0 B13R1.153 C#CCCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB2189 [0,0,0,0,0,0|2,0,2]=4 1 B13R1.153 C#CCCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB2189 [0,0,0,0,0,0|2,0,2]=4 2 B13R1.153 C#CCCC(=O)NCc1ccco1 WXVL_AK0010SB2189 [0,0,0,0,0,0|1,0,2]=3 3 B13R1.153 C#CCCC(=O)NCc1ccco1 WXVL_AK0010SB2189 [0,0,0,0,0,0|1,0,2]=3 4 B13R1.153 C#CCCC(=O)NCc1cccs1 WXVL_AK0014SB2189 [0,0,0,0,0,0|1,1,2]=4 5 B13R1.153 C#CCCC(=O)NCc1cccs1 WXVL_AK0014SB2189 [0,0,0,0,0,0|1,1,2]=4 6 B13R1.153 C#CCCC(=O)NCc1cnco1 WXVL_AK1437SB2189 [0,0,0,0,0,0|2,0,2]=4 7 B13R1.153 C#CCCC(=O)NCc1cnco1 WXVL_AK1437SB2189 [0,0,0,0,0,0|2,0,2]=4 8 B13R1.153 C=CCCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB1035 [0,0,0,0,0,0|2,0,2]=4 9 B13R1.153 C=CCCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB1035 [0,0,0,0,0,0|2,0,2]=4 10 B13R1.153 C=CCCC(=O)NCc1ccco1 WXVL_AK0010SB1035 [0,0,0,0,0,0|1,0,2]=3 11 B13R1.153 C=CCCC(=O)NCc1ccco1 WXVL_AK0010SB1035 [0,0,0,0,0,0|1,0,2]=3 12 B13R1.153 C=CCCC(=O)NCc1cccs1 WXVL_AK0014SB1035 [0,0,0,0,0,0|1,1,2]=4 13 B13R1.153 C=CCCC(=O)NCc1cccs1 WXVL_AK0014SB1035 [0,0,0,0,0,0|1,1,2]=4 14 B13R1.153 C=CCCC(=O)NCc1cnco1 WXVL_AK1437SB1035 [0,0,0,0,0,0|2,0,2]=4 15 B13R1.153 C=CCCC(=O)NCc1cnco1 WXVL_AK1437SB1035 [0,0,0,0,0,0|2,0,2]=4 16 B13R1.153 C=CCNC(=O)CCc1ccco1 WXVL_AK00561SA0167 [0,0,0,0,0,0|2,0,2]=4 17 B13R1.153 C=CCNC(=O)CCc1ccco1 WXVL_AK00561SA0167 [0,0,0,0,0,0|2,0,2]=4 18 B13R1.153 CCCNC(=O)/C=C/c1ccco1 WXVL_AK00504SA0180 [0,0,0,0,0,0|2,0,1]=3 19 B13R1.153 CCCNC(=O)/C=C/c1ccco1 WXVL_AK00504SA0180 [0,0,0,0,0,0|2,0,1]=3 20 B13R1.153 CCCNC(=O)/C=C/c1cccs1 WXVL_AK00504SA0001 [0,0,0,0,0,0|2,1,1]=4 21 B13R1.153 CCCNC(=O)/C=C/c1cccs1 WXVL_AK00504SA0001 [0,0,0,0,0,0|2,1,1]=4 22 B13R1.153 CCCNC(=O)CCc1ccc[nH]1 WXVL_AK00504SA0009 [0,0,0,0,0,0|3,0,0]=3 23 B13R1.153 CCCNC(=O)CCc1ccc[nH]1 WXVL_AK00504SA0009 [0,0,0,0,0,0|3,0,0]=3 24 B13R1.153 CCCNC(=O)CCc1ccco1 WXVL_AK00504SA0167 [0,0,0,0,0,0|2,0,0]=2 25 B13R1.153 CCCNC(=O)CCc1ccco1 WXVL_AK00504SA0167 [0,0,0,0,0,0|2,0,0]=2 26 B13R1.153 CCCNC(=O)CCc1cccs1 WXVL_AK00504SA0303 [0,0,0,0,0,0|2,1,0]=3 27 B13R1.153 CCCNC(=O)CCc1cccs1 WXVL_AK00504SA0303 [0,0,0,0,0,0|2,1,0]=3 28 B13R1.153 CCCNC(=O)CCc1ccoc1 WXVL_AK00504SA3178 [0,0,0,0,0,0|4,0,0]=4 29 B13R1.153 CCCNC(=O)CCc1ccoc1 WXVL_AK00504SA3178 [0,0,0,0,0,0|4,0,0]=4 30 B13R1.153 CCCNC(=O)CCc1ccsc1 WXVL_AK00504SA0008 [0,0,0,0,0,0|4,0,0]=4 31 B13R1.153 CCCNC(=O)CCc1ccsc1 WXVL_AK00504SA0008 [0,0,0,0,0,0|4,0,0]=4 32 B13R1.153 CCCNC(=O)CCc1cnc[nH]1 WXVL_AK00504SA0100 [0,0,0,0,0,0|4,0,0]=4 33 B13R1.153 CCCNC(=O)CCc1cnc[nH]1 WXVL_AK00504SA0100 [0,0,0,0,0,0|4,0,0]=4 34 B13R1.153 CCCNC(=O)CCc1ncc[nH]1 WXVL_AK00504SA0555 [0,0,0,0,0,0|4,0,0]=4 35 B13R1.153 CCCNC(=O)CCc1ncc[nH]1 WXVL_AK00504SA0555 [0,0,0,0,0,0|4,0,0]=4 36 B13R1.153 CCOCC(=O)NCc1cc[nH]n1 WXVL_AK00156SB0091 [0,0,0,0,0,0|4,0,0]=4 37 B13R1.153 CCOCC(=O)NCc1cc[nH]n1 WXVL_AK00156SB0091 [0,0,0,0,0,0|4,0,0]=4 38 B13R1.153 CCOCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0091 [0,0,0,0,0,0|3,0,0]=3 39 B13R1.153 CCOCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0091 [0,0,0,0,0,0|3,0,0]=3 40 B13R1.153 CCOCC(=O)NCc1ccco1 WXVL_AK0010SB0091 [0,0,0,0,0,0|2,0,0]=2 41 B13R1.153 CCOCC(=O)NCc1ccco1 WXVL_AK0010SB0091 [0,0,0,0,0,0|2,0,0]=2 42 B13R1.153 CCOCC(=O)NCc1cccs1 WXVL_AK0014SB0091 [0,0,0,0,0,0|2,1,0]=3 43 B13R1.153 CCOCC(=O)NCc1cccs1 WXVL_AK0014SB0091 [0,0,0,0,0,0|2,1,0]=3 44 B13R1.153 CCOCC(=O)NCc1ccn[nH]1 WXVL_AK0459SB0091 [0,0,0,0,0,0|4,0,0]=4 45 B13R1.153 CCOCC(=O)NCc1ccn[nH]1 WXVL_AK0459SB0091 [0,0,0,0,0,0|4,0,0]=4 46 B13R1.153 CCOCC(=O)NCc1ccoc1 WXVL_AK2033SB0091 [0,0,0,0,0,0|4,0,0]=4 47 B13R1.153 CCOCC(=O)NCc1ccoc1 WXVL_AK2033SB0091 [0,0,0,0,0,0|4,0,0]=4 48 B13R1.153 CCOCC(=O)NCc1ccsc1 WXVL_AK00174SB0091 [0,0,0,0,0,0|4,0,0]=4 49 B13R1.153 CCOCC(=O)NCc1ccsc1 WXVL_AK00174SB0091 [0,0,0,0,0,0|4,0,0]=4 50 B13R1.153 CCOCC(=O)NCc1cnc[nH]1 WXVL_AK00778SB0091 [0,0,0,0,0,0|4,0,0]=4 51 B13R1.153 CCOCC(=O)NCc1cnc[nH]1 WXVL_AK00778SB0091 [0,0,0,0,0,0|4,0,0]=4 52 B13R1.153 CCOCC(=O)NCc1cnco1 WXVL_AK1437SB0091 [0,0,0,0,0,0|3,0,0]=3 53 B13R1.153 CCOCC(=O)NCc1cnco1 WXVL_AK1437SB0091 [0,0,0,0,0,0|3,0,0]=3 54 B13R1.153 CCOCC(=O)NCc1cncs1 WXVL_AK0526SB0091 [0,0,0,0,0,0|3,1,0]=4 55 B13R1.153 CCOCC(=O)NCc1cncs1 WXVL_AK0526SB0091 [0,0,0,0,0,0|3,1,0]=4 56 B13R1.153 CCOCC(=O)NCc1cocn1 WXVL_AK00016SB0091 [0,0,0,0,0,0|4,0,0]=4 57 B13R1.153 CCOCC(=O)NCc1cocn1 WXVL_AK00016SB0091 [0,0,0,0,0,0|4,0,0]=4 58 B13R1.153 CCOCC(=O)NCc1cscn1 WXVL_AK0325SB0091 [0,0,0,0,0,0|4,0,0]=4 59 B13R1.153 CCOCC(=O)NCc1cscn1 WXVL_AK0325SB0091 [0,0,0,0,0,0|4,0,0]=4 60 B13R1.153 