AK00588SB0420 [0,2,0,0,0,0|1,0,0]=3 3208 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)Br WXVL_AK00588SB0308 [0,2,0,0,0,0|1,0,0]=3 3209 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)Br WXVL_AK00588SB0308 [0,2,0,0,0,0|1,0,0]=3 3210 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)Cl WXVL_AK00588SB0783 [0,2,0,0,0,0|1,0,0]=3 3211 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)Cl WXVL_AK00588SB0783 [0,2,0,0,0,0|1,0,0]=3 3212 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)F WXVL_AK00588SB1408 [0,2,0,0,0,0|1,0,0]=3 3213 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)F WXVL_AK00588SB1408 [0,2,0,0,0,0|1,0,0]=3 3214 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)F WXVL_AK00588SB2104 [0,2,0,0,0,0|1,0,0]=3 3215 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)F WXVL_AK00588SB2104 [0,2,0,0,0,0|1,0,0]=3 3216 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1O)Br WXVL_AK00588SB4784 [0,2,0,0,0,0|1,0,0]=3 3217 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1O)Br WXVL_AK00588SB4784 [0,2,0,0,0,0|1,0,0]=3 3218 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)C WXVL_AK00588YV0042 [0,2,0,0,0,0|2,0,0]=4 3219 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)C WXVL_AK00588YV0042 [0,2,0,0,0,0|2,0,0]=4 3220 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)Cl WXVL_AK00588YV0123 [0,2,0,0,0,0|2,0,0]=4 3221 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)Cl WXVL_AK00588YV0123 [0,2,0,0,0,0|2,0,0]=4 3222 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)F WXVL_AK00588YV0190 [0,2,0,0,0,0|2,0,0]=4 3223 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)F WXVL_AK00588YV0190 [0,2,0,0,0,0|2,0,0]=4 3224 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Cl)C WXVL_AK00588YV0197 [0,2,0,0,0,0|2,0,0]=4 3225 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Cl)C WXVL_AK00588YV0197 [0,2,0,0,0,0|2,0,0]=4 3226 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Cl)Cl WXVL_AK00588YV0128 [0,2,0,0,0,0|2,0,0]=4 3227 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Cl)Cl WXVL_AK00588YV0128 [0,2,0,0,0,0|2,0,0]=4 3228 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1F)C WXVL_AK00588YV0065 [0,2,0,0,0,0|2,0,0]=4 3229 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1F)C WXVL_AK00588YV0065 [0,2,0,0,0,0|2,0,0]=4 3230 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1F)F WXVL_AK00588YV0037 [0,2,0,0,0,0|2,0,0]=4 3231 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1F)F WXVL_AK00588YV0037 [0,2,0,0,0,0|2,0,0]=4 3232 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Br)Br WXVL_AK00440SB2266 [0,2,0,0,0,0|2,0,0]=4 3233 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Br)Br WXVL_AK00440SB2266 [0,2,0,0,0,0|2,0,0]=4 3234 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Br)Cl WXVL_AK00440SB0306 [0,2,0,0,0,0|2,0,0]=4 3235 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Br)Cl WXVL_AK00440SB0306 [0,2,0,0,0,0|2,0,0]=4 3236 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Br)F WXVL_AK00440SB1418 [0,2,0,0,0,0|2,0,0]=4 3237 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Br)F WXVL_AK00440SB1418 [0,2,0,0,0,0|2,0,0]=4 3238 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1C)Br WXVL_AK00440SB2430 [0,2,0,0,0,0|2,0,0]=4 3239 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1C)Br WXVL_AK00440SB2430 [0,2,0,0,0,0|2,0,0]=4 3240 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1C)C WXVL_AK00440SB0420 [0,2,0,0,0,0|2,0,0]=4 3241 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1C)C WXVL_AK00440SB0420 [0,2,0,0,0,0|2,0,0]=4 3242 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Cl)Br WXVL_AK00440SB0308 [0,2,0,0,0,0|2,0,0]=4 3243 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Cl)Br WXVL_AK00440SB0308 [0,2,0,0,0,0|2,0,0]=4 3244 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Cl)Cl WXVL_AK00440SB0783 [0,2,0,0,0,0|2,0,0]=4 3245 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Cl)Cl WXVL_AK00440SB0783 [0,2,0,0,0,0|2,0,0]=4 3246 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Cl)F WXVL_AK00440SB1408 [0,2,0,0,0,0|2,0,0]=4 3247 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Cl)F WXVL_AK00440SB1408 [0,2,0,0,0,0|2,0,0]=4 3248 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1F)F WXVL_AK00440SB2104 [0,2,0,0,0,0|2,0,0]=4 3249 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1F)F WXVL_AK00440SB2104 [0,2,0,0,0,0|2,0,0]=4 3250 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1O)Br WXVL_AK00440SB4784 [0,2,0,0,0,0|2,0,0]=4 3251 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1O)Br WXVL_AK00440SB4784 [0,2,0,0,0,0|2,0,0]=4 3252 B16R1.7379 Cc1ccc(c(c1)CC(=O)NCCCO)C WXVL_AK0073SB0420 [0,2,0,0,0,0|2,0,0]=4 3253 B16R1.7379 Cc1ccc(c(c1)CC(=O)NCCCO)C WXVL_AK0073SB0420 [0,2,0,0,0,0|2,0,0]=4 3254 B16R1.7379 Cc1ccc(cc1CC(=O)NCCCO)Br WXVL_AK0073SB2430 [0,2,0,0,0,0|2,0,0]=4 3255 B16R1.7379 Cc1ccc(cc1CC(=O)NCCCO)Br WXVL_AK0073SB2430 [0,2,0,0,0,0|2,0,0]=4 3256 B16R1.7379 O=C(Cc1cc(ccc1Br)Br)NCCCO WXVL_AK0073SB2266 [0,2,0,0,0,0|2,0,0]=4 3257 B16R1.7379 O=C(Cc1cc(ccc1Br)Br)NCCCO WXVL_AK0073SB2266 [0,2,0,0,0,0|2,0,0]=4 3258 B16R1.7379 O=C(Cc1cc(ccc1Br)Cl)NCCCO WXVL_AK0073SB0306 [0,2,0,0,0,0|2,0,0]=4 3259 B16R1.7379 O=C(Cc1cc(ccc1Br)Cl)NCCCO WXVL_AK0073SB0306 [0,2,0,0,0,0|2,0,0]=4 3260 B16R1.7379 O=C(Cc1cc(ccc1Br)F)NCCCO WXVL_AK0073SB1418 [0,2,0,0,0,0|2,0,0]=4 3261 B16R1.7379 O=C(Cc1cc(ccc1Br)F)NCCCO WXVL_AK0073SB1418 [0,2,0,0,0,0|2,0,0]=4 3262 B16R1.7379 O=C(Cc1cc(ccc1Cl)Br)NCCCO WXVL_AK0073SB0308 [0,2,0,0,0,0|2,0,0]=4 3263 B16R1.7379 O=C(Cc1cc(ccc1Cl)Br)NCCCO WXVL_AK0073SB0308 [0,2,0,0,0,0|2,0,0]=4 3264 B16R1.7379 O=C(Cc1cc(ccc1Cl)Cl)NCCCO WXVL_AK0073SB0783 [0,2,0,0,0,0|2,0,0]=4 3265 B16R1.7379 O=C(Cc1cc(ccc1Cl)Cl)NCCCO WXVL_AK0073SB0783 [0,2,0,0,0,0|2,0,0]=4 3266 B16R1.7379 O=C(Cc1cc(ccc1Cl)F)NCCCO WXVL_AK0073SB1408 [0,2,0,0,0,0|2,0,0]=4 3267 B16R1.7379 O=C(Cc1cc(ccc1Cl)F)NCCCO WXVL_AK0073SB1408 [0,2,0,0,0,0|2,0,0]=4 3268 B16R1.7379 O=C(Cc1cc(ccc1F)F)NCCCO WXVL_AK0073SB2104 [0,2,0,0,0,0|2,0,0]=4 3269 B16R1.7379 O=C(Cc1cc(ccc1F)F)NCCCO WXVL_AK0073SB2104 [0,2,0,0,0,0|2,0,0]=4 3270 B16R1.7379 O=C(Cc1cc(ccc1O)Br)NCCCO WXVL_AK0073SB4784 [0,2,0,0,0,0|2,0,0]=4 3271 B16R1.7379 O=C(Cc1cc(ccc1O)Br)NCCCO WXVL_AK0073SB4784 [0,2,0,0,0,0|2,0,0]=4 3272 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)Br)Br WXVL_AK00588SB2486 [0,2,0,0,0,0|1,0,0]=3 3273 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)Br)Br WXVL_AK00588SB2486 [0,2,0,0,0,0|1,0,0]=3 3274 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)C)C WXVL_AK00588SB2245 [0,2,0,0,0,0|1,0,0]=3 3275 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)C)C WXVL_AK00588SB2245 [0,2,0,0,0,0|1,0,0]=3 3276 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)Cl)F WXVL_AK00588SB2384 [0,2,0,0,0,0|1,0,0]=3 3277 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)Cl)F WXVL_AK00588SB2384 [0,2,0,0,0,0|1,0,0]=3 3278 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)F)C WXVL_AK00588SB3033 [0,2,0,0,0,0|1,0,0]=3 3279 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)F)C WXVL_AK00588SB3033 [0,2,0,0,0,0|1,0,0]=3 3280 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)F)F WXVL_AK00588SA0023 [0,2,0,0,0,0|1,0,0]=3 3281 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)F)F WXVL_AK00588SA0023 [0,2,0,0,0,0|1,0,0]=3 3282 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)C)C WXVL_AK00588YV0046 [0,2,0,0,0,0|2,0,0]=4 3283 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)C)C WXVL_AK00588YV0046 [0,2,0,0,0,0|2,0,0]=4 3284 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)Cl)Cl WXVL_AK00588YV0093 [0,2,0,0,0,0|2,0,0]=4 3285 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)Cl)Cl WXVL_AK00588YV0093 [0,2,0,0,0,0|2,0,0]=4 3286 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)Br)Br WXVL_AK00440SB2486 [0,2,0,0,0,0|2,0,0]=4 3287 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)Br)Br WXVL_AK00440SB2486 [0,2,0,0,0,0|2,0,0]=4 3288 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)C)C WXVL_AK00440SB2245 [0,2,0,0,0,0|2,0,0]=4 3289 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)C)C WXVL_AK00440SB2245 [0,2,0,0,0,0|2,0,0]=4 3290 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)Cl)F WXVL_AK00440SB2384 [0,2,0,0,0,0|2,0,0]=4 3291 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)Cl)F WXVL_AK00440SB2384 [0,2,0,0,0,0|2,0,0]=4 3292 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)F)C WXVL_AK00440SB3033 [0,2,0,0,0,0|2,0,0]=4 3293 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)F)C WXVL_AK00440SB3033 [0,2,0,0,0,0|2,0,0]=4 3294 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)F)F WXVL_AK00440SA0023 [0,2,0,0,0,0|2,0,0]=4 3295 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)F)F WXVL_AK00440SA0023 [0,2,0,0,0,0|2,0,0]=4 3296 B16R1.7381 Cc1cc(cc(c1)CC(=O)NCCCO)C WXVL_AK0073SB2245 [0,2,0,0,0,0|2,0,0]=4 3297 B16R1.7381 Cc1cc(cc(c1)CC(=O)NCCCO)C WXVL_AK0073SB2245 [0,2,0,0,0,0|2,0,0]=4 3298 B16R1.7381 Cc1cc(cc(c1)CC(=O)NCCCO)F WXVL_AK0073SB3033 [0,2,0,0,0,0|2,0,0]=4 3299 B16R1.7381 Cc1cc(cc(c1)CC(=O)NCCCO)F WXVL_AK0073SB3033 [0,2,0,0,0,0|2,0,0]=4 3300 B16R1.7381 O=C(Cc1cc(cc(c1)Br)Br)NCCCO WXVL_AK0073SB2486 [0,2,0,0,0,0|2,0,0]=4 3301 B16R1.7381 O=C(Cc1cc(cc(c1)Br)Br)NCCCO WXVL_AK0073SB2486 [0,2,0,0,0,0|2,0,0]=4 3302 B16R1.7381 O=C(Cc1cc(cc(c1)Cl)F)NCCCO WXVL_AK0073SB2384 [0,2,0,0,0,0|2,0,0]=4 3303 B16R1.7381 O=C(Cc1cc(cc(c1)Cl)F)NCCCO WXVL_AK0073SB2384 [0,2,0,0,0,0|2,0,0]=4 3304 B16R1.7381 O=C(Cc1cc(cc(c1)F)F)NCCCO WXVL_AK0073SA0023 [0,2,0,0,0,0|2,0,0]=4 3305 B16R1.7381 O=C(Cc1cc(cc(c1)F)F)NCCCO WXVL_AK0073SA0023 [0,2,0,0,0,0|2,0,0]=4 3306 B16R1.7389 CCCCNC(=O)Cc1cccc(c1)C#N WXVL_AK00588SB3619 [0,2,0,0,0,0|1,0,0]=3 3307 B16R1.7389 CCCCNC(=O)Cc1cccc(c1)C#N WXVL_AK00588SB3619 [0,2,0,0,0,0|1,0,0]=3 3308 B16R1.7389 CCCCNC(=O)Cc1cccc(c1)OC WXVL_AK00588SB0103 [0,2,0,0,0,0|1,0,0]=3 3309 B16R1.7389 CCCCNC(=O)Cc1cccc(c1)OC WXVL_AK00588SB0103 [0,2,0,0,0,0|1,0,0]=3 3310 B16R1.7389 CCCCNC(=O)Cc1cccc(c1)SC WXVL_AK00588SB5356 [0,2,0,0,0,0|1,0,0]=3 3311 B16R1.7389 CCCCNC(=O)Cc1cccc(c1)SC WXVL_AK00588SB5356 [0,2,0,0,0,0|1,0,0]=3 3312 B16R1.7389 CCCCNC(=O)Cc1cccc(n1)OC WXVL_AK00588SA0095 [0,2,0,0,0,0|2,0,0]=4 3313 B16R1.7389 CCCCNC(=O)Cc1cccc(n1)OC WXVL_AK00588SA0095 [0,2,0,0,0,0|2,0,0]=4 3314 B16R1.7389 CCCCNC(=O)Nc1cccc(c1)C#N WXVL_AK00588YV0043 [0,2,0,0,0,0|2,0,0]=4 3315 B16R1.7389 CCCCNC(=O)Nc1cccc(c1)C#N WXVL_AK00588YV0043 [0,2,0,0,0,0|2,0,0]=4 3316 B16R1.7389 CCCCNC(=O)Nc1cccc(c1)OC WXVL_AK00588YV0018 [0,2,0,0,0,0|2,0,0]=4 3317 B16R1.7389 CCCCNC(=O)Nc1cccc(c1)OC WXVL_AK00588YV0018 [0,2,0,0,0,0|2,0,0]=4 3318 B16R1.7389 COc1cccc(c1)CC(=O)NCCCO WXVL_AK0073SB0103 [0,2,0,0,0,0|2,0,0]=4 3319 B16R1.7389 COc1cccc(c1)CC(=O)NCCCO WXVL_AK0073SB0103 [0,2,0,0,0,0|2,0,0]=4 3320 B16R1.7389 COc1cccc(c1)CC(=O)NCCSC WXVL_AK00440SB0103 [0,2,0,0,0,0|2,0,0]=4 3321 B16R1.7389 COc1cccc(c1)CC(=O)NCCSC WXVL_AK00440SB0103 [0,2,0,0,0,0|2,0,0]=4 3322 B16R1.7389 CSCCNC(=O)Cc1cccc(c1)C#N WXVL_AK00440SB3619 [0,2,0,0,0,0|2,0,0]=4 3323 B16R1.7389 CSCCNC(=O)Cc1cccc(c1)C#N WXVL_AK00440SB3619 [0,2,0,0,0,0|2,0,0]=4 3324 B16R1.7389 CSCCNC(=O)Cc1cccc(c1)SC WXVL_AK00440SB5356 [0,2,0,0,0,0|2,0,0]=4 3325 B16R1.7389 CSCCNC(=O)Cc1cccc(c1)SC WXVL_AK00440SB5356 [0,2,0,0,0,0|2,0,0]=4 3326 B16R1.7389 CSc1cccc(c1)CC(=O)NCCCO WXVL_AK0073SB5356 [0,2,0,0,0,0|2,0,0]=4 3327 B16R1.7389 CSc1cccc(c1)CC(=O)NCCCO WXVL_AK0073SB5356 [0,2,0,0,0,0|2,0,0]=4 3328 B16R1.7389 N#Cc1cccc(c1)CC(=O)NCCCO WXVL_AK0073SB3619 [0,2,0,0,0,0|2,0,0]=4 3329 B16R1.7389 N#Cc1cccc(c1)CC(=O)NCCCO WXVL_AK0073SB3619 [0,2,0,0,0,0|2,0,0]=4 3330 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)I WXVL_AG0649SB1301 [0,2,0,0,0,0|2,0,0]=4 3331 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)I WXVL_AG0649SB1301 [0,2,0,0,0,0|2,0,0]=4 3332 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)O WXVL_AG00200SB1301 [0,2,0,0,0,0|2,0,0]=4 3333 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)O WXVL_AG00200SB1301 [0,2,0,0,0,0|2,0,0]=4 3334 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)Br WXVL_AK0068SB0099 [0,2,0,0,0,0|1,0,0]=3 3335 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)Br WXVL_AK0068SB0099 [0,2,0,0,0,0|1,0,0]=3 3336 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)Cl WXVL_AK0068SB0101 [0,2,0,0,0,0|1,0,0]=3 3337 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)Cl WXVL_AK0068SB0101 [0,2,0,0,0,0|1,0,0]=3 3338 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)F WXVL_AK0068SB0100 [0,2,0,0,0,0|1,0,0]=3 3339 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)F WXVL_AK0068SB0100 [0,2,0,0,0,0|1,0,0]=3 3340 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)O WXVL_AK0068SB0104 [0,2,0,0,0,0|1,0,0]=3 3341 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)O WXVL_AK0068SB0104 [0,2,0,0,0,0|1,0,0]=3 3342 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(n1)Cl WXVL_AK0068SA0313 [0,2,0,0,0,0|2,0,0]=4 3343 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(n1)Cl WXVL_AK0068SA0313 [0,2,0,0,0,0|2,0,0]=4 3344 B16R1.11236 CC(C)CCNC(=O)Cc1ccnc(c1)Br WXVL_AK0068SA0520 [0,2,0,0,0,0|2,0,0]=4 3345 B16R1.11236 CC(C)CCNC(=O)Cc1ccnc(c1)Br WXVL_AK0068SA0520 [0,2,0,0,0,0|2,0,0]=4 3346 B16R1.11236 CC(C)CCNC(=O)Nc1cccc(c1)Br WXVL_AK0068YV0098 [0,2,0,0,0,0|2,0,0]=4 3347 B16R1.11236 CC(C)CCNC(=O)Nc1cccc(c1)Br WXVL_AK0068YV0098 [0,2,0,0,0,0|2,0,0]=4 3348 B16R1.11236 CC(C)CCNC(=O)Nc1cccc(c1)Cl WXVL_AK0068YV0016 [0,2,0,0,0,0|2,0,0]=4 3349 B16R1.11236 CC(C)CCNC(=O)Nc1cccc(c1)Cl WXVL_AK0068YV0016 [0,2,0,0,0,0|2,0,0]=4 3350 B16R1.11236 CN(C)CCNC(=O)Cc1cccc(c1)Br WXVL_AK0058SB0099 [0,2,0,0,0,0|2,0,0]=4 3351 B16R1.11236 CN(C)CCNC(=O)Cc1cccc(c1)Br WXVL_AK0058SB0099 [0,2,0,0,0,0|2,0,0]=4 3352 B16R1.11236 CN(C)CCNC(=O)Cc1cccc(c1)Cl WXVL_AK0058SB0101 [0,2,0,0,0,0|2,0,0]=4 3353 B16R1.11236 CN(C)CCNC(=O)Cc1cccc(c1)Cl WXVL_AK0058SB0101 [0,2,0,0,0,0|2,0,0]=4 3354 B16R1.11236 CN(C)CCNC(=O)Cc1cccc(c1)F WXVL_AK0058SB0100 [0,2,0,0,0,0|2,0,0]=4 3355 B16R1.11236 CN(C)CCNC(=O)Cc1cccc(c1)F WXVL_AK0058SB0100 [0,2,0,0,0,0|2,0,0]=4 3356 B16R1.11236 CN(C)CCNC(=O)Cc1cccc(c1)O WXVL_AK0058SB0104 [0,2,0,0,0,0|2,0,0]=4 3357 B16R1.11236 CN(C)CCNC(=O)Cc1cccc(c1)O WXVL_AK0058SB0104 [0,2,0,0,0,0|2,0,0]=4 3358 B16R1.11236 Cc1cccc(c1)CC(=O)NCCC(C)C WXVL_AK0068SB0105 [0,2,0,0,0,0|1,0,0]=3 3359 B16R1.11236 Cc1cccc(c1)CC(=O)NCCC(C)C WXVL_AK0068SB0105 [0,2,0,0,0,0|1,0,0]=3 3360 B16R1.11236 Cc1cccc(c1)CC(=O)NCCN(C)C WXVL_AK0058SB0105 [0,2,0,0,0,0|2,0,0]=4 3361 B16R1.11236 Cc1cccc(c1)CC(=O)NCCN(C)C WXVL_AK0058SB0105 [0,2,0,0,0,0|2,0,0]=4 3362 B16R1.11236 Cc1cccc(c1)NC(=O)CCCC(C)C WXVL_AG0052SB1301 [0,2,0,0,0,0|2,0,0]=4 3363 B16R1.11236 Cc1cccc(c1)NC(=O)CCCC(C)C WXVL_AG0052SB1301 [0,2,0,0,0,0|2,0,0]=4 3364 B16R1.11236 Cc1cccc(c1)NC(=O)NCCC(C)C WXVL_AK0068YV0020 [0,2,0,0,0,0|2,0,0]=4 3365 B16R1.11236 Cc1cccc(c1)NC(=O)NCCC(C)C WXVL_AK0068YV0020 [0,2,0,0,0,0|2,0,0]=4 3366 B16R1.11236 Cc1cccc(n1)CC(=O)NCCC(C)C WXVL_AK0068SA0399 [0,2,0,0,0,0|2,0,0]=4 3367 B16R1.11236 Cc1cccc(n1)CC(=O)NCCC(C)C WXVL_AK0068SA0399 [0,2,0,0,0,0|2,0,0]=4 3368 B16R1.20523 CCCCNS(=O)(=O)Cc1cccc(c1)C WXVL_AK00588HU0138 [0,2,0,0,0,0|2,0,0]=4 3369 B16R1.20523 CCCCNS(=O)(=O)Cc1cccc(c1)C WXVL_AK00588HU0138 [0,2,0,0,0,0|2,0,0]=4 3370 B16R1.20523 CCCCNS(=O)(=O)Cc1cccc(c1)Cl WXVL_AK00588HU0242 [0,2,0,0,0,0|2,0,0]=4 3371 B16R1.20523 CCCCNS(=O)(=O)Cc1cccc(c1)Cl WXVL_AK00588HU0242 [0,2,0,0,0,0|2,0,0]=4 3372 B16R1.1284 CN(C)CCN(C)C(=O)Cc1ccccc1 WXVL_AN0052SB0092 [0,2,0,0,0,0|2,0,0]=4 3373 B16R1.1284 CN(C)CCN(C)C(=O)Cc1ccccc1 WXVL_AN0052SB0092 [0,2,0,0,0,0|2,0,0]=4 3374 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1Br WXVL_AG00180SB3429 [0,2,0,0,0,0|2,0,0]=4 3375 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1Br WXVL_AG00180SB3429 [0,2,0,0,0,0|2,0,0]=4 3376 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1C WXVL_AG0027SB3429 [0,2,0,0,0,0|2,0,0]=4 3377 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1C WXVL_AG0027SB3429 [0,2,0,0,0,0|2,0,0]=4 3378 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1Cl WXVL_AG00129SB3429 [0,2,0,0,0,0|2,0,0]=4 3379 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1Cl WXVL_AG00129SB3429 [0,2,0,0,0,0|2,0,0]=4 3380 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1I WXVL_AG0385SB3429 [0,2,0,0,0,0|2,0,0]=4 3381 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1I WXVL_AG0385SB3429 [0,2,0,0,0,0|2,0,0]=4 3382 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1Br WXVL_AN0085SB0093 [0,2,0,0,0,0|2,0,0]=4 3383 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1Br WXVL_AN0085SB0093 [0,2,0,0,0,0|2,0,0]=4 3384 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1C WXVL_AN0085SB0098 [0,2,0,0,0,0|2,0,0]=4 3385 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1C WXVL_AN0085SB0098 [0,2,0,0,0,0|2,0,0]=4 3386 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1Cl WXVL_AN0085SB0095 [0,2,0,0,0,0|2,0,0]=4 3387 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1Cl WXVL_AN0085SB0095 [0,2,0,0,0,0|2,0,0]=4 3388 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1F WXVL_AN0085SB0094 [0,2,0,0,0,0|2,0,0]=4 3389 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1F WXVL_AN0085SB0094 [0,2,0,0,0,0|2,0,0]=4 3390 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1I WXVL_AN0085SB1145 [0,2,0,0,0,0|2,0,0]=4 3391 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1I WXVL_AN0085SB1145 [0,2,0,0,0,0|2,0,0]=4 3392 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1O WXVL_AN0085SB0400 [0,2,0,0,0,0|2,0,0]=4 3393 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1O WXVL_AN0085SB0400 [0,2,0,0,0,0|2,0,0]=4 3394 B16R1.177 CCC[C@@H](CO)NC(=O)Cc1ccccc1 WXVL_AK2551SB0092 [0,2,0,0,0,0|1,0,0]=3 3395 B16R1.177 CCC[C@@H](CO)NC(=O)Cc1ccccc1 WXVL_AK2551SB0092 [0,2,0,0,0,0|1,0,0]=3 3396 B16R1.177 CCC[C@@H](CO)NC(=O)Cc1ccccn1 WXVL_AK2551SA0032 [0,2,0,0,0,0|2,0,0]=4 3397 B16R1.177 CCC[C@@H](CO)NC(=O)Cc1ccccn1 WXVL_AK2551SA0032 [0,2,0,0,0,0|2,0,0]=4 3398 B16R1.177 CCC[C@@H](CO)NC(=O)Cc1cccnc1 WXVL_AK2551SA0029 [0,2,0,0,0,0|2,0,0]=4 3399 B16R1.177 CCC[C@@H](CO)NC(=O)Cc1cccnc1 WXVL_AK2551SA0029 [0,2,0,0,0,0|2,0,0]=4 3400 B16R1.177 CCC[C@@H](CO)NC(=O)Cc1cccnc1 WXVL_AK2551SB00049 [0,2,0,0,0,0|2,0,0]=4 3401 B16R1.177 CCC[C@@H](CO)NC(=O)Cc1cccnc1 WXVL_AK2551SB00049 [0,2,0,0,0,0|2,0,0]=4 3402 B16R1.177 CCC[C@@H](CO)NC(=O)Cc1ccncc1 WXVL_AK2551SA00106 [0,2,0,0,0,0|2,0,0]=4 3403 B16R1.177 CCC[C@@H](CO)NC(=O)Cc1ccncc1 WXVL_AK2551SA00106 [0,2,0,0,0,0|2,0,0]=4 3404 B16R1.2180 CCC[C@H](C)NS(=O)(=O)Cc1ccccc1 WXVL_AK00682HU0025 [0,2,0,0,0,0|2,0,0]=4 3405 B16R1.2180 CCC[C@H](C)NS(=O)(=O)Cc1ccccc1 WXVL_AK00682HU0025 [0,2,0,0,0,0|2,0,0]=4 3406 B16R1.3991 COCC(C)(C)NC(=O)Cc1ccccc1 WXVL_AK1295SB0092 [0,2,0,0,0,0|2,0,0]=4 3407 B16R1.3991 COCC(C)(C)NC(=O)Cc1ccccc1 WXVL_AK1295SB0092 [0,2,0,0,0,0|2,0,0]=4 3408 B16R1.4235 CC(CCO)NC(=O)Cc1ccccc1Br WXVL_AK1288SB0093 [0,2,0,0,0,0|2,0,0]=4 3409 B16R1.4235 CC(CCO)NC(=O)Cc1ccccc1Br WXVL_AK1288SB0093 [0,2,0,0,0,0|2,0,0]=4 3410 B16R1.4235 CC(CCO)NC(=O)Cc1ccccc1Cl WXVL_AK1288SB0095 [0,2,0,0,0,0|2,0,0]=4 3411 B16R1.4235 CC(CCO)NC(=O)Cc1ccccc1Cl WXVL_AK1288SB0095 [0,2,0,0,0,0|2,0,0]=4 3412 B16R1.4235 CC(CCO)NC(=O)Cc1ccccc1F WXVL_AK1288SB0094 [0,2,0,0,0,0|2,0,0]=4 3413 B16R1.4235 CC(CCO)NC(=O)Cc1ccccc1F WXVL_AK1288SB0094 [0,2,0,0,0,0|2,0,0]=4 3414 B16R1.4235 CC(CCO)NC(=O)Cc1ccccc1I WXVL_AK1288SB1145 [0,2,0,0,0,0|2,0,0]=4 3415 B16R1.4235 CC(CCO)NC(=O)Cc1ccccc1I WXVL_AK1288SB1145 [0,2,0,0,0,0|2,0,0]=4 3416 B16R1.4235 CC(CCO)NC(=O)Cc1ccccc1O WXVL_AK1288SB0400 [0,2,0,0,0,0|2,0,0]=4 3417 B16R1.4235 CC(CCO)NC(=O)Cc1ccccc1O WXVL_AK1288SB0400 [0,2,0,0,0,0|2,0,0]=4 3418 B16R1.4235 CCC[C@H](C)NC(=O)Cc1ccccc1Br WXVL_AK00682SB0093 [0,2,0,0,0,0|1,0,0]=3 3419 B16R1.4235 CCC[C@H](C)NC(=O)Cc1ccccc1Br WXVL_AK00682SB0093 [0,2,0,0,0,0|1,0,0]=3 3420 B16R1.4235 CCC[C@H](C)NC(=O)Cc1ccccc1C WXVL_AK00682SB0098 [0,2,0,0,0,0|1,0,0]=3 3421 B16R1.4235 CCC[C@H](C)NC(=O)Cc1ccccc1C WXVL_AK00682SB0098 [0,2,0,0,0,0|1,0,0]=3 3422 B16R1.4235 CCC[C@H](C)NC(=O)Cc1ccccc1Cl WXVL_AK00682SB0095 [0,2,0,0,0,0|1,0,0]=3 3423 B16R1.4235 CCC[C@H](C)NC(=O)Cc1ccccc1Cl WXVL_AK00682SB0095 [0,2,0,0,0,0|1,0,0]=3 3424 B16R1.4235 CCC[C@H](C)NC(=O)Cc1ccccc1F WXVL_AK00682SB0094 [0,2,0,0,0,0|1,0,0]=3 3425 B16R1.4235 CCC[C@H](C)NC(=O)Cc1ccccc1F WXVL_AK00682SB0094 [0,2,0,0,0,0|1,0,0]=3 3426 B16R1.4235 CCC[C@H](C)NC(=O)Cc1ccccc1I WXVL_AK00682SB1145 [0,2,0,0,0,0|1,0,0]=3 3427 B16R1.4235 CCC[C@H](C)NC(=O)Cc1ccccc1I WXVL_AK00682SB1145 [0,2,0,0,0,0|1,0,0]=3 3428 B16R1.4235 CCC[C@H](C)NC(=O)Cc1ccccc1O WXVL_AK00682SB0400 [0,2,0,0,0,0|1,0,0]=3 3429 B16R1.4235 CCC[C@H](C)NC(=O)Cc1ccccc1O WXVL_AK00682SB0400 [0,2,0,0,0,0|1,0,0]=3 3430 B16R1.4235 CCC[C@H](C)NC(=O)Cc1cccnc1Cl WXVL_AK00682SA0056 [0,2,0,0,0,0|2,0,0]=4 3431 B16R1.4235 CCC[C@H](C)NC(=O)Cc1cccnc1Cl WXVL_AK00682SA0056 [0,2,0,0,0,0|2,0,0]=4 3432 B16R1.4235 CCC[C@H](C)NC(=O)Nc1ccccc1Br WXVL_AK00682YV0003 [0,2,0,0,0,0|2,0,0]=4 3433 B16R1.4235 CCC[C@H](C)NC(=O)Nc1ccccc1Br WXVL_AK00682YV0003 [0,2,0,0,0,0|2,0,0]=4 3434 B16R1.4235 CCC[C@H](C)NC(=O)Nc1ccccc1C WXVL_AK00682YV0013 [0,2,0,0,0,0|2,0,0]=4 3435 B16R1.4235 CCC[C@H](C)NC(=O)Nc1ccccc1C WXVL_AK00682YV0013 [0,2,0,0,0,0|2,0,0]=4 3436 B16R1.4235 CCC[C@H](C)NC(=O)Nc1ccccc1Cl WXVL_AK00682YV0007 [0,2,0,0,0,0|2,0,0]=4 3437 B16R1.4235 CCC[C@H](C)NC(=O)Nc1ccccc1Cl WXVL_AK00682YV0007 [0,2,0,0,0,0|2,0,0]=4 3438 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1Br WXVL_AK00613SB0093 [0,2,0,0,0,0|2,0,0]=4 3439 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1Br WXVL_AK00613SB0093 [0,2,0,0,0,0|2,0,0]=4 3440 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1C WXVL_AK00613SB0098 [0,2,0,0,0,0|2,0,0]=4 3441 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1C WXVL_AK00613SB0098 [0,2,0,0,0,0|2,0,0]=4 3442 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1Cl WXVL_AK00613SB0095 [0,2,0,0,0,0|2,0,0]=4 3443 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1Cl WXVL_AK00613SB0095 [0,2,0,0,0,0|2,0,0]=4 3444 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1F WXVL_AK00613SB0094 [0,2,0,0,0,0|2,0,0]=4 3445 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1F WXVL_AK00613SB0094 [0,2,0,0,0,0|2,0,0]=4 3446 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1I WXVL_AK00613SB1145 [0,2,0,0,0,0|2,0,0]=4 3447 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1I WXVL_AK00613SB1145 [0,2,0,0,0,0|2,0,0]=4 3448 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1O WXVL_AK00613SB0400 [0,2,0,0,0,0|2,0,0]=4 3449 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1O WXVL_AK00613SB0400 [0,2,0,0,0,0|2,0,0]=4 3450 B16R1.4235 COC[C@H](C)NC(=O)Cc1ccccc1Br WXVL_AK0137SB0093 [0,2,0,0,0,0|2,0,0]=4 3451 B16R1.4235 COC[C@H](C)NC(=O)Cc1ccccc1Br WXVL_AK0137SB0093 [0,2,0,0,0,0|2,0,0]=4 3452 B16R1.4235 COC[C@H](C)NC(=O)Cc1ccccc1C WXVL_AK0137SB0098 [0,2,0,0,0,0|2,0,0]=4 3453 B16R1.4235 COC[C@H](C)NC(=O)Cc1ccccc1C WXVL_AK0137SB0098 [0,2,0,0,0,0|2,0,0]=4 3454 B16R1.4235 COC[C@H](C)NC(=O)Cc1ccccc1Cl WXVL_AK0137SB0095 [0,2,0,0,0,0|2,0,0]=4 3455 B16R1.4235 COC[C@H](C)NC(=O)Cc1ccccc1Cl WXVL_AK0137SB0095 [0,2,0,0,0,0|2,0,0]=4 3456 B16R1.4235 COC[C@H](C)NC(=O)Cc1ccccc1F WXVL_AK0137SB0094 [0,2,0,0,0,0|2,0,0]=4 3457 B16R1.4235 COC[C@H](C)NC(=O)Cc1ccccc1F WXVL_AK0137SB0094 [0,2,0,0,0,0|2,0,0]=4 3458 B16R1.4235 COC[C@H](C)NC(=O)Cc1ccccc1I WXVL_AK0137SB1145 [0,2,0,0,0,0|2,0,0]=4 3459 B16R1.4235 COC[C@H](C)NC(=O)Cc1ccccc1I WXVL_AK0137SB1145 [0,2,0,0,0,0|2,0,0]=4 3460 B16R1.4235 COC[C@H](C)NC(=O)Cc1ccccc1O WXVL_AK0137SB0400 [0,2,0,0,0,0|2,0,0]=4 3461 B16R1.4235 COC[C@H](C)NC(=O)Cc1ccccc1O WXVL_AK0137SB0400 [0,2,0,0,0,0|2,0,0]=4 3462 B16R1.4235 Cc1ccccc1CC(=O)NC(C)CCO WXVL_AK1288SB0098 [0,2,0,0,0,0|2,0,0]=4 3463 B16R1.4235 Cc1ccccc1CC(=O)NC(C)CCO WXVL_AK1288SB0098 [0,2,0,0,0,0|2,0,0]=4 3464 B16R1.6940 CC(CN(C)C)NC(=O)Cc1ccccc1 WXVL_AK0938SB0092 [0,2,0,0,0,0|2,0,0]=4 3465 B16R1.6940 CC(CN(C)C)NC(=O)Cc1ccccc1 WXVL_AK0938SB0092 [0,2,0,0,0,0|2,0,0]=4 3466 B16R1.360 CC(C)(CO)CNC(=O)Cc1ccccc1 WXVL_AK0104SB0092 [0,2,0,0,0,0|2,0,0]=4 3467 B16R1.360 CC(C)(CO)CNC(=O)Cc1ccccc1 WXVL_AK0104SB0092 [0,2,0,0,0,0|2,0,0]=4 3468 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1Br WXVL_AK00704SB0093 [0,2,0,0,0,0|2,0,0]=4 3469 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1Br WXVL_AK00704SB0093 [0,2,0,0,0,0|2,0,0]=4 3470 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1C WXVL_AK00704SB0098 [0,2,0,0,0,0|2,0,0]=4 3471 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1C WXVL_AK00704SB0098 [0,2,0,0,0,0|2,0,0]=4 3472 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1Cl WXVL_AK00704SB0095 [0,2,0,0,0,0|2,0,0]=4 3473 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1Cl WXVL_AK00704SB0095 [0,2,0,0,0,0|2,0,0]=4 3474 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1F WXVL_AK00704SB0094 [0,2,0,0,0,0|2,0,0]=4 3475 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1F WXVL_AK00704SB0094 [0,2,0,0,0,0|2,0,0]=4 3476 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1I WXVL_AK00704SB1145 [0,2,0,0,0,0|2,0,0]=4 3477 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1I WXVL_AK00704SB1145 [0,2,0,0,0,0|2,0,0]=4 3478 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1O WXVL_AK00704SB0400 [0,2,0,0,0,0|2,0,0]=4 3479 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1O WXVL_AK00704SB0400 [0,2,0,0,0,0|2,0,0]=4 3480 B16R1.7458 Cc1ccccc1CC(=O)NC[C@@H](F)CO WXVL_AK00590SB0098 [0,2,0,0,0,0|2,0,0]=4 3481 B16R1.7458 Cc1ccccc1CC(=O)NC[C@@H](F)CO WXVL_AK00590SB0098 [0,2,0,0,0,0|2,0,0]=4 3482 B16R1.7458 Cc1ccccc1CC(=O)NC[C@H](O)CO WXVL_AK00483SB0098 [0,2,0,0,0,0|2,0,0]=4 3483 B16R1.7458 Cc1ccccc1CC(=O)NC[C@H](O)CO WXVL_AK00483SB0098 [0,2,0,0,0,0|2,0,0]=4 3484 B16R1.7458 O=C(Cc1ccccc1Br)NC[C@@H](F)CO WXVL_AK00590SB0093 [0,2,0,0,0,0|2,0,0]=4 3485 B16R1.7458 O=C(Cc1ccccc1Br)NC[C@@H](F)CO WXVL_AK00590SB0093 [0,2,0,0,0,0|2,0,0]=4 3486 B16R1.7458 O=C(Cc1ccccc1Br)NC[C@H](O)CO WXVL_AK00483SB0093 [0,2,0,0,0,0|2,0,0]=4 3487 B16R1.7458 O=C(Cc1ccccc1Br)NC[C@H](O)CO WXVL_AK00483SB0093 [0,2,0,0,0,0|2,0,0]=4 3488 B16R1.7458 O=C(Cc1ccccc1Cl)NC[C@@H](F)CO WXVL_AK00590SB0095 [0,2,0,0,0,0|2,0,0]=4 3489 B16R1.7458 O=C(Cc1ccccc1Cl)NC[C@@H](F)CO WXVL_AK00590SB0095 [0,2,0,0,0,0|2,0,0]=4 3490 B16R1.7458 O=C(Cc1ccccc1Cl)NC[C@H](O)CO WXVL_AK00483SB0095 [0,2,0,0,0,0|2,0,0]=4 3491 B16R1.7458 O=C(Cc1ccccc1Cl)NC[C@H](O)CO WXVL_AK00483SB0095 [0,2,0,0,0,0|2,0,0]=4 3492 B16R1.7458 O=C(Cc1ccccc1F)NC[C@@H](F)CO WXVL_AK00590SB0094 [0,2,0,0,0,0|2,0,0]=4 3493 B16R1.7458 O=C(Cc1ccccc1F)NC[C@@H](F)CO WXVL_AK00590SB0094 [0,2,0,0,0,0|2,0,0]=4 3494 B16R1.7458 O=C(Cc1ccccc1F)NC[C@H](O)CO WXVL_AK00483SB0094 [0,2,0,0,0,0|2,0,0]=4 3495 B16R1.7458 O=C(Cc1ccccc1F)NC[C@H](O)CO WXVL_AK00483SB0094 [0,2,0,0,0,0|2,0,0]=4 3496 B16R1.7458 O=C(Cc1ccccc1I)NC[C@@H](F)CO WXVL_AK00590SB1145 [0,2,0,0,0,0|2,0,0]=4 3497 B16R1.7458 O=C(Cc1ccccc1I)NC[C@@H](F)CO WXVL_AK00590SB1145 [0,2,0,0,0,0|2,0,0]=4 3498 B16R1.7458 O=C(Cc1ccccc1I)NC[C@H](O)CO WXVL_AK00483SB1145 [0,2,0,0,0,0|2,0,0]=4 3499 B16R1.7458 O=C(Cc1ccccc1I)NC[C@H](O)CO WXVL_AK00483SB1145 [0,2,0,0,0,0|2,0,0]=4 3500 B16R1.7458 O=C(Cc1ccccc1O)NC[C@@H](F)CO WXVL_AK00590SB0400 [0,2,0,0,0,0|2,0,0]=4 3501 B16R1.7458 O=C(Cc1ccccc1O)NC[C@@H](F)CO WXVL_AK00590SB0400 [0,2,0,0,0,0|2,0,0]=4 3502 B16R1.7458 O=C(Cc1ccccc1O)NC[C@H](O)CO WXVL_AK00483SB0400 [0,2,0,0,0,0|2,0,0]=4 3503 B16R1.7458 O=C(Cc1ccccc1O)NC[C@H](O)CO WXVL_AK00483SB0400 [0,2,0,0,0,0|2,0,0]=4 3504 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1Br WXVL_AG00180SB1301 [0,2,0,0,0,0|2,0,0]=4 3505 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1Br WXVL_AG00180SB1301 [0,2,0,0,0,0|2,0,0]=4 3506 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1Cl WXVL_AG00129SB1301 [0,2,0,0,0,0|2,0,0]=4 3507 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1Cl WXVL_AG00129SB1301 [0,2,0,0,0,0|2,0,0]=4 3508 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1I WXVL_AG0385SB1301 [0,2,0,0,0,0|2,0,0]=4 3509 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1I WXVL_AG0385SB1301 [0,2,0,0,0,0|2,0,0]=4 3510 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1Br WXVL_AK0068SB0093 [0,2,0,0,0,0|1,0,0]=3 3511 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1Br WXVL_AK0068SB0093 [0,2,0,0,0,0|1,0,0]=3 3512 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1Cl WXVL_AK0068SB0095 [0,2,0,0,0,0|1,0,0]=3 3513 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1Cl WXVL_AK0068SB0095 [0,2,0,0,0,0|1,0,0]=3 3514 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1F WXVL_AK0068SB0094 [0,2,0,0,0,0|1,0,0]=3 3515 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1F WXVL_AK0068SB0094 [0,2,0,0,0,0|1,0,0]=3 3516 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1I WXVL_AK0068SB1145 [0,2,0,0,0,0|1,0,0]=3 3517 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1I WXVL_AK0068SB1145 [0,2,0,0,0,0|1,0,0]=3 3518 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1O WXVL_AK0068SB0400 [0,2,0,0,0,0|1,0,0]=3 3519 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1O WXVL_AK0068SB0400 [0,2,0,0,0,0|1,0,0]=3 3520 B16R1.7414 CC(C)CCNC(=O)Cc1cccnc1Cl WXVL_AK0068SA0056 [0,2,0,0,0,0|2,0,0]=4 3521 B16R1.7414 CC(C)CCNC(=O)Cc1cccnc1Cl WXVL_AK0068SA0056 [0,2,0,0,0,0|2,0,0]=4 3522 B16R1.7414 CC(C)CCNC(=O)Nc1ccccc1Br WXVL_AK0068YV0003 [0,2,0,0,0,0|2,0,0]=4 3523 B16R1.7414 CC(C)CCNC(=O)Nc1ccccc1Br WXVL_AK0068YV0003 [0,2,0,0,0,0|2,0,0]=4 3524 B16R1.7414 CC(C)CCNC(=O)Nc1ccccc1Cl WXVL_AK0068YV0007 [0,2,0,0,0,0|2,0,0]=4 3525 B16R1.7414 CC(C)CCNC(=O)Nc1ccccc1Cl WXVL_AK0068YV0007 [0,2,0,0,0,0|2,0,0]=4 3526 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1Br WXVL_AK0058SB0093 [0,2,0,0,0,0|2,0,0]=4 3527 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1Br WXVL_AK0058SB0093 [0,2,0,0,0,0|2,0,0]=4 3528 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1Cl WXVL_AK0058SB0095 [0,2,0,0,0,0|2,0,0]=4 3529 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1Cl WXVL_AK0058SB0095 [0,2,0,0,0,0|2,0,0]=4 3530 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1F WXVL_AK0058SB0094 [0,2,0,0,0,0|2,0,0]=4 3531 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1F WXVL_AK0058SB0094 [0,2,0,0,0,0|2,0,0]=4 3532 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1I WXVL_AK0058SB1145 [0,2,0,0,0,0|2,0,0]=4 3533 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1I WXVL_AK0058SB1145 [0,2,0,0,0,0|2,0,0]=4 3534 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1O WXVL_AK0058SB0400 [0,2,0,0,0,0|2,0,0]=4 3535 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1O WXVL_AK0058SB0400 [0,2,0,0,0,0|2,0,0]=4 3536 B16R1.7414 Cc1ccccc1CC(=O)NCCC(C)C WXVL_AK0068SB0098 [0,2,0,0,0,0|1,0,0]=3 3537 B16R1.7414 Cc1ccccc1CC(=O)NCCC(C)C WXVL_AK0068SB0098 [0,2,0,0,0,0|1,0,0]=3 3538 B16R1.7414 Cc1ccccc1CC(=O)NCCN(C)C WXVL_AK0058SB0098 [0,2,0,0,0,0|2,0,0]=4 3539 B16R1.7414 Cc1ccccc1CC(=O)NCCN(C)C WXVL_AK0058SB0098 [0,2,0,0,0,0|2,0,0]=4 3540 B16R1.7414 Cc1ccccc1NC(=O)CCCC(C)C WXVL_AG0027SB1301 [0,2,0,0,0,0|2,0,0]=4 3541 B16R1.7414 Cc1ccccc1NC(=O)CCCC(C)C WXVL_AG0027SB1301 [0,2,0,0,0,0|2,0,0]=4 3542 B16R1.7414 Cc1ccccc1NC(=O)NCCC(C)C WXVL_AK0068YV0013 [0,2,0,0,0,0|2,0,0]=4 3543 B16R1.7414 Cc1ccccc1NC(=O)NCCC(C)C WXVL_AK0068YV0013 [0,2,0,0,0,0|2,0,0]=4 3544 B16R1.12285 CC(C)CCNS(=O)(=O)Cc1ccccc1 WXVL_AK0068HU0025 [0,2,0,0,0,0|2,0,0]=4 3545 B16R1.12285 CC(C)CCNS(=O)(=O)Cc1ccccc1 WXVL_AK0068HU0025 [0,2,0,0,0,0|2,0,0]=4 3546 B16R1.59031 CC(C)(O)CCNC(=O)Cc1ccccc1 WXVL_AK1558SB0092 [0,2,0,0,0,0|1,0,0]=3 3547 B16R1.59031 CC(C)(O)CCNC(=O)Cc1ccccc1 WXVL_AK1558SB0092 [0,2,0,0,0,0|1,0,0]=3 3548 B16R1.59031 CC(C)(O)CCNC(=O)Cc1ccccn1 WXVL_AK1558SA0032 [0,2,0,0,0,0|2,0,0]=4 3549 B16R1.59031 CC(C)(O)CCNC(=O)Cc1ccccn1 WXVL_AK1558SA0032 [0,2,0,0,0,0|2,0,0]=4 3550 B16R1.59031 CC(C)(O)CCNC(=O)Cc1cccnc1 WXVL_AK1558SA0029 [0,2,0,0,0,0|2,0,0]=4 3551 B16R1.59031 CC(C)(O)CCNC(=O)Cc1cccnc1 WXVL_AK1558SA0029 [0,2,0,0,0,0|2,0,0]=4 3552 B16R1.59031 CC(C)(O)CCNC(=O)Cc1cccnc1 WXVL_AK1558SB00049 [0,2,0,0,0,0|2,0,0]=4 3553 B16R1.59031 CC(C)(O)CCNC(=O)Cc1cccnc1 WXVL_AK1558SB00049 [0,2,0,0,0,0|2,0,0]=4 3554 B16R1.59031 CC(C)(O)CCNC(=O)Cc1ccncc1 WXVL_AK1558SA00106 [0,2,0,0,0,0|2,0,0]=4 3555 B16R1.59031 CC(C)(O)CCNC(=O)Cc1ccncc1 WXVL_AK1558SA00106 [0,2,0,0,0,0|2,0,0]=4 3556 B16R1.59031 CS(=O)(=O)CCNC(=O)Cc1ccccc1 WXVL_AK0333SB0092 [0,2,0,0,0,0|2,0,0]=4 3557 B16R1.59031 CS(=O)(=O)CCNC(=O)Cc1ccccc1 WXVL_AK0333SB0092 [0,2,0,0,0,0|2,0,0]=4 3558 B16R1.59031 O=C(Cc1ccccc1)NCCC(F)(F)F WXVL_AK0145SB0092 [0,2,0,0,0,0|2,0,0]=4 3559 B16R1.59031 O=C(Cc1ccccc1)NCCC(F)(F)F WXVL_AK0145SB0092 [0,2,0,0,0,0|2,0,0]=4 3560 B16R1.7391 CCCCNC(=O)Cc1ccccc1C#N WXVL_AK00588SB3111 [0,2,0,0,0,0|1,0,0]=3 3561 B16R1.7391 CCCCNC(=O)Cc1ccccc1C#N WXVL_AK00588SB3111 [0,2,0,0,0,0|1,0,0]=3 3562 B16R1.7391 CCCCNC(=O)Cc1ccccc1OC WXVL_AK00588SB0427 [0,2,0,0,0,0|1,0,0]=3 3563 B16R1.7391 CCCCNC(=O)Cc1ccccc1OC WXVL_AK00588SB0427 [0,2,0,0,0,0|1,0,0]=3 3564 B16R1.7391 CCCCNC(=O)Nc1ccccc1CC WXVL_AK00588YV0101 [0,2,0,0,0,0|2,0,0]=4 3565 B16R1.7391 CCCCNC(=O)Nc1ccccc1CC WXVL_AK00588YV0101 [0,2,0,0,0,0|2,0,0]=4 3566 B16R1.7391 CCCCNC(=O)Nc1ccccc1OC WXVL_AK00588YV0010 [0,2,0,0,0,0|2,0,0]=4 3567 B16R1.7391 CCCCNC(=O)Nc1ccccc1OC WXVL_AK00588YV0010 [0,2,0,0,0,0|2,0,0]=4 3568 B16R1.7391 COc1ccccc1CC(=O)NCCCO WXVL_AK0073SB0427 [0,2,0,0,0,0|2,0,0]=4 3569 B16R1.7391 COc1ccccc1CC(=O)NCCCO WXVL_AK0073SB0427 [0,2,0,0,0,0|2,0,0]=4 3570 B16R1.7391 COc1ccccc1CC(=O)NCCSC WXVL_AK00440SB0427 [0,2,0,0,0,0|2,0,0]=4 3571 B16R1.7391 COc1ccccc1CC(=O)NCCSC WXVL_AK00440SB0427 [0,2,0,0,0,0|2,0,0]=4 3572 B16R1.7391 CSCCNC(=O)Cc1ccccc1C#N WXVL_AK00440SB3111 [0,2,0,0,0,0|2,0,0]=4 3573 B16R1.7391 CSCCNC(=O)Cc1ccccc1C#N WXVL_AK00440SB3111 [0,2,0,0,0,0|2,0,0]=4 3574 B16R1.7391 N#Cc1ccccc1CC(=O)NCCCO WXVL_AK0073SB3111 [0,2,0,0,0,0|2,0,0]=4 3575 B16R1.7391 N#Cc1ccccc1CC(=O)NCCCO WXVL_AK0073SB3111 [0,2,0,0,0,0|2,0,0]=4 3576 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Cl)Cl WXVL_AK00588SB1287 [0,2,0,0,0,0|1,0,0]=3 3577 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Cl)Cl WXVL_AK00588SB1287 [0,2,0,0,0,0|1,0,0]=3 3578 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Cl)F WXVL_AK00588SB0498 [0,2,0,0,0,0|1,0,0]=3 3579 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Cl)F WXVL_AK00588SB0498 [0,2,0,0,0,0|1,0,0]=3 3580 B16R1.22096 CCCCNC(=O)Cc1c(cccc1F)F WXVL_AK00588SD0088 [0,2,0,0,0,0|1,0,0]=3 3581 B16R1.22096 CCCCNC(=O)Cc1c(cccc1F)F WXVL_AK00588SD0088 [0,2,0,0,0,0|1,0,0]=3 3582 B16R1.22096 CCCCNC(=O)Nc1c(cccc1C)C WXVL_AK00588YV0014 [0,2,0,0,0,0|2,0,0]=4 3583 B16R1.22096 CCCCNC(=O)Nc1c(cccc1C)C WXVL_AK00588YV0014 [0,2,0,0,0,0|2,0,0]=4 3584 B16R1.22096 CCCCNC(=O)Nc1c(cccc1Cl)Cl WXVL_AK00588YV0009 [0,2,0,0,0,0|2,0,0]=4 3585 B16R1.22096 CCCCNC(=O)Nc1c(cccc1Cl)Cl WXVL_AK00588YV0009 [0,2,0,0,0,0|2,0,0]=4 3586 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Cl)Cl WXVL_AK00440SB1287 [0,2,0,0,0,0|2,0,0]=4 3587 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Cl)Cl WXVL_AK00440SB1287 [0,2,0,0,0,0|2,0,0]=4 3588 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Cl)F WXVL_AK00440SB0498 [0,2,0,0,0,0|2,0,0]=4 3589 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Cl)F WXVL_AK00440SB0498 [0,2,0,0,0,0|2,0,0]=4 3590 B16R1.22096 CSCCNC(=O)Cc1c(cccc1F)F WXVL_AK00440SD0088 [0,2,0,0,0,0|2,0,0]=4 3591 B16R1.22096 CSCCNC(=O)Cc1c(cccc1F)F WXVL_AK00440SD0088 [0,2,0,0,0,0|2,0,0]=4 3592 B16R1.22096 O=C(Cc1c(cccc1Cl)Cl)NCCCO WXVL_AK0073SB1287 [0,2,0,0,0,0|2,0,0]=4 3593 B16R1.22096 O=C(Cc1c(cccc1Cl)Cl)NCCCO WXVL_AK0073SB1287 [0,2,0,0,0,0|2,0,0]=4 3594 B16R1.22096 O=C(Cc1c(cccc1Cl)F)NCCCO WXVL_AK0073SB0498 [0,2,0,0,0,0|2,0,0]=4 3595 B16R1.22096 O=C(Cc1c(cccc1Cl)F)NCCCO WXVL_AK0073SB0498 [0,2,0,0,0,0|2,0,0]=4 3596 B16R1.22096 O=C(Cc1c(cccc1F)F)NCCCO WXVL_AK0073SD0088 [0,2,0,0,0,0|2,0,0]=4 3597 B16R1.22096 O=C(Cc1c(cccc1F)F)NCCCO WXVL_AK0073SD0088 [0,2,0,0,0,0|2,0,0]=4 3598 B14R2.343 CC1CC1C(=O)Nc2ccccc2 WXVL_AG00183SB0041 [1,0,0,1,0,0|1,0,0]=3 3599 B14R2.343 CC1CC1C(=O)Nc2ccccc2 WXVL_AG00183SB0041 [1,0,0,1,0,0|1,0,0]=3 3600 B14R2.343 CC1CC1C(=O)Nc2ccccn2 WXVL_AF00298SB0041 [1,0,0,1,0,0|2,0,0]=4 3601 B14R2.343 CC1CC1C(=O)Nc2ccccn2 WXVL_AF00298SB0041 [1,0,0,1,0,0|2,0,0]=4 3602 B14R2.343 O=C(Nc1ccccc1)[C@@H]2C[C@@H]2F WXVL_AG00183SB1245 [1,0,0,1,0,0|2,0,0]=4 3603 B14R2.343 O=C(Nc1ccccc1)[C@@H]2C[C@@H]2F WXVL_AG00183SB1245 [1,0,0,1,0,0|2,0,0]=4 3604 B14R2.343 O=C(Nc1ccccc1)[C@H]2C[C@H]2F WXVL_AG00183SB00019 [1,0,0,1,0,0|2,0,0]=4 3605 B14R2.343 O=C(Nc1ccccc1)[C@H]2C[C@H]2F WXVL_AG00183SB00019 [1,0,0,1,0,0|2,0,0]=4 3606 B14R2.9589 O=C(Nc1ccccc1)C2CCC2 WXVL_AG00183SB0042 [1,0,0,1,0,0|1,0,0]=3 3607 B14R2.9589 O=C(Nc1ccccc1)C2CCC2 WXVL_AG00183SB0042 [1,0,0,1,0,0|1,0,0]=3 3608 B14R2.9589 O=C(Nc1ccccn1)C2CCC2 WXVL_AF00298SB0042 [1,0,0,1,0,0|2,0,0]=4 3609 B14R2.9589 O=C(Nc1ccccn1)C2CCC2 WXVL_AF00298SB0042 [1,0,0,1,0,0|2,0,0]=4 3610 B14R2.9593 O=C(CC1CC1)Nc2ccccc2 WXVL_AG00183SB0155 [1,0,0,1,0,0|1,0,0]=3 3611 B14R2.9593 O=C(CC1CC1)Nc2ccccc2 WXVL_AG00183SB0155 [1,0,0,1,0,0|1,0,0]=3 3612 B14R2.9593 O=C(CC1CC1)Nc2ccccn2 WXVL_AF00298SB0155 [1,0,0,1,0,0|2,0,0]=4 3613 B14R2.9593 O=C(CC1CC1)Nc2ccccn2 WXVL_AF00298SB0155 [1,0,0,1,0,0|2,0,0]=4 3614 B14R2.9593 O=C(Cc1ccccc1)NC2CC2 WXVL_AK0001SB0092 [1,0,0,1,0,0|1,0,0]=3 3615 B14R2.9593 O=C(Cc1ccccc1)NC2CC2 WXVL_AK0001SB0092 [1,0,0,1,0,0|1,0,0]=3 3616 B14R2.9593 O=C(Cc1ccccn1)NC2CC2 WXVL_AK0001SA0032 [1,0,0,1,0,0|2,0,0]=4 3617 B14R2.9593 O=C(Cc1ccccn1)NC2CC2 WXVL_AK0001SA0032 [1,0,0,1,0,0|2,0,0]=4 3618 B14R2.9593 O=C(Cc1cccnc1)NC2CC2 WXVL_AK0001SA0029 [1,0,0,1,0,0|2,0,0]=4 3619 B14R2.9593 O=C(Cc1cccnc1)NC2CC2 WXVL_AK0001SA0029 [1,0,0,1,0,0|2,0,0]=4 3620 B14R2.9593 O=C(Cc1cccnc1)NC2CC2 WXVL_AK0001SB00049 [1,0,0,1,0,0|2,0,0]=4 3621 B14R2.9593 O=C(Cc1cccnc1)NC2CC2 WXVL_AK0001SB00049 [1,0,0,1,0,0|2,0,0]=4 3622 B14R2.9593 O=C(Cc1ccncc1)NC2CC2 WXVL_AK0001SA00106 [1,0,0,1,0,0|2,0,0]=4 3623 B14R2.9593 O=C(Cc1ccncc1)NC2CC2 WXVL_AK0001SA00106 [1,0,0,1,0,0|2,0,0]=4 3624 B14R2.114 O=C(c1ccccc1)N2CCCC2 WXVL_AN0008SD0001 [0,0,0,1,1,0|1,0,0]=3 3625 B14R2.114 O=C(c1ccccc1)N2CCCC2 WXVL_AN0008SD0001 [0,0,0,1,1,0|1,0,0]=3 3626 B14R2.114 O=C(c1ccccn1)N2CCCC2 WXVL_AN0008SC0058 [0,0,0,1,1,0|2,0,0]=4 3627 B14R2.114 O=C(c1ccccn1)N2CCCC2 WXVL_AN0008SC0058 [0,0,0,1,1,0|2,0,0]=4 3628 B14R2.114 O=C(c1cccnc1)N2CCCC2 WXVL_AN0008SC0061 [0,0,0,1,1,0|2,0,0]=4 3629 B14R2.114 O=C(c1cccnc1)N2CCCC2 WXVL_AN0008SC0061 [0,0,0,1,1,0|2,0,0]=4 3630 B14R2.114 O=C(c1ccncc1)N2CCCC2 WXVL_AN0008SC0062 [0,0,0,1,1,0|2,0,0]=4 3631 B14R2.114 O=C(c1ccncc1)N2CCCC2 WXVL_AN0008SC0062 [0,0,0,1,1,0|2,0,0]=4 3632 B14R2.794 O=C(NC1CNC1)c2ccccc2 WXVL_AK1291SD0001 [0,0,0,1,1,0|2,0,0]=4 3633 B14R2.794 O=C(NC1CNC1)c2ccccc2 WXVL_AK1291SD0001 [0,0,0,1,1,0|2,0,0]=4 3634 B14R2.794 O=C(NC1CSC1)c2ccccc2 WXVL_AK2089SD0001 [0,0,0,1,1,0|2,0,0]=4 3635 B14R2.794 O=C(NC1CSC1)c2ccccc2 WXVL_AK2089SD0001 [0,0,0,1,1,0|2,0,0]=4 3636 B14R2.793 O=C(Cc1cccs1)N2CCCC2 WXVL_AN0008SA0018 [0,0,0,1,1,0|2,0,0]=4 3637 B14R2.793 O=C(Cc1cccs1)N2CCCC2 WXVL_AN0008SA0018 [0,0,0,1,1,0|2,0,0]=4 3638 B14R2.793 O=C(Cc1ccsc1)N2CCCC2 WXVL_AN0008SA0020 [0,0,0,1,1,0|2,0,0]=4 3639 B14R2.793 O=C(Cc1ccsc1)N2CCCC2 WXVL_AN0008SA0020 [0,0,0,1,1,0|2,0,0]=4 3640 B16R2.2238 O=C(/C=C/c1ccccc1)N2CCCC2 WXVL_AN0008SB0115 [0,0,0,1,0,1|1,0,1]=4 3641 B16R2.2238 O=C(/C=C/c1ccccc1)N2CCCC2 WXVL_AN0008SB0115 [0,0,0,1,0,1|1,0,1]=4 3642 B16R2.2238 O=C(C#Cc1ccccc1)N2CCCC2 WXVL_AN0008SB0114 [0,0,0,1,0,1|1,0,1]=4 3643 B16R2.2238 O=C(C#Cc1ccccc1)N2CCCC2 WXVL_AN0008SB0114 [0,0,0,1,0,1|1,0,1]=4 3644 B16R2.2238 O=C(CCc1ccccc1)N2CCCC2 WXVL_AN0008SB0067 [0,0,0,1,0,1|1,0,0]=3 3645 B16R2.2238 O=C(CCc1ccccc1)N2CCCC2 WXVL_AN0008SB0067 [0,0,0,1,0,1|1,0,0]=3 3646 B16R2.2238 O=C(CCc1ccccn1)N2CCCC2 WXVL_AN0008SA0316 [0,0,0,1,0,1|2,0,0]=4 3647 B16R2.2238 O=C(CCc1ccccn1)N2CCCC2 WXVL_AN0008SA0316 [0,0,0,1,0,1|2,0,0]=4 3648 B16R2.2238 O=C(CCc1cccnc1)N2CCCC2 WXVL_AN0008SA0031 [0,0,0,1,0,1|2,0,0]=4 3649 B16R2.2238 O=C(CCc1cccnc1)N2CCCC2 WXVL_AN0008SA0031 [0,0,0,1,0,1|2,0,0]=4 3650 B16R2.2238 O=C(COc1ccccc1)N2CCCC2 WXVL_AN0008SB0086 [0,0,0,1,0,1|1,0,0]=3 3651 B16R2.2238 O=C(COc1ccccc1)N2CCCC2 WXVL_AN0008SB0086 [0,0,0,1,0,1|1,0,0]=3 3652 B16R2.2238 O=C(COc1cccnc1)N2CCCC2 WXVL_AN0008SA0051 [0,0,0,1,0,1|2,0,0]=4 3653 B16R2.2238 O=C(COc1cccnc1)N2CCCC2 WXVL_AN0008SA0051 [0,0,0,1,0,1|2,0,0]=4 3654 B16R2.2238 O=C(CSc1ccccc1)N2CCCC2 WXVL_AN0008SB0113 [0,0,0,1,0,1|1,0,0]=3 3655 B16R2.2238 O=C(CSc1ccccc1)N2CCCC2 WXVL_AN0008SB0113 [0,0,0,1,0,1|1,0,0]=3 3656 B16R2.2238 O=C(CSc1ccncc1)N2CCCC2 WXVL_AN0008SA0055 [0,0,0,1,0,1|2,0,0]=4 3657 B16R2.2238 O=C(CSc1ccncc1)N2CCCC2 WXVL_AN0008SA0055 [0,0,0,1,0,1|2,0,0]=4 3658 B16R2.2238 O=C(NCc1ccccc1)C2CCCC2 WXVL_AK00502SB0043 [0,0,0,1,0,1|1,0,0]=3 3659 B16R2.2238 O=C(NCc1ccccc1)C2CCCC2 WXVL_AK00502SB0043 [0,0,0,1,0,1|1,0,0]=3 3660 B16R2.2238 O=C(NCc1ccccc1)C2CCCO2 WXVL_AK00502SB1033 [0,0,0,1,0,1|2,0,0]=4 3661 B16R2.2238 O=C(NCc1ccccc1)C2CCCO2 WXVL_AK00502SB1033 [0,0,0,1,0,1|2,0,0]=4 3662 B16R2.2238 O=C(NCc1ccccc1)C2CCCS2 WXVL_AK00502SB0022 [0,0,0,1,0,1|2,0,0]=4 3663 B16R2.2238 O=C(NCc1ccccc1)C2CCCS2 WXVL_AK00502SB0022 [0,0,0,1,0,1|2,0,0]=4 3664 B16R2.2238 O=C(NCc1ccccc1)[C@H]2CCCO2 WXVL_AK00502SB00043 [0,0,0,1,0,1|2,0,0]=4 3665 B16R2.2238 O=C(NCc1ccccc1)[C@H]2CCCO2 WXVL_AK00502SB00043 [0,0,0,1,0,1|2,0,0]=4 3666 B16R2.2238 O=C(NCc1ccccn1)C2CCCC2 WXVL_AK0018SB0043 [0,0,0,1,0,1|2,0,0]=4 3667 B16R2.2238 O=C(NCc1ccccn1)C2CCCC2 WXVL_AK0018SB0043 [0,0,0,1,0,1|2,0,0]=4 3668 B16R2.2238 O=C(NCc1cccnc1)C2CCCC2 WXVL_AK0020SB0043 [0,0,0,1,0,1|2,0,0]=4 3669 B16R2.2238 O=C(NCc1cccnc1)C2CCCC2 WXVL_AK0020SB0043 [0,0,0,1,0,1|2,0,0]=4 3670 B16R2.2238 O=C(NCc1ccncc1)C2CCCC2 WXVL_AK0021SB0043 [0,0,0,1,0,1|2,0,0]=4 3671 B16R2.2238 O=C(NCc1ccncc1)C2CCCC2 WXVL_AK0021SB0043 [0,0,0,1,0,1|2,0,0]=4 3672 B16R2.44148 O=C(CC1CCC1)NCc2ccccc2 WXVL_AK00502SB2207 [0,0,0,1,0,1|1,0,0]=3 3673 B16R2.44148 O=C(CC1CCC1)NCc2ccccc2 WXVL_AK00502SB2207 [0,0,0,1,0,1|1,0,0]=3 3674 B16R2.44148 O=C(CC1CCC1)NCc2ccccn2 WXVL_AK0018SB2207 [0,0,0,1,0,1|2,0,0]=4 3675 B16R2.44148 O=C(CC1CCC1)NCc2ccccn2 WXVL_AK0018SB2207 [0,0,0,1,0,1|2,0,0]=4 3676 B16R2.44148 O=C(CC1CCC1)NCc2cccnc2 WXVL_AK0020SB2207 [0,0,0,1,0,1|2,0,0]=4 3677 B16R2.44148 O=C(CC1CCC1)NCc2cccnc2 WXVL_AK0020SB2207 [0,0,0,1,0,1|2,0,0]=4 3678 B16R2.44148 O=C(CC1CCC1)NCc2ccncc2 WXVL_AK0021SB2207 [0,0,0,1,0,1|2,0,0]=4 3679 B16R2.44148 O=C(CC1CCC1)NCc2ccncc2 WXVL_AK0021SB2207 [0,0,0,1,0,1|2,0,0]=4 3680 B16R2.44148 O=C(CCc1ccccc1)NC2CNC2 WXVL_AK1291SB0067 [0,0,0,1,0,1|2,0,0]=4 3681 B16R2.44148 O=C(CCc1ccccc1)NC2CNC2 WXVL_AK1291SB0067 [0,0,0,1,0,1|2,0,0]=4 3682 B16R2.44148 O=C(CCc1ccccc1)NC2CSC2 WXVL_AK2089SB0067 [0,0,0,1,0,1|2,0,0]=4 3683 B16R2.44148 O=C(CCc1ccccc1)NC2CSC2 WXVL_AK2089SB0067 [0,0,0,1,0,1|2,0,0]=4 3684 B16R2.44148 O=C(COc1ccccc1)NC2CNC2 WXVL_AK1291SB0086 [0,0,0,1,0,1|2,0,0]=4 3685 B16R2.44148 O=C(COc1ccccc1)NC2CNC2 WXVL_AK1291SB0086 [0,0,0,1,0,1|2,0,0]=4 3686 B16R2.44148 O=C(COc1ccccc1)NC2CSC2 WXVL_AK2089SB0086 [0,0,0,1,0,1|2,0,0]=4 3687 B16R2.44148 O=C(COc1ccccc1)NC2CSC2 WXVL_AK2089SB0086 [0,0,0,1,0,1|2,0,0]=4 3688 B16R2.44148 O=C(CSc1ccccc1)NC2CNC2 WXVL_AK1291SB0113 [0,0,0,1,0,1|2,0,0]=4 3689 B16R2.44148 O=C(CSc1ccccc1)NC2CNC2 WXVL_AK1291SB0113 [0,0,0,1,0,1|2,0,0]=4 3690 B16R2.44148 O=C(CSc1ccccc1)NC2CSC2 WXVL_AK2089SB0113 [0,0,0,1,0,1|2,0,0]=4 3691 B16R2.44148 O=C(CSc1ccccc1)NC2CSC2 WXVL_AK2089SB0113 [0,0,0,1,0,1|2,0,0]=4 3692 B16R2.44153 O=C(C=CC1CC1)NCc2ccccc2 WXVL_AK00502SB4216 [0,0,0,1,0,1|1,0,1]=4 3693 B16R2.44153 O=C(C=CC1CC1)NCc2ccccc2 WXVL_AK00502SB4216 [0,0,0,1,0,1|1,0,1]=4 3694 B16R2.44153 O=C(CCC1CC1)NCc2ccccc2 WXVL_AK00502SB5360 [0,0,0,1,0,1|1,0,0]=3 3695 B16R2.44153 O=C(CCC1CC1)NCc2ccccc2 WXVL_AK00502SB5360 [0,0,0,1,0,1|1,0,0]=3 3696 B16R2.44153 O=C(CCC1CC1)NCc2ccccn2 WXVL_AK0018SB5360 [0,0,0,1,0,1|2,0,0]=4 3697 B16R2.44153 O=C(CCC1CC1)NCc2ccccn2 WXVL_AK0018SB5360 [0,0,0,1,0,1|2,0,0]=4 3698 B16R2.44153 O=C(CCC1CC1)NCc2cccnc2 WXVL_AK0020SB5360 [0,0,0,1,0,1|2,0,0]=4 3699 B16R2.44153 O=C(CCC1CC1)NCc2cccnc2 WXVL_AK0020SB5360 [0,0,0,1,0,1|2,0,0]=4 3700 B16R2.44153 O=C(CCC1CC1)NCc2ccncc2 WXVL_AK0021SB5360 [0,0,0,1,0,1|2,0,0]=4 3701 B16R2.44153 O=C(CCC1CC1)NCc2ccncc2 WXVL_AK0021SB5360 [0,0,0,1,0,1|2,0,0]=4 3702 B16R2.88 O=C(Cc1ccccc1)N2CCOCC2 WXVL_AN00478SB0092 [0,1,0,1,0,0|1,0,0]=3 3703 B16R2.88 O=C(Cc1ccccc1)N2CCOCC2 WXVL_AN00478SB0092 [0,1,0,1,0,0|1,0,0]=3 3704 B16R2.88 O=C(Cc1ccccc1)N2CCSCC2 WXVL_AN0896SB0092 [0,1,0,1,0,0|1,0,0]=3 3705 B16R2.88 O=C(Cc1ccccn1)N2CCOCC2 WXVL_AN00478SA0032 [0,1,0,1,0,0|2,0,0]=4 3706 B16R2.88 O=C(Cc1ccccn1)N2CCOCC2 WXVL_AN00478SA0032 [0,1,0,1,0,0|2,0,0]=4 3707 B16R2.88 O=C(Cc1ccccn1)N2CCSCC2 WXVL_AN0896SA0032 [0,1,0,1,0,0|2,0,0]=4 3708 B16R2.88 O=C(Cc1cccnc1)N2CCOCC2 WXVL_AN00478SA0029 [0,1,0,1,0,0|2,0,0]=4 3709 B16R2.88 O=C(Cc1cccnc1)N2CCOCC2 WXVL_AN00478SA0029 [0,1,0,1,0,0|2,0,0]=4 3710 B16R2.88 O=C(Cc1cccnc1)N2CCOCC2 WXVL_AN00478SB00049 [0,1,0,1,0,0|2,0,0]=4 3711 B16R2.88 O=C(Cc1cccnc1)N2CCOCC2 WXVL_AN00478SB00049 [0,1,0,1,0,0|2,0,0]=4 3712 B16R2.88 O=C(Cc1cccnc1)N2CCSCC2 WXVL_AN0896SA0029 [0,1,0,1,0,0|2,0,0]=4 3713 B16R2.88 O=C(Cc1cccnc1)N2CCSCC2 WXVL_AN0896SB00049 [0,1,0,1,0,0|2,0,0]=4 3714 B16R2.88 O=C(Cc1ccncc1)N2CCOCC2 WXVL_AN00478SA00106 [0,1,0,1,0,0|2,0,0]=4 3715 B16R2.88 O=C(Cc1ccncc1)N2CCOCC2 WXVL_AN00478SA00106 [0,1,0,1,0,0|2,0,0]=4 3716 B16R2.88 O=C(Cc1ccncc1)N2CCSCC2 WXVL_AN0896SA00106 [0,1,0,1,0,0|2,0,0]=4 3717 B16R2.88 O=C(Nc1ccccc1)C2=CCCCO2 WXVL_AG00183SB4858 [0,1,0,1,0,0|1,0,1]=4 3718 B16R2.88 O=C(Nc1ccccc1)C2=CCCCO2 WXVL_AG00183SB4858 [0,1,0,1,0,0|1,0,1]=4 3719 B16R2.88 O=C(Nc1ccccc1)C2CCCCC2 WXVL_AG00183SB0047 [0,1,0,1,0,0|2,0,0]=4 3720 B16R2.88 O=C(Nc1ccccc1)C2CCCCC2 WXVL_AG00183SB0047 [0,1,0,1,0,0|2,0,0]=4 3721 B16R2.88 O=C(Nc1ccccc1)C2CCCCO2 WXVL_AG00183SB0206 [0,1,0,1,0,0|1,0,0]=3 3722 B16R2.88 O=C(Nc1ccccc1)C2CCCCO2 WXVL_AG00183SB0206 [0,1,0,1,0,0|1,0,0]=3 3723 B16R2.88 O=C(Nc1ccccc1)C2CCOCC2 WXVL_AG00183SB0149 [0,1,0,1,0,0|2,0,0]=4 3724 B16R2.88 O=C(Nc1ccccc1)C2CCOCC2 WXVL_AG00183SB0149 [0,1,0,1,0,0|2,0,0]=4 3725 B16R2.88 O=C(Nc1ccccc1)C2CCSCC2 WXVL_AG00183SB0752 [0,1,0,1,0,0|2,0,0]=4 3726 B16R2.88 O=C(Nc1ccccc1)C2CCSCC2 WXVL_AG00183SB0752 [0,1,0,1,0,0|2,0,0]=4 3727 B16R2.88 O=C(Nc1ccccc1)[C@H]2CCCCO2 WXVL_AG00183SB00044 [0,1,0,1,0,0|1,0,0]=3 3728 B16R2.88 O=C(Nc1ccccc1)[C@H]2CCCCO2 WXVL_AG00183SB00044 [0,1,0,1,0,0|1,0,0]=3 3729 B16R2.88 O=C(Nc1ccccn1)C2CCCCO2 WXVL_AF00298SB0206 [0,1,0,1,0,0|2,0,0]=4 3730 B16R2.88 O=C(Nc1ccccn1)C2CCCCO2 WXVL_AF00298SB0206 [0,1,0,1,0,0|2,0,0]=4 3731 B16R2.88 O=C(Nc1ccccn1)[C@H]2CCCCO2 WXVL_AF00298SB00044 [0,1,0,1,0,0|2,0,0]=4 3732 B16R2.88 O=C(Nc1ccccn1)[C@H]2CCCCO2 WXVL_AF00298SB00044 [0,1,0,1,0,0|2,0,0]=4 3733 B16R2.524 O=C(CC1CCCC1)Nc2ccccc2 WXVL_AG00183SB0044 [0,1,0,1,0,0|2,0,0]=4 3734 B16R2.524 O=C(CC1CCCC1)Nc2ccccc2 WXVL_AG00183SB0044 [0,1,0,1,0,0|2,0,0]=4 3735 B16R2.524 O=C(CN1CCCC1)Nc2ccccc2 WXVL_AG00183SB0201 [0,1,0,1,0,0|2,0,0]=4 3736 B16R2.524 O=C(CN1CCCC1)Nc2ccccc2 WXVL_AG00183SB0201 [0,1,0,1,0,0|2,0,0]=4 3737 B16R2.1983 O=C(Cc1ccccc1)N2CC[C@@H]2CO WXVL_AN00694SB0092 [0,1,0,1,0,0|1,0,0]=3 3738 B16R2.1983 O=C(Cc1ccccc1)N2CC[C@H]2CO WXVL_AN3414SB0092 [0,1,0,1,0,0|1,0,0]=3 3739 B16R2.1983 O=C(Cc1ccccc1)N2CC[C@H]2CO WXVL_AN3414SB0092 [0,1,0,1,0,0|1,0,0]=3 3740 B16R2.1983 O=C(Cc1ccccn1)N2CC[C@@H]2CO WXVL_AN00694SA0032 [0,1,0,1,0,0|2,0,0]=4 3741 B16R2.1983 O=C(Cc1ccccn1)N2CC[C@H]2CO WXVL_AN3414SA0032 [0,1,0,1,0,0|2,0,0]=4 3742 B16R2.1983 O=C(Cc1ccccn1)N2CC[C@H]2CO WXVL_AN3414SA0032 [0,1,0,1,0,0|2,0,0]=4 3743 B16R2.1983 O=C(Cc1cccnc1)N2CC[C@@H]2CO WXVL_AN00694SA0029 [0,1,0,1,0,0|2,0,0]=4 3744 B16R2.1983 O=C(Cc1cccnc1)N2CC[C@@H]2CO WXVL_AN00694SB00049 [0,1,0,1,0,0|2,0,0]=4 3745 B16R2.1983 O=C(Cc1cccnc1)N2CC[C@H]2CO WXVL_AN3414SA0029 [0,1,0,1,0,0|2,0,0]=4 3746 B16R2.1983 O=C(Cc1cccnc1)N2CC[C@H]2CO WXVL_AN3414SA0029 [0,1,0,1,0,0|2,0,0]=4 3747 B16R2.1983 O=C(Cc1cccnc1)N2CC[C@H]2CO WXVL_AN3414SB00049 [0,1,0,1,0,0|2,0,0]=4 3748 B16R2.1983 O=C(Cc1cccnc1)N2CC[C@H]2CO WXVL_AN3414SB00049 [0,1,0,1,0,0|2,0,0]=4 3749 B16R2.1983 O=C(Cc1ccncc1)N2CC[C@@H]2CO WXVL_AN00694SA00106 [0,1,0,1,0,0|2,0,0]=4 3750 B16R2.1983 O=C(Cc1ccncc1)N2CC[C@H]2CO WXVL_AN3414SA00106 [0,1,0,1,0,0|2,0,0]=4 3751 B16R2.1983 O=C(Cc1ccncc1)N2CC[C@H]2CO WXVL_AN3414SA00106 [0,1,0,1,0,0|2,0,0]=4 3752 B16R2.3005 CC1CCCC1C(=O)Nc2ccccc2 WXVL_AG00183SB0904 [0,1,0,1,0,0|2,0,0]=4 3753 B16R2.3005 CC1CCCC1C(=O)Nc2ccccc2 WXVL_AG00183SB0904 [0,1,0,1,0,0|2,0,0]=4 3754 B16R2.3005 CN1CCC[C@H]1C(=O)Nc2ccccc2 WXVL_AG00183SB1197 [0,1,0,1,0,0|2,0,0]=4 3755 B16R2.3005 CN1CCC[C@H]1C(=O)Nc2ccccc2 WXVL_AG00183SB1197 [0,1,0,1,0,0|2,0,0]=4 3756 B16R2.3005 C[C@@H]1CCCN1C(=O)Cc2ccccc2 WXVL_AN00593SB0092 [0,1,0,1,0,0|1,0,0]=3 3757 B16R2.3005 C[C@@H]1CCCN1C(=O)Cc2ccccn2 WXVL_AN00593SA0032 [0,1,0,1,0,0|2,0,0]=4 3758 B16R2.3005 C[C@@H]1CCCN1C(=O)Cc2cccnc2 WXVL_AN00593SA0029 [0,1,0,1,0,0|2,0,0]=4 3759 B16R2.3005 C[C@@H]1CCCN1C(=O)Cc2cccnc2 WXVL_AN00593SB00049 [0,1,0,1,0,0|2,0,0]=4 3760 B16R2.3005 C[C@@H]1CCCN1C(=O)Cc2ccncc2 WXVL_AN00593SA00106 [0,1,0,1,0,0|2,0,0]=4 3761 B16R2.10947 O=C(Cc1ccccc1)NCCC2CC2 WXVL_AK00594SB0092 [0,1,0,1,0,0|1,0,0]=3 3762 B16R2.10947 O=C(Cc1ccccc1)NCCC2CC2 WXVL_AK00594SB0092 [0,1,0,1,0,0|1,0,0]=3 3763 B16R2.10947 O=C(Cc1ccccn1)NCCC2CC2 WXVL_AK00594SA0032 [0,1,0,1,0,0|2,0,0]=4 3764 B16R2.10947 O=C(Cc1ccccn1)NCCC2CC2 WXVL_AK00594SA0032 [0,1,0,1,0,0|2,0,0]=4 3765 B16R2.10947 O=C(Cc1cccnc1)NCCC2CC2 WXVL_AK00594SA0029 [0,1,0,1,0,0|2,0,0]=4 3766 B16R2.10947 O=C(Cc1cccnc1)NCCC2CC2 WXVL_AK00594SA0029 [0,1,0,1,0,0|2,0,0]=4 3767 B16R2.10947 O=C(Cc1cccnc1)NCCC2CC2 WXVL_AK00594SB00049 [0,1,0,1,0,0|2,0,0]=4 3768 B16R2.10947 O=C(Cc1cccnc1)NCCC2CC2 WXVL_AK00594SB00049 [0,1,0,1,0,0|2,0,0]=4 3769 B16R2.10947 O=C(Cc1ccncc1)NCCC2CC2 WXVL_AK00594SA00106 [0,1,0,1,0,0|2,0,0]=4 3770 B16R2.10947 O=C(Cc1ccncc1)NCCC2CC2 WXVL_AK00594SA00106 [0,1,0,1,0,0|2,0,0]=4 3771 B16R2.10948 O=C(CCC1CCC1)Nc2ccccc2 WXVL_AG00183SB8784 [0,1,0,1,0,0|2,0,0]=4 3772 B16R2.10948 O=C(CCC1CCC1)Nc2ccccc2 WXVL_AG00183SB8784 [0,1,0,1,0,0|2,0,0]=4 3773 B16R2.10948 O=C(Cc1ccccc1)NCC2CCC2 WXVL_AK00492SB0092 [0,1,0,1,0,0|1,0,0]=3 3774 B16R2.10948 O=C(Cc1ccccc1)NCC2CCC2 WXVL_AK00492SB0092 [0,1,0,1,0,0|1,0,0]=3 3775 B16R2.10948 O=C(Cc1ccccc1)NCC2CCO2 WXVL_AK1433SB0092 [0,1,0,1,0,0|1,0,0]=3 3776 B16R2.10948 O=C(Cc1ccccc1)NCC2CCO2 WXVL_AK1433SB0092 [0,1,0,1,0,0|1,0,0]=3 3777 B16R2.10948 O=C(Cc1ccccc1)NCC2COC2 WXVL_AK0186SB0092 [0,1,0,1,0,0|1,0,0]=3 3778 B16R2.10948 O=C(Cc1ccccc1)NCC2COC2 WXVL_AK0186SB0092 [0,1,0,1,0,0|1,0,0]=3 3779 B16R2.10948 O=C(Cc1ccccn1)NCC2CCC2 WXVL_AK00492SA0032 [0,1,0,1,0,0|2,0,0]=4 3780 B16R2.10948 O=C(Cc1ccccn1)NCC2CCC2 WXVL_AK00492SA0032 [0,1,0,1,0,0|2,0,0]=4 3781 B16R2.10948 O=C(Cc1ccccn1)NCC2CCO2 WXVL_AK1433SA0032 [0,1,0,1,0,0|2,0,0]=4 3782 B16R2.10948 O=C(Cc1ccccn1)NCC2CCO2 WXVL_AK1433SA0032 [0,1,0,1,0,0|2,0,0]=4 3783 B16R2.10948 O=C(Cc1ccccn1)NCC2COC2 WXVL_AK0186SA0032 [0,1,0,1,0,0|2,0,0]=4 3784 B16R2.10948 O=C(Cc1ccccn1)NCC2COC2 WXVL_AK0186SA0032 [0,1,0,1,0,0|2,0,0]=4 3785 B16R2.10948 O=C(Cc1cccnc1)NCC2CCC2 WXVL_AK00492SA0029 [0,1,0,1,0,0|2,0,0]=4 3786 B16R2.10948 O=C(Cc1cccnc1)NCC2CCC2 WXVL_AK00492SA0029 [0,1,0,1,0,0|2,0,0]=4 3787 B16R2.10948 O=C(Cc1cccnc1)NCC2CCC2 WXVL_AK00492SB00049 [0,1,0,1,0,0|2,0,0]=4 3788 B16R2.10948 O=C(Cc1cccnc1)NCC2CCC2 WXVL_AK00492SB00049 [0,1,0,1,0,0|2,0,0]=4 3789 B16R2.10948 O=C(Cc1cccnc1)NCC2CCO2 WXVL_AK1433SA0029 [0,1,0,1,0,0|2,0,0]=4 3790 B16R2.10948 O=C(Cc1cccnc1)NCC2CCO2 WXVL_AK1433SA0029 [0,1,0,1,0,0|2,0,0]=4 3791 B16R2.10948 O=C(Cc1cccnc1)NCC2CCO2 WXVL_AK1433SB00049 [0,1,0,1,0,0|2,0,0]=4 3792 B16R2.10948 O=C(Cc1cccnc1)NCC2CCO2 WXVL_AK1433SB00049 [0,1,0,1,0,0|2,0,0]=4 3793 B16R2.10948 O=C(Cc1cccnc1)NCC2COC2 WXVL_AK0186SA0029 [0,1,0,1,0,0|2,0,0]=4 3794 B16R2.10948 O=C(Cc1cccnc1)NCC2COC2 WXVL_AK0186SA0029 [0,1,0,1,0,0|2,0,0]=4 3795 B16R2.10948 O=C(Cc1cccnc1)NCC2COC2 WXVL_AK0186SB00049 [0,1,0,1,0,0|2,0,0]=4 3796 B16R2.10948 O=C(Cc1cccnc1)NCC2COC2 WXVL_AK0186SB00049 [0,1,0,1,0,0|2,0,0]=4 3797 B16R2.10948 O=C(Cc1ccncc1)NCC2CCC2 WXVL_AK00492SA00106 [0,1,0,1,0,0|2,0,0]=4 3798 B16R2.10948 O=C(Cc1ccncc1)NCC2CCC2 WXVL_AK00492SA00106 [0,1,0,1,0,0|2,0,0]=4 3799 B16R2.10948 O=C(Cc1ccncc1)NCC2CCO2 WXVL_AK1433SA00106 [0,1,0,1,0,0|2,0,0]=4 3800 B16R2.10948 O=C(Cc1ccncc1)NCC2CCO2 WXVL_AK1433SA00106 [0,1,0,1,0,0|2,0,0]=4 3801 B16R2.10948 O=C(Cc1ccncc1)NCC2COC2 WXVL_AK0186SA00106 [0,1,0,1,0,0|2,0,0]=4 3802 B16R2.10948 O=C(Cc1ccncc1)NCC2COC2 WXVL_AK0186SA00106 [0,1,0,1,0,0|2,0,0]=4 3803 B16R2.6780 CC(C(=O)N1CCCC1)c2ccccc2 WXVL_AN0008SB2326 [0,1,0,1,0,0|1,0,0]=3 3804 B16R2.6780 CC(C(=O)N1CCCC1)c2ccccc2 WXVL_AN0008SB2326 [0,1,0,1,0,0|1,0,0]=3 3805 B16R2.6780 O=C(C(=O)N1CCCC1)c2ccccc2 WXVL_AN0008SB0050 [0,1,0,1,0,0|1,0,1]=4 3806 B16R2.6780 O=C(C(=O)N1CCCC1)c2ccccc2 WXVL_AN0008SB0050 [0,1,0,1,0,0|1,0,1]=4 3807 B16R2.6780 O=C(C(O)c1ccccc1)N2CCCC2 WXVL_AN0008SB0168 [0,1,0,1,0,0|1,0,0]=3 3808 B16R2.6780 O=C(C(O)c1ccccc1)N2CCCC2 WXVL_AN0008SB0168 [0,1,0,1,0,0|1,0,0]=3 3809 B16R2.27760 CC(C(=O)NC1CNC1)c2ccccc2 WXVL_AK1291SB2326 [0,1,0,1,0,0|2,0,0]=4 3810 B16R2.27760 CC(C(=O)NC1CNC1)c2ccccc2 WXVL_AK1291SB2326 [0,1,0,1,0,0|2,0,0]=4 3811 B16R2.27760 CC(C(=O)NC1CSC1)c2ccccc2 WXVL_AK2089SB2326 [0,1,0,1,0,0|2,0,0]=4 3812 B16R2.27760 CC(C(=O)NC1CSC1)c2ccccc2 WXVL_AK2089SB2326 [0,1,0,1,0,0|2,0,0]=4 3813 B16R2.27760 O=C(NC1CNC1)C(O)c2ccccc2 WXVL_AK1291SB0168 [0,1,0,1,0,0|2,0,0]=4 3814 B16R2.27760 O=C(NC1CNC1)C(O)c2ccccc2 WXVL_AK1291SB0168 [0,1,0,1,0,0|2,0,0]=4 3815 B16R2.27760 O=C(NC1CSC1)C(O)c2ccccc2 WXVL_AK2089SB0168 [0,1,0,1,0,0|2,0,0]=4 3816 B16R2.27760 O=C(NC1CSC1)C(O)c2ccccc2 WXVL_AK2089SB0168 [0,1,0,1,0,0|2,0,0]=4 3817 B16R2.133 Cc1ccc(cc1)CC(=O)N2CCCC2 WXVL_AN0008SB0112 [0,1,0,1,0,0|1,0,0]=3 3818 B16R2.133 Cc1ccc(cc1)CC(=O)N2CCCC2 WXVL_AN0008SB0112 [0,1,0,1,0,0|1,0,0]=3 3819 B16R2.133 Cc1ccc(cc1)NC(=O)N2CCCC2 WXVL_AN0008YV0026 [0,1,0,1,0,0|2,0,0]=4 3820 B16R2.133 Cc1ccc(cc1)NC(=O)N2CCCC2 WXVL_AN0008YV0026 [0,1,0,1,0,0|2,0,0]=4 3821 B16R2.133 Cc1ccc(cn1)CC(=O)N2CCCC2 WXVL_AN0008SA0250 [0,1,0,1,0,0|2,0,0]=4 3822 B16R2.133 Cc1ccc(cn1)CC(=O)N2CCCC2 WXVL_AN0008SA0250 [0,1,0,1,0,0|2,0,0]=4 3823 B16R2.133 O=C(Cc1ccc(cc1)Br)N2CCCC2 WXVL_AN0008SB0926 [0,1,0,1,0,0|1,0,0]=3 3824 B16R2.133 O=C(Cc1ccc(cc1)Br)N2CCCC2 WXVL_AN0008SB0926 [0,1,0,1,0,0|1,0,0]=3 3825 B16R2.133 O=C(Cc1ccc(cc1)Cl)N2CCCC2 WXVL_AN0008SB0107 [0,1,0,1,0,0|1,0,0]=3 3826 B16R2.133 O=C(Cc1ccc(cc1)Cl)N2CCCC2 WXVL_AN0008SB0107 [0,1,0,1,0,0|1,0,0]=3 3827 B16R2.133 O=C(Cc1ccc(cc1)F)N2CCCC2 WXVL_AN0008SB0106 [0,1,0,1,0,0|1,0,0]=3 3828 B16R2.133 O=C(Cc1ccc(cc1)F)N2CCCC2 WXVL_AN0008SB0106 [0,1,0,1,0,0|1,0,0]=3 3829 B16R2.133 O=C(Cc1ccc(cc1)O)N2CCCC2 WXVL_AN0008SB0110 [0,1,0,1,0,0|1,0,0]=3 3830 B16R2.133 O=C(Cc1ccc(cc1)O)N2CCCC2 WXVL_AN0008SB0110 [0,1,0,1,0,0|1,0,0]=3 3831 B16R2.133 O=C(Cc1ccc(cn1)Br)N2CCCC2 WXVL_AN0008SA0212 [0,1,0,1,0,0|2,0,0]=4 3832 B16R2.133 O=C(Cc1ccc(cn1)Br)N2CCCC2 WXVL_AN0008SA0212 [0,1,0,1,0,0|2,0,0]=4 3833 B16R2.133 O=C(Cc1ccc(cn1)Cl)N2CCCC2 WXVL_AN0008SA0537 [0,1,0,1,0,0|2,0,0]=4 3834 B16R2.133 O=C(Cc1ccc(cn1)Cl)N2CCCC2 WXVL_AN0008SA0537 [0,1,0,1,0,0|2,0,0]=4 3835 B16R2.133 O=C(Cc1ccc(cn1)F)N2CCCC2 WXVL_AN0008SA0011 [0,1,0,1,0,0|2,0,0]=4 3836 B16R2.133 O=C(Cc1ccc(cn1)F)N2CCCC2 WXVL_AN0008SA0011 [0,1,0,1,0,0|2,0,0]=4 3837 B16R2.133 O=C(Cc1ccc(cn1)O)N2CCCC2 WXVL_AN0008SA2976 [0,1,0,1,0,0|2,0,0]=4 3838 B16R2.133 O=C(Cc1ccc(cn1)O)N2CCCC2 WXVL_AN0008SA2976 [0,1,0,1,0,0|2,0,0]=4 3839 B16R2.133 O=C(Cc1ccc(nc1)Br)N2CCCC2 WXVL_AN0008SA00056 [0,1,0,1,0,0|2,0,0]=4 3840 B16R2.133 O=C(Cc1ccc(nc1)Br)N2CCCC2 WXVL_AN0008SA00056 [0,1,0,1,0,0|2,0,0]=4 3841 B16R2.133 O=C(Nc1ccc(cc1)Cl)C2CCCC2 WXVL_AG0062SB0043 [0,1,0,1,0,0|2,0,0]=4 3842 B16R2.133 O=C(Nc1ccc(cc1)Cl)C2CCCC2 WXVL_AG0062SB0043 [0,1,0,1,0,0|2,0,0]=4 3843 B16R2.133 O=C(Nc1ccc(cc1)Cl)N2CCCC2 WXVL_AN0008YV0023 [0,1,0,1,0,0|2,0,0]=4 3844 B16R2.133 O=C(Nc1ccc(cc1)Cl)N2CCCC2 WXVL_AN0008YV0023 [0,1,0,1,0,0|2,0,0]=4 3845 B16R2.133 O=C(Nc1ccc(cc1)I)C2CCCC2 WXVL_AG1742SB0043 [0,1,0,1,0,0|2,0,0]=4 3846 B16R2.133 O=C(Nc1ccc(cc1)I)C2CCCC2 WXVL_AG1742SB0043 [0,1,0,1,0,0|2,0,0]=4 3847 B16R2.33345 O=C(CCC1CC1)Nc2ccc(cc2)Cl WXVL_AG0062SB5360 [0,1,0,1,0,0|2,0,0]=4 3848 B16R2.33345 O=C(CCC1CC1)Nc2ccc(cc2)Cl WXVL_AG0062SB5360 [0,1,0,1,0,0|2,0,0]=4 3849 B16R2.33345 O=C(CCC1CC1)Nc2ccc(cc2)I WXVL_AG1742SB5360 [0,1,0,1,0,0|2,0,0]=4 3850 B16R2.33345 O=C(CCC1CC1)Nc2ccc(cc2)I WXVL_AG1742SB5360 [0,1,0,1,0,0|2,0,0]=4 3851 B16R2.33353 Cc1ccc(cc1)CC(=O)NC2CNC2 WXVL_AK1291SB0112 [0,1,0,1,0,0|2,0,0]=4 3852 B16R2.33353 Cc1ccc(cc1)CC(=O)NC2CNC2 WXVL_AK1291SB0112 [0,1,0,1,0,0|2,0,0]=4 3853 B16R2.33353 Cc1ccc(cc1)CC(=O)NC2CSC2 WXVL_AK2089SB0112 [0,1,0,1,0,0|2,0,0]=4 3854 B16R2.33353 Cc1ccc(cc1)CC(=O)NC2CSC2 WXVL_AK2089SB0112 [0,1,0,1,0,0|2,0,0]=4 3855 B16R2.33353 O=C(CC1CCC1)Nc2ccc(cc2)Cl WXVL_AG0062SB2207 [0,1,0,1,0,0|2,0,0]=4 3856 B16R2.33353 O=C(CC1CCC1)Nc2ccc(cc2)Cl WXVL_AG0062SB2207 [0,1,0,1,0,0|2,0,0]=4 3857 B16R2.33353 O=C(CC1CCC1)Nc2ccc(cc2)I WXVL_AG1742SB2207 [0,1,0,1,0,0|2,0,0]=4 3858 B16R2.33353 O=C(CC1CCC1)Nc2ccc(cc2)I WXVL_AG1742SB2207 [0,1,0,1,0,0|2,0,0]=4 3859 B16R2.33353 O=C(Cc1ccc(cc1)Br)NC2CNC2 WXVL_AK1291SB0926 [0,1,0,1,0,0|2,0,0]=4 3860 B16R2.33353 O=C(Cc1ccc(cc1)Br)NC2CNC2 WXVL_AK1291SB0926 [0,1,0,1,0,0|2,0,0]=4 3861 B16R2.33353 O=C(Cc1ccc(cc1)Br)NC2CSC2 WXVL_AK2089SB0926 [0,1,0,1,0,0|2,0,0]=4 3862 B16R2.33353 O=C(Cc1ccc(cc1)Br)NC2CSC2 WXVL_AK2089SB0926 [0,1,0,1,0,0|2,0,0]=4 3863 B16R2.33353 O=C(Cc1ccc(cc1)Cl)NC2CNC2 WXVL_AK1291SB0107 [0,1,0,1,0,0|2,0,0]=4 3864 B16R2.33353 O=C(Cc1ccc(cc1)Cl)NC2CNC2 WXVL_AK1291SB0107 [0,1,0,1,0,0|2,0,0]=4 3865 B16R2.33353 O=C(Cc1ccc(cc1)Cl)NC2CSC2 WXVL_AK2089SB0107 [0,1,0,1,0,0|2,0,0]=4 3866 B16R2.33353 O=C(Cc1ccc(cc1)Cl)NC2CSC2 WXVL_AK2089SB0107 [0,1,0,1,0,0|2,0,0]=4 3867 B16R2.33353 O=C(Cc1ccc(cc1)F)NC2CNC2 WXVL_AK1291SB0106 [0,1,0,1,0,0|2,0,0]=4 3868 B16R2.33353 O=C(Cc1ccc(cc1)F)NC2CNC2 WXVL_AK1291SB0106 [0,1,0,1,0,0|2,0,0]=4 3869 B16R2.33353 O=C(Cc1ccc(cc1)F)NC2CSC2 WXVL_AK2089SB0106 [0,1,0,1,0,0|2,0,0]=4 3870 B16R2.33353 O=C(Cc1ccc(cc1)F)NC2CSC2 WXVL_AK2089SB0106 [0,1,0,1,0,0|2,0,0]=4 3871 B16R2.33353 O=C(Cc1ccc(cc1)O)NC2CNC2 WXVL_AK1291SB0110 [0,1,0,1,0,0|2,0,0]=4 3872 B16R2.33353 O=C(Cc1ccc(cc1)O)NC2CNC2 WXVL_AK1291SB0110 [0,1,0,1,0,0|2,0,0]=4 3873 B16R2.33353 O=C(Cc1ccc(cc1)O)NC2CSC2 WXVL_AK2089SB0110 [0,1,0,1,0,0|2,0,0]=4 3874 B16R2.33353 O=C(Cc1ccc(cc1)O)NC2CSC2 WXVL_AK2089SB0110 [0,1,0,1,0,0|2,0,0]=4 3875 B16R2.253 Cc1cccc(c1)CC(=O)N2CCCC2 WXVL_AN0008SB0105 [0,1,0,1,0,0|1,0,0]=3 3876 B16R2.253 Cc1cccc(c1)CC(=O)N2CCCC2 WXVL_AN0008SB0105 [0,1,0,1,0,0|1,0,0]=3 3877 B16R2.253 Cc1cccc(c1)NC(=O)C2CCCC2 WXVL_AG0052SB0043 [0,1,0,1,0,0|2,0,0]=4 3878 B16R2.253 Cc1cccc(c1)NC(=O)C2CCCC2 WXVL_AG0052SB0043 [0,1,0,1,0,0|2,0,0]=4 3879 B16R2.253 Cc1cccc(c1)NC(=O)N2CCCC2 WXVL_AN0008YV0020 [0,1,0,1,0,0|2,0,0]=4 3880 B16R2.253 Cc1cccc(c1)NC(=O)N2CCCC2 WXVL_AN0008YV0020 [0,1,0,1,0,0|2,0,0]=4 3881 B16R2.253 Cc1cccc(n1)CC(=O)N2CCCC2 WXVL_AN0008SA0399 [0,1,0,1,0,0|2,0,0]=4 3882 B16R2.253 Cc1cccc(n1)CC(=O)N2CCCC2 WXVL_AN0008SA0399 [0,1,0,1,0,0|2,0,0]=4 3883 B16R2.253 O=C(Cc1cccc(c1)Br)N2CCCC2 WXVL_AN0008SB0099 [0,1,0,1,0,0|1,0,0]=3 3884 B16R2.253 O=C(Cc1cccc(c1)Br)N2CCCC2 WXVL_AN0008SB0099 [0,1,0,1,0,0|1,0,0]=3 3885 B16R2.253 O=C(Cc1cccc(c1)Cl)N2CCCC2 WXVL_AN0008SB0101 [0,1,0,1,0,0|1,0,0]=3 3886 B16R2.253 O=C(Cc1cccc(c1)Cl)N2CCCC2 WXVL_AN0008SB0101 [0,1,0,1,0,0|1,0,0]=3 3887 B16R2.253 O=C(Cc1cccc(c1)F)N2CCCC2 WXVL_AN0008SB0100 [0,1,0,1,0,0|1,0,0]=3 3888 B16R2.253 O=C(Cc1cccc(c1)F)N2CCCC2 WXVL_AN0008SB0100 [0,1,0,1,0,0|1,0,0]=3 3889 B16R2.253 O=C(Cc1cccc(c1)O)N2CCCC2 WXVL_AN0008SB0104 [0,1,0,1,0,0|1,0,0]=3 3890 B16R2.253 O=C(Cc1cccc(c1)O)N2CCCC2 WXVL_AN0008SB0104 [0,1,0,1,0,0|1,0,0]=3 3891 B16R2.253 O=C(Cc1cccc(n1)Cl)N2CCCC2 WXVL_AN0008SA0313 [0,1,0,1,0,0|2,0,0]=4 3892 B16R2.253 O=C(Cc1cccc(n1)Cl)N2CCCC2 WXVL_AN0008SA0313 [0,1,0,1,0,0|2,0,0]=4 3893 B16R2.253 O=C(Cc1ccnc(c1)Br)N2CCCC2 WXVL_AN0008SA0520 [0,1,0,1,0,0|2,0,0]=4 3894 B16R2.253 O=C(Cc1ccnc(c1)Br)N2CCCC2 WXVL_AN0008SA0520 [0,1,0,1,0,0|2,0,0]=4 3895 B16R2.253 O=C(Nc1cccc(c1)Br)N2CCCC2 WXVL_AN0008YV0098 [0,1,0,1,0,0|2,0,0]=4 3896 B16R2.253 O=C(Nc1cccc(c1)Br)N2CCCC2 WXVL_AN0008YV0098 [0,1,0,1,0,0|2,0,0]=4 3897 B16R2.253 O=C(Nc1cccc(c1)Cl)N2CCCC2 WXVL_AN0008YV0016 [0,1,0,1,0,0|2,0,0]=4 3898 B16R2.253 O=C(Nc1cccc(c1)Cl)N2CCCC2 WXVL_AN0008YV0016 [0,1,0,1,0,0|2,0,0]=4 3899 B16R2.253 O=C(Nc1cccc(c1)I)C2CCCC2 WXVL_AG0649SB0043 [0,1,0,1,0,0|2,0,0]=4 3900 B16R2.253 O=C(Nc1cccc(c1)I)C2CCCC2 WXVL_AG0649SB0043 [0,1,0,1,0,0|2,0,0]=4 3901 B16R2.253 O=C(Nc1cccc(c1)O)C2CCCC2 WXVL_AG00200SB0043 [0,1,0,1,0,0|2,0,0]=4 3902 B16R2.253 O=C(Nc1cccc(c1)O)C2CCCC2 WXVL_AG00200SB0043 [0,1,0,1,0,0|2,0,0]=4 3903 B16R2.80725 Cc1cccc(c1)CC(=O)NC2CNC2 WXVL_AK1291SB0105 [0,1,0,1,0,0|2,0,0]=4 3904 B16R2.80725 Cc1cccc(c1)CC(=O)NC2CNC2 WXVL_AK1291SB0105 [0,1,0,1,0,0|2,0,0]=4 3905 B16R2.80725 Cc1cccc(c1)CC(=O)NC2CSC2 WXVL_AK2089SB0105 [0,1,0,1,0,0|2,0,0]=4 3906 B16R2.80725 Cc1cccc(c1)CC(=O)NC2CSC2 WXVL_AK2089SB0105 [0,1,0,1,0,0|2,0,0]=4 3907 B16R2.80725 Cc1cccc(c1)NC(=O)CC2CCC2 WXVL_AG0052SB2207 [0,1,0,1,0,0|2,0,0]=4 3908 B16R2.80725 Cc1cccc(c1)NC(=O)CC2CCC2 WXVL_AG0052SB2207 [0,1,0,1,0,0|2,0,0]=4 3909 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)I WXVL_AG0649SB2207 [0,1,0,1,0,0|2,0,0]=4 3910 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)I WXVL_AG0649SB2207 [0,1,0,1,0,0|2,0,0]=4 3911 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)O WXVL_AG00200SB2207 [0,1,0,1,0,0|2,0,0]=4 3912 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)O WXVL_AG00200SB2207 [0,1,0,1,0,0|2,0,0]=4 3913 B16R2.80725 O=C(Cc1cccc(c1)Br)NC2CNC2 WXVL_AK1291SB0099 [0,1,0,1,0,0|2,0,0]=4 3914 B16R2.80725 O=C(Cc1cccc(c1)Br)NC2CNC2 WXVL_AK1291SB0099 [0,1,0,1,0,0|2,0,0]=4 3915 B16R2.80725 O=C(Cc1cccc(c1)Br)NC2CSC2 WXVL_AK2089SB0099 [0,1,0,1,0,0|2,0,0]=4 3916 B16R2.80725 O=C(Cc1cccc(c1)Br)NC2CSC2 WXVL_AK2089SB0099 [0,1,0,1,0,0|2,0,0]=4 3917 B16R2.80725 O=C(Cc1cccc(c1)Cl)NC2CNC2 WXVL_AK1291SB0101 [0,1,0,1,0,0|2,0,0]=4 3918 B16R2.80725 O=C(Cc1cccc(c1)Cl)NC2CNC2 WXVL_AK1291SB0101 [0,1,0,1,0,0|2,0,0]=4 3919 B16R2.80725 O=C(Cc1cccc(c1)Cl)NC2CSC2 WXVL_AK2089SB0101 [0,1,0,1,0,0|2,0,0]=4 3920 B16R2.80725 O=C(Cc1cccc(c1)Cl)NC2CSC2 WXVL_AK2089SB0101 [0,1,0,1,0,0|2,0,0]=4 3921 B16R2.80725 O=C(Cc1cccc(c1)F)NC2CNC2 WXVL_AK1291SB0100 [0,1,0,1,0,0|2,0,0]=4 3922 B16R2.80725 O=C(Cc1cccc(c1)F)NC2CNC2 WXVL_AK1291SB0100 [0,1,0,1,0,0|2,0,0]=4 3923 B16R2.80725 O=C(Cc1cccc(c1)F)NC2CSC2 WXVL_AK2089SB0100 [0,1,0,1,0,0|2,0,0]=4 3924 B16R2.80725 O=C(Cc1cccc(c1)F)NC2CSC2 WXVL_AK2089SB0100 [0,1,0,1,0,0|2,0,0]=4 3925 B16R2.80725 O=C(Cc1cccc(c1)O)NC2CNC2 WXVL_AK1291SB0104 [0,1,0,1,0,0|2,0,0]=4 3926 B16R2.80725 O=C(Cc1cccc(c1)O)NC2CNC2 WXVL_AK1291SB0104 [0,1,0,1,0,0|2,0,0]=4 3927 B16R2.80725 O=C(Cc1cccc(c1)O)NC2CSC2 WXVL_AK2089SB0104 [0,1,0,1,0,0|2,0,0]=4 3928 B16R2.80725 O=C(Cc1cccc(c1)O)NC2CSC2 WXVL_AK2089SB0104 [0,1,0,1,0,0|2,0,0]=4 3929 B16R2.136607 Cc1cccc(c1)NC(=O)CCC2CC2 WXVL_AG0052SB5360 [0,1,0,1,0,0|2,0,0]=4 3930 B16R2.136607 Cc1cccc(c1)NC(=O)CCC2CC2 WXVL_AG0052SB5360 [0,1,0,1,0,0|2,0,0]=4 3931 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)I WXVL_AG0649SB5360 [0,1,0,1,0,0|2,0,0]=4 3932 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)I WXVL_AG0649SB5360 [0,1,0,1,0,0|2,0,0]=4 3933 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)O WXVL_AG00200SB5360 [0,1,0,1,0,0|2,0,0]=4 3934 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)O WXVL_AG00200SB5360 [0,1,0,1,0,0|2,0,0]=4 3935 B16R2.2843 CC1CCN(C1)C(=O)Cc2ccccc2 WXVL_AN0556SB0092 [0,1,0,1,0,0|1,0,0]=3 3936 B16R2.2843 CC1CCN(C1)C(=O)Cc2ccccc2 WXVL_AN0556SB0092 [0,1,0,1,0,0|1,0,0]=3 3937 B16R2.2843 CC1CCN(C1)C(=O)Cc2ccccn2 WXVL_AN0556SA0032 [0,1,0,1,0,0|2,0,0]=4 3938 B16R2.2843 CC1CCN(C1)C(=O)Cc2ccccn2 WXVL_AN0556SA0032 [0,1,0,1,0,0|2,0,0]=4 3939 B16R2.2843 CC1CCN(C1)C(=O)Cc2cccnc2 WXVL_AN0556SA0029 [0,1,0,1,0,0|2,0,0]=4 3940 B16R2.2843 CC1CCN(C1)C(=O)Cc2cccnc2 WXVL_AN0556SA0029 [0,1,0,1,0,0|2,0,0]=4 3941 B16R2.2843 CC1CCN(C1)C(=O)Cc2cccnc2 WXVL_AN0556SB00049 [0,1,0,1,0,0|2,0,0]=4 3942 B16R2.2843 CC1CCN(C1)C(=O)Cc2cccnc2 WXVL_AN0556SB00049 [0,1,0,1,0,0|2,0,0]=4 3943 B16R2.2843 CC1CCN(C1)C(=O)Cc2ccncc2 WXVL_AN0556SA00106 [0,1,0,1,0,0|2,0,0]=4 3944 B16R2.2843 CC1CCN(C1)C(=O)Cc2ccncc2 WXVL_AN0556SA00106 [0,1,0,1,0,0|2,0,0]=4 3945 B16R2.2843 C[C@@H]1CCN(C1)C(=O)Cc2ccccc2 WXVL_AN00488SB0092 [0,1,0,1,0,0|1,0,0]=3 3946 B16R2.2843 C[C@@H]1CCN(C1)C(=O)Cc2ccccc2 WXVL_AN00488SB0092 [0,1,0,1,0,0|1,0,0]=3 3947 B16R2.2843 C[C@@H]1CCN(C1)C(=O)Cc2ccccn2 WXVL_AN00488SA0032 [0,1,0,1,0,0|2,0,0]=4 3948 B16R2.2843 C[C@@H]1CCN(C1)C(=O)Cc2ccccn2 WXVL_AN00488SA0032 [0,1,0,1,0,0|2,0,0]=4 3949 B16R2.2843 C[C@@H]1CCN(C1)C(=O)Cc2cccnc2 WXVL_AN00488SA0029 [0,1,0,1,0,0|2,0,0]=4 3950 B16R2.2843 C[C@@H]1CCN(C1)C(=O)Cc2cccnc2 WXVL_AN00488SA0029 [0,1,0,1,0,0|2,0,0]=4 3951 B16R2.2843 C[C@@H]1CCN(C1)C(=O)Cc2cccnc2 WXVL_AN00488SB00049 [0,1,0,1,0,0|2,0,0]=4 3952 B16R2.2843 C[C@@H]1CCN(C1)C(=O)Cc2cccnc2 WXVL_AN00488SB00049 [0,1,0,1,0,0|2,0,0]=4 3953 B16R2.2843 C[C@@H]1CCN(C1)C(=O)Cc2ccncc2 WXVL_AN00488SA00106 [0,1,0,1,0,0|2,0,0]=4 3954 B16R2.2843 C[C@@H]1CCN(C1)C(=O)Cc2ccncc2 WXVL_AN00488SA00106 [0,1,0,1,0,0|2,0,0]=4 3955 B16R2.2843 C[C@@H]1CC[C@@H](O1)C(=O)Nc2ccccc2 WXVL_AG00183SB0853 [0,1,0,1,0,0|2,0,0]=4 3956 B16R2.2843 C[C@@H]1CC[C@@H](O1)C(=O)Nc2ccccc2 WXVL_AG00183SB0853 [0,1,0,1,0,0|2,0,0]=4 3957 B16R2.2843 C[C@H]1CCN(C1)C(=O)Cc2ccccc2 WXVL_AN00094SB0092 [0,1,0,1,0,0|1,0,0]=3 3958 B16R2.2843 C[C@H]1CCN(C1)C(=O)Cc2ccccc2 WXVL_AN00094SB0092 [0,1,0,1,0,0|1,0,0]=3 3959 B16R2.2843 C[C@H]1CCN(C1)C(=O)Cc2ccccn2 WXVL_AN00094SA0032 [0,1,0,1,0,0|2,0,0]=4 3960 B16R2.2843 C[C@H]1CCN(C1)C(=O)Cc2ccccn2 WXVL_AN00094SA0032 [0,1,0,1,0,0|2,0,0]=4 3961 B16R2.2843 C[C@H]1CCN(C1)C(=O)Cc2cccnc2 WXVL_AN00094SA0029 [0,1,0,1,0,0|2,0,0]=4 3962 B16R2.2843 C[C@H]1CCN(C1)C(=O)Cc2cccnc2 WXVL_AN00094SA0029 [0,1,0,1,0,0|2,0,0]=4 3963 B16R2.2843 C[C@H]1CCN(C1)C(=O)Cc2cccnc2 WXVL_AN00094SB00049 [0,1,0,1,0,0|2,0,0]=4 3964 B16R2.2843 C[C@H]1CCN(C1)C(=O)Cc2cccnc2 WXVL_AN00094SB00049 [0,1,0,1,0,0|2,0,0]=4 3965 B16R2.2843 C[C@H]1CCN(C1)C(=O)Cc2ccncc2 WXVL_AN00094SA00106 [0,1,0,1,0,0|2,0,0]=4 3966 B16R2.2843 C[C@H]1CCN(C1)C(=O)Cc2ccncc2 WXVL_AN00094SA00106 [0,1,0,1,0,0|2,0,0]=4 3967 B16R2.2843 O=C(Cc1ccccc1)N2CCC(C2)Br WXVL_AN00715SB0092 [0,1,0,1,0,0|1,0,0]=3 3968 B16R2.2843 O=C(Cc1ccccc1)N2CCC(C2)F WXVL_AN00338SB0092 [0,1,0,1,0,0|1,0,0]=3 3969 B16R2.2843 O=C(Cc1ccccc1)N2CCC(C2)F WXVL_AN00338SB0092 [0,1,0,1,0,0|1,0,0]=3 3970 B16R2.2843 O=C(Cc1ccccc1)N2CCC(C2)O WXVL_AN0158SB0092 [0,1,0,1,0,0|1,0,0]=3 3971 B16R2.2843 O=C(Cc1ccccc1)N2CCC(C2)O WXVL_AN0158SB0092 [0,1,0,1,0,0|1,0,0]=3 3972 B16R2.2843 O=C(Cc1ccccc1)N2CC[C@@H](C2)O WXVL_AN00391SB0092 [0,1,0,1,0,0|1,0,0]=3 3973 B16R2.2843 O=C(Cc1ccccc1)N2CC[C@@H](C2)O WXVL_AN00391SB0092 [0,1,0,1,0,0|1,0,0]=3 3974 B16R2.2843 O=C(Cc1ccccc1)N2CC[C@H](C2)F WXVL_AN00035SB0092 [0,1,0,1,0,0|1,0,0]=3 3975 B16R2.2843 O=C(Cc1ccccc1)N2CC[C@H](C2)F WXVL_AN00035SB0092 [0,1,0,1,0,0|1,0,0]=3 3976 B16R2.2843 O=C(Cc1ccccc1)N2CC[C@H](C2)O WXVL_AN00543SB0092 [0,1,0,1,0,0|1,0,0]=3 3977 B16R2.2843 O=C(Cc1ccccn1)N2CCC(C2)Br WXVL_AN00715SA0032 [0,1,0,1,0,0|2,0,0]=4 3978 B16R2.2843 O=C(Cc1ccccn1)N2CCC(C2)F WXVL_AN00338SA0032 [0,1,0,1,0,0|2,0,0]=4 3979 B16R2.2843 O=C(Cc1ccccn1)N2CCC(C2)F WXVL_AN00338SA0032 [0,1,0,1,0,0|2,0,0]=4 3980 B16R2.2843 O=C(Cc1ccccn1)N2CCC(C2)O WXVL_AN0158SA0032 [0,1,0,1,0,0|2,0,0]=4 3981 B16R2.2843 O=C(Cc1ccccn1)N2CCC(C2)O WXVL_AN0158SA0032 [0,1,0,1,0,0|2,0,0]=4 3982 B16R2.2843 O=C(Cc1ccccn1)N2CC[C@@H](C2)O WXVL_AN00391SA0032 [0,1,0,1,0,0|2,0,0]=4 3983 B16R2.2843 O=C(Cc1ccccn1)N2CC[C@@H](C2)O WXVL_AN00391SA0032 [0,1,0,1,0,0|2,0,0]=4 3984 B16R2.2843 O=C(Cc1ccccn1)N2CC[C@H](C2)F WXVL_AN00035SA0032 [0,1,0,1,0,0|2,0,0]=4 3985 B16R2.2843 O=C(Cc1ccccn1)N2CC[C@H](C2)F WXVL_AN00035SA0032 [0,1,0,1,0,0|2,0,0]=4 3986 B16R2.2843 O=C(Cc1ccccn1)N2CC[C@H](C2)O WXVL_AN00543SA0032 [0,1,0,1,0,0|2,0,0]=4 3987 B16R2.2843 O=C(Cc1cccnc1)N2CCC(C2)Br WXVL_AN00715SA0029 [0,1,0,1,0,0|2,0,0]=4 3988 B16R2.2843 O=C(Cc1cccnc1)N2CCC(C2)Br WXVL_AN00715SB00049 [0,1,0,1,0,0|2,0,0]=4 3989 B16R2.2843 O=C(Cc1cccnc1)N2CCC(C2)F WXVL_AN00338SA0029 [0,1,0,1,0,0|2,0,0]=4 3990 B16R2.2843 O=C(Cc1cccnc1)N2CCC(C2)F WXVL_AN00338SA0029 [0,1,0,1,0,0|2,0,0]=4 3991 B16R2.2843 O=C(Cc1cccnc1)N2CCC(C2)F WXVL_AN00338SB00049 [0,1,0,1,0,0|2,0,0]=4 3992 B16R2.2843 O=C(Cc1cccnc1)N2CCC(C2)F WXVL_AN00338SB00049 [0,1,0,1,0,0|2,0,0]=4 3993 B16R2.2843 O=C(Cc1cccnc1)N2CCC(C2)O WXVL_AN0158SA0029 [0,1,0,1,0,0|2,0,0]=4 3994 B16R2.2843 O=C(Cc1cccnc1)N2CCC(C2)O WXVL_AN0158SA0029 [0,1,0,1,0,0|2,0,0]=4 3995 B16R2.2843 O=C(Cc1cccnc1)N2CCC(C2)O WXVL_AN0158SB00049 [0,1,0,1,0,0|2,0,0]=4 3996 B16R2.2843 O=C(Cc1cccnc1)N2CCC(C2)O WXVL_AN0158SB00049 [0,1,0,1,0,0|2,0,0]=4 3997 B16R2.2843 O=C(Cc1cccnc1)N2CC[C@@H](C2)O WXVL_AN00391SA0029 [0,1,0,1,0,0|2,0,0]=4 3998 B16R2.2843 O=C(Cc1cccnc1)N2CC[C@@H](C2)O WXVL_AN00391SA0029 [0,1,0,1,0,0|2,0,0]=4 3999 B16R2.2843 O=C(Cc1cccnc1)N2CC[C@@H](C2)O WXVL_AN00391SB00049 [0,1,0,1,0,0|2,0,0]=4 4000 B16R2.2843 O=C(Cc1cccnc1)N2CC[C@@H](C2)O WXVL_AN00391SB00049 [0,1,0,1,0,0|2,0,0]=4 4001 B16R2.2843 O=C(Cc1cccnc1)N2CC[C@H](C2)F WXVL_AN00035SA0029 [0,1,0,1,0,0|2,0,0]=4 4002 B16R2.2843 O=C(Cc1cccnc1)N2CC[C@H](C2)F WXVL_AN00035SA0029 [0,1,0,1,0,0|2,0,0]=4 4003 B16R2.2843 O=C(Cc1cccnc1)N2CC[C@H](C2)F WXVL_AN00035SB00049 [0,1,0,1,0,0|2,0,0]=4 4004 B16R2.2843 O=C(Cc1cccnc1)N2CC[C@H](C2)F WXVL_AN00035SB00049 [0,1,0,1,0,0|2,0,0]=4 4005 B16R2.2843 O=C(Cc1cccnc1)N2CC[C@H](C2)O WXVL_AN00543SA0029 [0,1,0,1,0,0|2,0,0]=4 4006 B16R2.2843 O=C(Cc1cccnc1)N2CC[C@H](C2)O WXVL_AN00543SB00049 [0,1,0,1,0,0|2,0,0]=4 4007 B16R2.2843 O=C(Cc1ccncc1)N2CCC(C2)Br WXVL_AN00715SA00106 [0,1,0,1,0,0|2,0,0]=4 4008 B16R2.2843 O=C(Cc1ccncc1)N2CCC(C2)F WXVL_AN00338SA00106 [0,1,0,1,0,0|2,0,0]=4 4009 B16R2.2843 O=C(Cc1ccncc1)N2CCC(C2)F WXVL_AN00338SA00106 [0,1,0,1,0,0|2,0,0]=4 4010 B16R2.2843 O=C(Cc1ccncc1)N2CCC(C2)O WXVL_AN0158SA00106 [0,1,0,1,0,0|2,0,0]=4 4011 B16R2.2843 O=C(Cc1ccncc1)N2CCC(C2)O WXVL_AN0158SA00106 [0,1,0,1,0,0|2,0,0]=4 4012 B16R2.2843 O=C(Cc1ccncc1)N2CC[C@@H](C2)O WXVL_AN00391SA00106 [0,1,0,1,0,0|2,0,0]=4 4013 B16R2.2843 O=C(Cc1ccncc1)N2CC[C@@H](C2)O WXVL_AN00391SA00106 [0,1,0,1,0,0|2,0,0]=4 4014 B16R2.2843 O=C(Cc1ccncc1)N2CC[C@H](C2)F WXVL_AN00035SA00106 [0,1,0,1,0,0|2,0,0]=4 4015 B16R2.2843 O=C(Cc1ccncc1)N2CC[C@H](C2)F WXVL_AN00035SA00106 [0,1,0,1,0,0|2,0,0]=4 4016 B16R2.2843 O=C(Cc1ccncc1)N2CC[C@H](C2)O WXVL_AN00543SA00106 [0,1,0,1,0,0|2,0,0]=4 4017 B16R2.27732 CC1(CCCC1)C(=O)Nc2ccccc2 WXVL_AG00183SB0209 [0,1,0,1,0,0|2,0,0]=4 4018 B16R2.27732 CC1(CCCC1)C(=O)Nc2ccccc2 WXVL_AG00183SB0209 [0,1,0,1,0,0|2,0,0]=4 4019 B16R2.3334 CC1CC(C1)NC(=O)Cc2ccccc2 WXVL_AK0309SB0092 [0,1,0,1,0,0|1,0,0]=3 4020 B16R2.3334 CC1CC(C1)NC(=O)Cc2ccccc2 WXVL_AK0309SB0092 [0,1,0,1,0,0|1,0,0]=3 4021 B16R2.3334 CC1CC(C1)NC(=O)Cc2ccccn2 WXVL_AK0309SA0032 [0,1,0,1,0,0|2,0,0]=4 4022 B16R2.3334 CC1CC(C1)NC(=O)Cc2ccccn2 WXVL_AK0309SA0032 [0,1,0,1,0,0|2,0,0]=4 4023 B16R2.3334 CC1CC(C1)NC(=O)Cc2cccnc2 WXVL_AK0309SA0029 [0,1,0,1,0,0|2,0,0]=4 4024 B16R2.3334 CC1CC(C1)NC(=O)Cc2cccnc2 WXVL_AK0309SA0029 [0,1,0,1,0,0|2,0,0]=4 4025 B16R2.3334 CC1CC(C1)NC(=O)Cc2cccnc2 WXVL_AK0309SB00049 [0,1,0,1,0,0|2,0,0]=4 4026 B16R2.3334 CC1CC(C1)NC(=O)Cc2cccnc2 WXVL_AK0309SB00049 [0,1,0,1,0,0|2,0,0]=4 4027 B16R2.3334 CC1CC(C1)NC(=O)Cc2ccncc2 WXVL_AK0309SA00106 [0,1,0,1,0,0|2,0,0]=4 4028 B16R2.3334 CC1CC(C1)NC(=O)Cc2ccncc2 WXVL_AK0309SA00106 [0,1,0,1,0,0|2,0,0]=4 4029 B16R2.3334 CN1CC(C1)NC(=O)Cc2ccccc2 WXVL_AK1377SB0092 [0,1,0,1,0,0|2,0,0]=4 4030 B16R2.3334 CN1CC(C1)NC(=O)Cc2ccccc2 WXVL_AK1377SB0092 [0,1,0,1,0,0|2,0,0]=4 4031 B16R2.3334 O=C(Cc1ccccc1)NC2CC(C2)F WXVL_AK0307SB0092 [0,1,0,1,0,0|1,0,0]=3 4032 B16R2.3334 O=C(Cc1ccccc1)NC2CC(C2)F WXVL_AK0307SB0092 [0,1,0,1,0,0|1,0,0]=3 4033 B16R2.3334 O=C(Cc1ccccc1)NC2CC(C2)O WXVL_AK0306SB0092 [0,1,0,1,0,0|1,0,0]=3 4034 B16R2.3334 O=C(Cc1ccccc1)NC2CC(C2)O WXVL_AK0306SB0092 [0,1,0,1,0,0|1,0,0]=3 4035 B16R2.3334 O=C(Cc1ccccc1)N[C@H]2C[C@H](C2)O WXVL_AK1397SB0092 [0,1,0,1,0,0|1,0,0]=3 4036 B16R2.3334 O=C(Cc1ccccc1)N[C@H]2C[C@H](C2)O WXVL_AK1397SB0092 [0,1,0,1,0,0|1,0,0]=3 4037 B16R2.3334 O=C(Cc1ccccn1)NC2CC(C2)F WXVL_AK0307SA0032 [0,1,0,1,0,0|2,0,0]=4 4038 B16R2.3334 O=C(Cc1ccccn1)NC2CC(C2)F WXVL_AK0307SA0032 [0,1,0,1,0,0|2,0,0]=4 4039 B16R2.3334 O=C(Cc1ccccn1)NC2CC(C2)O WXVL_AK0306SA0032 [0,1,0,1,0,0|2,0,0]=4 4040 B16R2.3334 O=C(Cc1ccccn1)NC2CC(C2)O WXVL_AK0306SA0032 [0,1,0,1,0,0|2,0,0]=4 4041 B16R2.3334 O=C(Cc1ccccn1)N[C@H]2C[C@H](C2)O WXVL_AK1397SA0032 [0,1,0,1,0,0|2,0,0]=4 4042 B16R2.3334 O=C(Cc1ccccn1)N[C@H]2C[C@H](C2)O WXVL_AK1397SA0032 [0,1,0,1,0,0|2,0,0]=4 4043 B16R2.3334 O=C(Cc1cccnc1)NC2CC(C2)F WXVL_AK0307SA0029 [0,1,0,1,0,0|2,0,0]=4 4044 B16R2.3334 O=C(Cc1cccnc1)NC2CC(C2)F WXVL_AK0307SA0029 [0,1,0,1,0,0|2,0,0]=4 4045 B16R2.3334 O=C(Cc1cccnc1)NC2CC(C2)F WXVL_AK0307SB00049 [0,1,0,1,0,0|2,0,0]=4 4046 B16R2.3334 O=C(Cc1cccnc1)NC2CC(C2)F WXVL_AK0307SB00049 [0,1,0,1,0,0|2,0,0]=4 4047 B16R2.3334 O=C(Cc1cccnc1)NC2CC(C2)O WXVL_AK0306SA0029 [0,1,0,1,0,0|2,0,0]=4 4048 B16R2.3334 O=C(Cc1cccnc1)NC2CC(C2)O WXVL_AK0306SA0029 [0,1,0,1,0,0|2,0,0]=4 4049 B16R2.3334 O=C(Cc1cccnc1)NC2CC(C2)O WXVL_AK0306SB00049 [0,1,0,1,0,0|2,0,0]=4 4050 B16R2.3334 O=C(Cc1cccnc1)NC2CC(C2)O WXVL_AK0306SB00049 [0,1,0,1,0,0|2,0,0]=4 4051 B16R2.3334 O=C(Cc1cccnc1)N[C@H]2C[C@H](C2)O WXVL_AK1397SA0029 [0,1,0,1,0,0|2,0,0]=4 4052 B16R2.3334 O=C(Cc1cccnc1)N[C@H]2C[C@H](C2)O WXVL_AK1397SA0029 [0,1,0,1,0,0|2,0,0]=4 4053 B16R2.3334 O=C(Cc1cccnc1)N[C@H]2C[C@H](C2)O WXVL_AK1397SB00049 [0,1,0,1,0,0|2,0,0]=4 4054 B16R2.3334 O=C(Cc1cccnc1)N[C@H]2C[C@H](C2)O WXVL_AK1397SB00049 [0,1,0,1,0,0|2,0,0]=4 4055 B16R2.3334 O=C(Cc1ccncc1)NC2CC(C2)F WXVL_AK0307SA00106 [0,1,0,1,0,0|2,0,0]=4 4056 B16R2.3334 O=C(Cc1ccncc1)NC2CC(C2)F WXVL_AK0307SA00106 [0,1,0,1,0,0|2,0,0]=4 4057 B16R2.3334 O=C(Cc1ccncc1)NC2CC(C2)O WXVL_AK0306SA00106 [0,1,0,1,0,0|2,0,0]=4 4058 B16R2.3334 O=C(Cc1ccncc1)NC2CC(C2)O WXVL_AK0306SA00106 [0,1,0,1,0,0|2,0,0]=4 4059 B16R2.3334 O=C(Cc1ccncc1)N[C@H]2C[C@H](C2)O WXVL_AK1397SA00106 [0,1,0,1,0,0|2,0,0]=4 4060 B16R2.3334 O=C(Cc1ccncc1)N[C@H]2C[C@H](C2)O WXVL_AK1397SA00106 [0,1,0,1,0,0|2,0,0]=4 4061 B16R2.27736 O=C(CC1(CCC1)O)Nc2ccccc2 WXVL_AG00183SB0026 [0,1,0,1,0,0|2,0,0]=4 4062 B16R2.27736 O=C(CC1(CCC1)O)Nc2ccccc2 WXVL_AG00183SB0026 [0,1,0,1,0,0|2,0,0]=4 4063 B16R2.27769 CC(NC(=O)Cc1ccccc1)C2CC2 WXVL_AK00200SB0092 [0,1,0,1,0,0|1,0,0]=3 4064 B16R2.27769 CC(NC(=O)Cc1ccccc1)C2CC2 WXVL_AK00200SB0092 [0,1,0,1,0,0|1,0,0]=3 4065 B16R2.27769 CC(NC(=O)Cc1ccccn1)C2CC2 WXVL_AK00200SA0032 [0,1,0,1,0,0|2,0,0]=4 4066 B16R2.27769 CC(NC(=O)Cc1ccccn1)C2CC2 WXVL_AK00200SA0032 [0,1,0,1,0,0|2,0,0]=4 4067 B16R2.27769 CC(NC(=O)Cc1cccnc1)C2CC2 WXVL_AK00200SA0029 [0,1,0,1,0,0|2,0,0]=4 4068 B16R2.27769 CC(NC(=O)Cc1cccnc1)C2CC2 WXVL_AK00200SA0029 [0,1,0,1,0,0|2,0,0]=4 4069 B16R2.27769 CC(NC(=O)Cc1cccnc1)C2CC2 WXVL_AK00200SB00049 [0,1,0,1,0,0|2,0,0]=4 4070 B16R2.27769 CC(NC(=O)Cc1cccnc1)C2CC2 WXVL_AK00200SB00049 [0,1,0,1,0,0|2,0,0]=4 4071 B16R2.27769 CC(NC(=O)Cc1ccncc1)C2CC2 WXVL_AK00200SA00106 [0,1,0,1,0,0|2,0,0]=4 4072 B16R2.27769 CC(NC(=O)Cc1ccncc1)C2CC2 WXVL_AK00200SA00106 [0,1,0,1,0,0|2,0,0]=4 4073 B16R2.27769 C[C@H](NC(=O)Cc1ccccc1)C2CC2 WXVL_AK0484SB0092 [0,1,0,1,0,0|1,0,0]=3 4074 B16R2.27769 C[C@H](NC(=O)Cc1ccccc1)C2CC2 WXVL_AK0484SB0092 [0,1,0,1,0,0|1,0,0]=3 4075 B16R2.27769 C[C@H](NC(=O)Cc1ccccn1)C2CC2 WXVL_AK0484SA0032 [0,1,0,1,0,0|2,0,0]=4 4076 B16R2.27769 C[C@H](NC(=O)Cc1ccccn1)C2CC2 WXVL_AK0484SA0032 [0,1,0,1,0,0|2,0,0]=4 4077 B16R2.27769 C[C@H](NC(=O)Cc1cccnc1)C2CC2 WXVL_AK0484SA0029 [0,1,0,1,0,0|2,0,0]=4 4078 B16R2.27769 C[C@H](NC(=O)Cc1cccnc1)C2CC2 WXVL_AK0484SA0029 [0,1,0,1,0,0|2,0,0]=4 4079 B16R2.27769 C[C@H](NC(=O)Cc1cccnc1)C2CC2 WXVL_AK0484SB00049 [0,1,0,1,0,0|2,0,0]=4 4080 B16R2.27769 C[C@H](NC(=O)Cc1cccnc1)C2CC2 WXVL_AK0484SB00049 [0,1,0,1,0,0|2,0,0]=4 4081 B16R2.27769 C[C@H](NC(=O)Cc1ccncc1)C2CC2 WXVL_AK0484SA00106 [0,1,0,1,0,0|2,0,0]=4 4082 B16R2.27769 C[C@H](NC(=O)Cc1ccncc1)C2CC2 WXVL_AK0484SA00106 [0,1,0,1,0,0|2,0,0]=4 4083 B16R2.147271 CC1(CC1)CNC(=O)Cc2ccccc2 WXVL_AK00811SB0092 [0,1,0,1,0,0|1,0,0]=3 4084 B16R2.147271 CC1(CC1)CNC(=O)Cc2ccccc2 WXVL_AK00811SB0092 [0,1,0,1,0,0|1,0,0]=3 4085 B16R2.147271 CC1(CC1)CNC(=O)Cc2ccccn2 WXVL_AK00811SA0032 [0,1,0,1,0,0|2,0,0]=4 4086 B16R2.147271 CC1(CC1)CNC(=O)Cc2ccccn2 WXVL_AK00811SA0032 [0,1,0,1,0,0|2,0,0]=4 4087 B16R2.147271 CC1(CC1)CNC(=O)Cc2cccnc2 WXVL_AK00811SA0029 [0,1,0,1,0,0|2,0,0]=4 4088 B16R2.147271 CC1(CC1)CNC(=O)Cc2cccnc2 WXVL_AK00811SA0029 [0,1,0,1,0,0|2,0,0]=4 4089 B16R2.147271 CC1(CC1)CNC(=O)Cc2cccnc2 WXVL_AK00811SB00049 [0,1,0,1,0,0|2,0,0]=4 4090 B16R2.147271 CC1(CC1)CNC(=O)Cc2cccnc2 WXVL_AK00811SB00049 [0,1,0,1,0,0|2,0,0]=4 4091 B16R2.147271 CC1(CC1)CNC(=O)Cc2ccncc2 WXVL_AK00811SA00106 [0,1,0,1,0,0|2,0,0]=4 4092 B16R2.147271 CC1(CC1)CNC(=O)Cc2ccncc2 WXVL_AK00811SA00106 [0,1,0,1,0,0|2,0,0]=4 4093 B16R2.147271 O=C(Cc1ccccc1)NCC2(CC2)O WXVL_AK0301SB0092 [0,1,0,1,0,0|1,0,0]=3 4094 B16R2.147271 O=C(Cc1ccccc1)NCC2(CC2)O WXVL_AK0301SB0092 [0,1,0,1,0,0|1,0,0]=3 4095 B16R2.147271 O=C(Cc1ccccn1)NCC2(CC2)O WXVL_AK0301SA0032 [0,1,0,1,0,0|2,0,0]=4 4096 B16R2.147271 O=C(Cc1ccccn1)NCC2(CC2)O WXVL_AK0301SA0032 [0,1,0,1,0,0|2,0,0]=4 4097 B16R2.147271 O=C(Cc1cccnc1)NCC2(CC2)O WXVL_AK0301SA0029 [0,1,0,1,0,0|2,0,0]=4 4098 B16R2.147271 O=C(Cc1cccnc1)NCC2(CC2)O WXVL_AK0301SA0029 [0,1,0,1,0,0|2,0,0]=4 4099 B16R2.147271 O=C(Cc1cccnc1)NCC2(CC2)O WXVL_AK0301SB00049 [0,1,0,1,0,0|2,0,0]=4 4100 B16R2.147271 O=C(Cc1cccnc1)NCC2(CC2)O WXVL_AK0301SB00049 [0,1,0,1,0,0|2,0,0]=4 4101 B16R2.147271 O=C(Cc1ccncc1)NCC2(CC2)O WXVL_AK0301SA00106 [0,1,0,1,0,0|2,0,0]=4 4102 B16R2.147271 O=C(Cc1ccncc1)NCC2(CC2)O WXVL_AK0301SA00106 [0,1,0,1,0,0|2,0,0]=4 4103 B16R2.27737 O=C(Cc1ccccc1)NC2CC2(F)F WXVL_AK0397SB0092 [0,1,0,1,0,0|2,0,0]=4 4104 B16R2.27737 O=C(Cc1ccccc1)NC2CC2(F)F WXVL_AK0397SB0092 [0,1,0,1,0,0|2,0,0]=4 4105 B16R2.2957 Cc1ccccc1CC(=O)N2CCCC2 WXVL_AN0008SB0098 [0,1,0,1,0,0|1,0,0]=3 4106 B16R2.2957 Cc1ccccc1CC(=O)N2CCCC2 WXVL_AN0008SB0098 [0,1,0,1,0,0|1,0,0]=3 4107 B16R2.2957 Cc1ccccc1NC(=O)C2CCCC2 WXVL_AG0027SB0043 [0,1,0,1,0,0|2,0,0]=4 4108 B16R2.2957 Cc1ccccc1NC(=O)C2CCCC2 WXVL_AG0027SB0043 [0,1,0,1,0,0|2,0,0]=4 4109 B16R2.2957 Cc1ccccc1NC(=O)N2CCCC2 WXVL_AN0008YV0013 [0,1,0,1,0,0|2,0,0]=4 4110 B16R2.2957 Cc1ccccc1NC(=O)N2CCCC2 WXVL_AN0008YV0013 [0,1,0,1,0,0|2,0,0]=4 4111 B16R2.2957 O=C(Cc1ccccc1Br)N2CCCC2 WXVL_AN0008SB0093 [0,1,0,1,0,0|1,0,0]=3 4112 B16R2.2957 O=C(Cc1ccccc1Br)N2CCCC2 WXVL_AN0008SB0093 [0,1,0,1,0,0|1,0,0]=3 4113 B16R2.2957 O=C(Cc1ccccc1Cl)N2CCCC2 WXVL_AN0008SB0095 [0,1,0,1,0,0|1,0,0]=3 4114 B16R2.2957 O=C(Cc1ccccc1Cl)N2CCCC2 WXVL_AN0008SB0095 [0,1,0,1,0,0|1,0,0]=3 4115 B16R2.2957 O=C(Cc1ccccc1F)N2CCCC2 WXVL_AN0008SB0094 [0,1,0,1,0,0|1,0,0]=3 4116 B16R2.2957 O=C(Cc1ccccc1F)N2CCCC2 WXVL_AN0008SB0094 [0,1,0,1,0,0|1,0,0]=3 4117 B16R2.2957 O=C(Cc1ccccc1I)N2CCCC2 WXVL_AN0008SB1145 [0,1,0,1,0,0|1,0,0]=3 4118 B16R2.2957 O=C(Cc1ccccc1I)N2CCCC2 WXVL_AN0008SB1145 [0,1,0,1,0,0|1,0,0]=3 4119 B16R2.2957 O=C(Cc1ccccc1O)N2CCCC2 WXVL_AN0008SB0400 [0,1,0,1,0,0|1,0,0]=3 4120 B16R2.2957 O=C(Cc1ccccc1O)N2CCCC2 WXVL_AN0008SB0400 [0,1,0,1,0,0|1,0,0]=3 4121 B16R2.2957 O=C(Cc1cccnc1Cl)N2CCCC2 WXVL_AN0008SA0056 [0,1,0,1,0,0|2,0,0]=4 4122 B16R2.2957 O=C(Cc1cccnc1Cl)N2CCCC2 WXVL_AN0008SA0056 [0,1,0,1,0,0|2,0,0]=4 4123 B16R2.2957 O=C(Nc1ccccc1Br)C2CCCC2 WXVL_AG00180SB0043 [0,1,0,1,0,0|2,0,0]=4 4124 B16R2.2957 O=C(Nc1ccccc1Br)C2CCCC2 WXVL_AG00180SB0043 [0,1,0,1,0,0|2,0,0]=4 4125 B16R2.2957 O=C(Nc1ccccc1Br)N2CCCC2 WXVL_AN0008YV0003 [0,1,0,1,0,0|2,0,0]=4 4126 B16R2.2957 O=C(Nc1ccccc1Br)N2CCCC2 WXVL_AN0008YV0003 [0,1,0,1,0,0|2,0,0]=4 4127 B16R2.2957 O=C(Nc1ccccc1Cl)C2CCCC2 WXVL_AG00129SB0043 [0,1,0,1,0,0|2,0,0]=4 4128 B16R2.2957 O=C(Nc1ccccc1Cl)C2CCCC2 WXVL_AG00129SB0043 [0,1,0,1,0,0|2,0,0]=4 4129 B16R2.2957 O=C(Nc1ccccc1Cl)N2CCCC2 WXVL_AN0008YV0007 [0,1,0,1,0,0|2,0,0]=4 4130 B16R2.2957 O=C(Nc1ccccc1Cl)N2CCCC2 WXVL_AN0008YV0007 [0,1,0,1,0,0|2,0,0]=4 4131 B16R2.2957 O=C(Nc1ccccc1I)C2CCCC2 WXVL_AG0385SB0043 [0,1,0,1,0,0|2,0,0]=4 4132 B16R2.2957 O=C(Nc1ccccc1I)C2CCCC2 WXVL_AG0385SB0043 [0,1,0,1,0,0|2,0,0]=4 4133 B16R2.24867 Cc1ccccc1NC(=O)CCC2CC2 WXVL_AG0027SB5360 [0,1,0,1,0,0|2,0,0]=4 4134 B16R2.24867 Cc1ccccc1NC(=O)CCC2CC2 WXVL_AG0027SB5360 [0,1,0,1,0,0|2,0,0]=4 4135 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2Br WXVL_AG00180SB5360 [0,1,0,1,0,0|2,0,0]=4 4136 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2Br WXVL_AG00180SB5360 [0,1,0,1,0,0|2,0,0]=4 4137 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2Cl WXVL_AG00129SB5360 [0,1,0,1,0,0|2,0,0]=4 4138 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2Cl WXVL_AG00129SB5360 [0,1,0,1,0,0|2,0,0]=4 4139 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2I WXVL_AG0385SB5360 [0,1,0,1,0,0|2,0,0]=4 4140 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2I WXVL_AG0385SB5360 [0,1,0,1,0,0|2,0,0]=4 4141 B16R2.84031 Cc1ccccc1CC(=O)NC2CNC2 WXVL_AK1291SB0098 [0,1,0,1,0,0|2,0,0]=4 4142 B16R2.84031 Cc1ccccc1CC(=O)NC2CNC2 WXVL_AK1291SB0098 [0,1,0,1,0,0|2,0,0]=4 4143 B16R2.84031 Cc1ccccc1CC(=O)NC2CSC2 WXVL_AK2089SB0098 [0,1,0,1,0,0|2,0,0]=4 4144 B16R2.84031 Cc1ccccc1CC(=O)NC2CSC2 WXVL_AK2089SB0098 [0,1,0,1,0,0|2,0,0]=4 4145 B16R2.84031 Cc1ccccc1NC(=O)CC2CCC2 WXVL_AG0027SB2207 [0,1,0,1,0,0|2,0,0]=4 4146 B16R2.84031 Cc1ccccc1NC(=O)CC2CCC2 WXVL_AG0027SB2207 [0,1,0,1,0,0|2,0,0]=4 4147 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2Br WXVL_AG00180SB2207 [0,1,0,1,0,0|2,0,0]=4 4148 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2Br WXVL_AG00180SB2207 [0,1,0,1,0,0|2,0,0]=4 4149 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2Cl WXVL_AG00129SB2207 [0,1,0,1,0,0|2,0,0]=4 4150 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2Cl WXVL_AG00129SB2207 [0,1,0,1,0,0|2,0,0]=4 4151 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2I WXVL_AG0385SB2207 [0,1,0,1,0,0|2,0,0]=4 4152 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2I WXVL_AG0385SB2207 [0,1,0,1,0,0|2,0,0]=4 4153 B16R2.84031 O=C(Cc1ccccc1Br)NC2CNC2 WXVL_AK1291SB0093 [0,1,0,1,0,0|2,0,0]=4 4154 B16R2.84031 O=C(Cc1ccccc1Br)NC2CNC2 WXVL_AK1291SB0093 [0,1,0,1,0,0|2,0,0]=4 4155 B16R2.84031 O=C(Cc1ccccc1Br)NC2CSC2 WXVL_AK2089SB0093 [0,1,0,1,0,0|2,0,0]=4 4156 B16R2.84031 O=C(Cc1ccccc1Br)NC2CSC2 WXVL_AK2089SB0093 [0,1,0,1,0,0|2,0,0]=4 4157 B16R2.84031 O=C(Cc1ccccc1Cl)NC2CNC2 WXVL_AK1291SB0095 [0,1,0,1,0,0|2,0,0]=4 4158 B16R2.84031 O=C(Cc1ccccc1Cl)NC2CNC2 WXVL_AK1291SB0095 [0,1,0,1,0,0|2,0,0]=4 4159 B16R2.84031 O=C(Cc1ccccc1Cl)NC2CSC2 WXVL_AK2089SB0095 [0,1,0,1,0,0|2,0,0]=4 4160 B16R2.84031 O=C(Cc1ccccc1Cl)NC2CSC2 WXVL_AK2089SB0095 [0,1,0,1,0,0|2,0,0]=4 4161 B16R2.84031 O=C(Cc1ccccc1F)NC2CNC2 WXVL_AK1291SB0094 [0,1,0,1,0,0|2,0,0]=4 4162 B16R2.84031 O=C(Cc1ccccc1F)NC2CNC2 WXVL_AK1291SB0094 [0,1,0,1,0,0|2,0,0]=4 4163 B16R2.84031 O=C(Cc1ccccc1F)NC2CSC2 WXVL_AK2089SB0094 [0,1,0,1,0,0|2,0,0]=4 4164 B16R2.84031 O=C(Cc1ccccc1F)NC2CSC2 WXVL_AK2089SB0094 [0,1,0,1,0,0|2,0,0]=4 4165 B16R2.84031 O=C(Cc1ccccc1I)NC2CNC2 WXVL_AK1291SB1145 [0,1,0,1,0,0|2,0,0]=4 4166 B16R2.84031 O=C(Cc1ccccc1I)NC2CNC2 WXVL_AK1291SB1145 [0,1,0,1,0,0|2,0,0]=4 4167 B16R2.84031 O=C(Cc1ccccc1I)NC2CSC2 WXVL_AK2089SB1145 [0,1,0,1,0,0|2,0,0]=4 4168 B16R2.84031 O=C(Cc1ccccc1I)NC2CSC2 WXVL_AK2089SB1145 [0,1,0,1,0,0|2,0,0]=4 4169 B16R2.84031 O=C(Cc1ccccc1O)NC2CNC2 WXVL_AK1291SB0400 [0,1,0,1,0,0|2,0,0]=4 4170 B16R2.84031 O=C(Cc1ccccc1O)NC2CNC2 WXVL_AK1291SB0400 [0,1,0,1,0,0|2,0,0]=4 4171 B16R2.84031 O=C(Cc1ccccc1O)NC2CSC2 WXVL_AK2089SB0400 [0,1,0,1,0,0|2,0,0]=4 4172 B16R2.84031 O=C(Cc1ccccc1O)NC2CSC2 WXVL_AK2089SB0400 [0,1,0,1,0,0|2,0,0]=4 4173 B16R2.12242 O=S(=O)(Cc1ccccc1)N2CCCC2 WXVL_AN0008HU0025 [0,1,0,1,0,0|2,0,0]=4 4174 B16R2.12242 O=S(=O)(Cc1ccccc1)N2CCCC2 WXVL_AN0008HU0025 [0,1,0,1,0,0|2,0,0]=4 4175 B12R1.30 CCCNC(=O)c1ccccc1 WXVL_AK00504SD0001 [1,0,0,0,1,0|1,0,0]=3 4176 B12R1.30 CCCNC(=O)c1ccccc1 WXVL_AK00504SD0001 [1,0,0,0,1,0|1,0,0]=3 4177 B12R1.30 CCCNC(=O)c1ccccn1 WXVL_AK00504SC0058 [1,0,0,0,1,0|2,0,0]=4 4178 B12R1.30 CCCNC(=O)c1ccccn1 WXVL_AK00504SC0058 [1,0,0,0,1,0|2,0,0]=4 4179 B12R1.30 CCCNC(=O)c1cccnc1 WXVL_AK00504SC0061 [1,0,0,0,1,0|2,0,0]=4 4180 B12R1.30 CCCNC(=O)c1cccnc1 WXVL_AK00504SC0061 [1,0,0,0,1,0|2,0,0]=4 4181 B12R1.30 CCCNC(=O)c1ccncc1 WXVL_AK00504SC0062 [1,0,0,0,1,0|2,0,0]=4 4182 B12R1.30 CCCNC(=O)c1ccncc1 WXVL_AK00504SC0062 [1,0,0,0,1,0|2,0,0]=4 4183 B12R1.30 O=C(NCCF)c1ccccc1 WXVL_AK00466SD0001 [1,0,0,0,1,0|2,0,0]=4 4184 B12R1.30 O=C(NCCF)c1ccccc1 WXVL_AK00466SD0001 [1,0,0,0,1,0|2,0,0]=4 4185 B12R1.53 CCCNC(=O)Cc1cccs1 WXVL_AK00504SA0018 [1,0,0,0,1,0|2,0,0]=4 4186 B12R1.53 CCCNC(=O)Cc1cccs1 WXVL_AK00504SA0018 [1,0,0,0,1,0|2,0,0]=4 4187 B12R1.53 CCCNC(=O)Cc1ccsc1 WXVL_AK00504SA0020 [1,0,0,0,1,0|2,0,0]=4 4188 B12R1.53 CCCNC(=O)Cc1ccsc1 WXVL_AK00504SA0020 [1,0,0,0,1,0|2,0,0]=4 4189 B12R1.35 CCCCNC(=O)c1cc[nH]c1 WXVL_AK00588SC0013 [0,0,0,0,2,0|2,0,0]=4 4190 B12R1.35 CCCCNC(=O)c1cc[nH]c1 WXVL_AK00588SC0013 [0,0,0,0,2,0|2,0,0]=4 4191 B12R1.35 CCCCNC(=O)c1ccco1 WXVL_AK00588SC0049 [0,0,0,0,2,0|2,0,0]=4 4192 B12R1.35 CCCCNC(=O)c1ccco1 WXVL_AK00588SC0049 [0,0,0,0,2,0|2,0,0]=4 4193 B12R1.35 CCCCNC(=O)c1cccs1 WXVL_AK00588SC0051 [0,0,0,0,2,0|2,0,0]=4 4194 B12R1.35 CCCCNC(=O)c1cccs1 WXVL_AK00588SC0051 [0,0,0,0,2,0|2,0,0]=4 4195 B12R1.35 CCCCNC(=O)c1ccoc1 WXVL_AK00588SC0050 [0,0,0,0,2,0|2,0,0]=4 4196 B12R1.35 CCCCNC(=O)c1ccoc1 WXVL_AK00588SC0050 [0,0,0,0,2,0|2,0,0]=4 4197 B12R1.35 CCCCNC(=O)c1ccsc1 WXVL_AK00588SC0054 [0,0,0,0,2,0|2,0,0]=4 4198 B12R1.35 CCCCNC(=O)c1ccsc1 WXVL_AK00588SC0054 [0,0,0,0,2,0|2,0,0]=4 4199 B16R1.1694 CCCCNC(=O)CCCc1ccccc1 WXVL_AK00588SB0121 [0,0,0,0,0,2|1,0,0]=3 4200 B16R1.1694 CCCCNC(=O)CCCc1ccccc1 WXVL_AK00588SB0121 [0,0,0,0,0,2|1,0,0]=3 4201 B16R1.1694 CCCCNC(=O)CCOc1ccccc1 WXVL_AK00588SB0066 [0,0,0,0,0,2|1,0,0]=3 4202 B16R1.1694 CCCCNC(=O)CCOc1ccccc1 WXVL_AK00588SB0066 [0,0,0,0,0,2|1,0,0]=3 4203 B16R1.1694 CCCCNC(=O)COCc1ccccc1 WXVL_AK00588SB0185 [0,0,0,0,0,2|1,0,0]=3 4204 B16R1.1694 CCCCNC(=O)COCc1ccccc1 WXVL_AK00588SB0185 [0,0,0,0,0,2|1,0,0]=3 4205 B16R1.1694 CSCCNC(=O)CCCc1ccccc1 WXVL_AK00440SB0121 [0,0,0,0,0,2|2,0,0]=4 4206 B16R1.1694 CSCCNC(=O)CCCc1ccccc1 WXVL_AK00440SB0121 [0,0,0,0,0,2|2,0,0]=4 4207 B16R1.1694 CSCCNC(=O)CCOc1ccccc1 WXVL_AK00440SB0066 [0,0,0,0,0,2|2,0,0]=4 4208 B16R1.1694 CSCCNC(=O)CCOc1ccccc1 WXVL_AK00440SB0066 [0,0,0,0,0,2|2,0,0]=4 4209 B16R1.1694 CSCCNC(=O)COCc1ccccc1 WXVL_AK00440SB0185 [0,0,0,0,0,2|2,0,0]=4 4210 B16R1.1694 CSCCNC(=O)COCc1ccccc1 WXVL_AK00440SB0185 [0,0,0,0,0,2|2,0,0]=4 4211 B16R1.1694 O=C(CCCCBr)NCCc1ccccc1 WXVL_AK00498SB3153 [0,0,0,0,0,2|2,0,0]=4 4212 B16R1.1694 O=C(CCCCBr)NCCc1ccccc1 WXVL_AK00498SB3153 [0,0,0,0,0,2|2,0,0]=4 4213 B16R1.1694 O=C(CCCCCl)NCCc1ccccc1 WXVL_AK00498SB0379 [0,0,0,0,0,2|2,0,0]=4 4214 B16R1.1694 O=C(CCCCCl)NCCc1ccccc1 WXVL_AK00498SB0379 [0,0,0,0,0,2|2,0,0]=4 4215 B16R1.1694 O=C(CCCc1ccccc1)NCCCO WXVL_AK0073SB0121 [0,0,0,0,0,2|2,0,0]=4 4216 B16R1.1694 O=C(CCCc1ccccc1)NCCCO WXVL_AK0073SB0121 [0,0,0,0,0,2|2,0,0]=4 4217 B16R1.1694 O=C(CCOc1ccccc1)NCCCO WXVL_AK0073SB0066 [0,0,0,0,0,2|2,0,0]=4 4218 B16R1.1694 O=C(CCOc1ccccc1)NCCCO WXVL_AK0073SB0066 [0,0,0,0,0,2|2,0,0]=4 4219 B16R1.1694 O=C(COCc1ccccc1)NCCCO WXVL_AK0073SB0185 [0,0,0,0,0,2|2,0,0]=4 4220 B16R1.1694 O=C(COCc1ccccc1)NCCCO WXVL_AK0073SB0185 [0,0,0,0,0,2|2,0,0]=4 4221 B16R1.1694 O=C(NCCCCl)NCCc1ccccc1 WXVL_AK00498YV0130 [0,0,0,0,0,2|2,0,0]=4 4222 B16R1.1694 O=C(NCCCCl)NCCc1ccccc1 WXVL_AK00498YV0130 [0,0,0,0,0,2|2,0,0]=4