CCOCC(=O)NCc1nccs1 WXVL_AK0153SB0091 [0,0,0,0,0,0|3,1,0]=4 61 B13R1.153 CCOCC(=O)NCc1nccs1 WXVL_AK0153SB0091 [0,0,0,0,0,0|3,1,0]=4 62 B13R1.153 CCSCC(=O)NCc1cc[nH]n1 WXVL_AK00156SB0002 [0,0,0,0,0,0|4,0,0]=4 63 B13R1.153 CCSCC(=O)NCc1cc[nH]n1 WXVL_AK00156SB0002 [0,0,0,0,0,0|4,0,0]=4 64 B13R1.153 CCSCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0002 [0,0,0,0,0,0|3,0,0]=3 65 B13R1.153 CCSCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0002 [0,0,0,0,0,0|3,0,0]=3 66 B13R1.153 CCSCC(=O)NCc1ccco1 WXVL_AK0010SB0002 [0,0,0,0,0,0|2,0,0]=2 67 B13R1.153 CCSCC(=O)NCc1ccco1 WXVL_AK0010SB0002 [0,0,0,0,0,0|2,0,0]=2 68 B13R1.153 CCSCC(=O)NCc1cccs1 WXVL_AK0014SB0002 [0,0,0,0,0,0|2,1,0]=3 69 B13R1.153 CCSCC(=O)NCc1cccs1 WXVL_AK0014SB0002 [0,0,0,0,0,0|2,1,0]=3 70 B13R1.153 CCSCC(=O)NCc1ccn[nH]1 WXVL_AK0459SB0002 [0,0,0,0,0,0|4,0,0]=4 71 B13R1.153 CCSCC(=O)NCc1ccn[nH]1 WXVL_AK0459SB0002 [0,0,0,0,0,0|4,0,0]=4 72 B13R1.153 CCSCC(=O)NCc1ccoc1 WXVL_AK2033SB0002 [0,0,0,0,0,0|4,0,0]=4 73 B13R1.153 CCSCC(=O)NCc1ccoc1 WXVL_AK2033SB0002 [0,0,0,0,0,0|4,0,0]=4 74 B13R1.153 CCSCC(=O)NCc1ccsc1 WXVL_AK00174SB0002 [0,0,0,0,0,0|4,0,0]=4 75 B13R1.153 CCSCC(=O)NCc1ccsc1 WXVL_AK00174SB0002 [0,0,0,0,0,0|4,0,0]=4 76 B13R1.153 CCSCC(=O)NCc1cnc[nH]1 WXVL_AK00778SB0002 [0,0,0,0,0,0|4,0,0]=4 77 B13R1.153 CCSCC(=O)NCc1cnc[nH]1 WXVL_AK00778SB0002 [0,0,0,0,0,0|4,0,0]=4 78 B13R1.153 CCSCC(=O)NCc1cnco1 WXVL_AK1437SB0002 [0,0,0,0,0,0|3,0,0]=3 79 B13R1.153 CCSCC(=O)NCc1cnco1 WXVL_AK1437SB0002 [0,0,0,0,0,0|3,0,0]=3 80 B13R1.153 CCSCC(=O)NCc1cncs1 WXVL_AK0526SB0002 [0,0,0,0,0,0|3,1,0]=4 81 B13R1.153 CCSCC(=O)NCc1cncs1 WXVL_AK0526SB0002 [0,0,0,0,0,0|3,1,0]=4 82 B13R1.153 CCSCC(=O)NCc1cocn1 WXVL_AK00016SB0002 [0,0,0,0,0,0|4,0,0]=4 83 B13R1.153 CCSCC(=O)NCc1cocn1 WXVL_AK00016SB0002 [0,0,0,0,0,0|4,0,0]=4 84 B13R1.153 CCSCC(=O)NCc1cscn1 WXVL_AK0325SB0002 [0,0,0,0,0,0|4,0,0]=4 85 B13R1.153 CCSCC(=O)NCc1cscn1 WXVL_AK0325SB0002 [0,0,0,0,0,0|4,0,0]=4 86 B13R1.153 CCSCC(=O)NCc1nccs1 WXVL_AK0153SB0002 [0,0,0,0,0,0|3,1,0]=4 87 B13R1.153 CCSCC(=O)NCc1nccs1 WXVL_AK0153SB0002 [0,0,0,0,0,0|3,1,0]=4 88 B13R1.153 COCCC(=O)NCc1cc[nH]n1 WXVL_AK00156SB0156 [0,0,0,0,0,0|4,0,0]=4 89 B13R1.153 COCCC(=O)NCc1cc[nH]n1 WXVL_AK00156SB0156 [0,0,0,0,0,0|4,0,0]=4 90 B13R1.153 COCCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0156 [0,0,0,0,0,0|3,0,0]=3 91 B13R1.153 COCCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0156 [0,0,0,0,0,0|3,0,0]=3 92 B13R1.153 COCCC(=O)NCc1ccco1 WXVL_AK0010SB0156 [0,0,0,0,0,0|2,0,0]=2 93 B13R1.153 COCCC(=O)NCc1ccco1 WXVL_AK0010SB0156 [0,0,0,0,0,0|2,0,0]=2 94 B13R1.153 COCCC(=O)NCc1cccs1 WXVL_AK0014SB0156 [0,0,0,0,0,0|2,1,0]=3 95 B13R1.153 COCCC(=O)NCc1cccs1 WXVL_AK0014SB0156 [0,0,0,0,0,0|2,1,0]=3 96 B13R1.153 COCCC(=O)NCc1ccn[nH]1 WXVL_AK0459SB0156 [0,0,0,0,0,0|4,0,0]=4 97 B13R1.153 COCCC(=O)NCc1ccn[nH]1 WXVL_AK0459SB0156 [0,0,0,0,0,0|4,0,0]=4 98 B13R1.153 COCCC(=O)NCc1ccoc1 WXVL_AK2033SB0156 [0,0,0,0,0,0|4,0,0]=4 99 B13R1.153 COCCC(=O)NCc1ccoc1 WXVL_AK2033SB0156 [0,0,0,0,0,0|4,0,0]=4 100 B13R1.153 COCCC(=O)NCc1ccsc1 WXVL_AK00174SB0156 [0,0,0,0,0,0|4,0,0]=4 101 B13R1.153 COCCC(=O)NCc1ccsc1 WXVL_AK00174SB0156 [0,0,0,0,0,0|4,0,0]=4 102 B13R1.153 COCCC(=O)NCc1cnc[nH]1 WXVL_AK00778SB0156 [0,0,0,0,0,0|4,0,0]=4 103 B13R1.153 COCCC(=O)NCc1cnc[nH]1 WXVL_AK00778SB0156 [0,0,0,0,0,0|4,0,0]=4 104 B13R1.153 COCCC(=O)NCc1cnco1 WXVL_AK1437SB0156 [0,0,0,0,0,0|3,0,0]=3 105 B13R1.153 COCCC(=O)NCc1cnco1 WXVL_AK1437SB0156 [0,0,0,0,0,0|3,0,0]=3 106 B13R1.153 COCCC(=O)NCc1cncs1 WXVL_AK0526SB0156 [0,0,0,0,0,0|3,1,0]=4 107 B13R1.153 COCCC(=O)NCc1cncs1 WXVL_AK0526SB0156 [0,0,0,0,0,0|3,1,0]=4 108 B13R1.153 COCCC(=O)NCc1cocn1 WXVL_AK00016SB0156 [0,0,0,0,0,0|4,0,0]=4 109 B13R1.153 COCCC(=O)NCc1cocn1 WXVL_AK00016SB0156 [0,0,0,0,0,0|4,0,0]=4 110 B13R1.153 COCCC(=O)NCc1cscn1 WXVL_AK0325SB0156 [0,0,0,0,0,0|4,0,0]=4 111 B13R1.153 COCCC(=O)NCc1cscn1 WXVL_AK0325SB0156 [0,0,0,0,0,0|4,0,0]=4 112 B13R1.153 COCCC(=O)NCc1nccs1 WXVL_AK0153SB0156 [0,0,0,0,0,0|3,1,0]=4 113 B13R1.153 COCCC(=O)NCc1nccs1 WXVL_AK0153SB0156 [0,0,0,0,0,0|3,1,0]=4 114 B13R1.153 CSCCC(=O)NCc1cc[nH]n1 WXVL_AK00156SB0361 [0,0,0,0,0,0|4,0,0]=4 115 B13R1.153 CSCCC(=O)NCc1cc[nH]n1 WXVL_AK00156SB0361 [0,0,0,0,0,0|4,0,0]=4 116 B13R1.153 CSCCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0361 [0,0,0,0,0,0|3,0,0]=3 117 B13R1.153 CSCCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0361 [0,0,0,0,0,0|3,0,0]=3 118 B13R1.153 CSCCC(=O)NCc1ccco1 WXVL_AK0010SB0361 [0,0,0,0,0,0|2,0,0]=2 119 B13R1.153 CSCCC(=O)NCc1ccco1 WXVL_AK0010SB0361 [0,0,0,0,0,0|2,0,0]=2 120 B13R1.153 CSCCC(=O)NCc1cccs1 WXVL_AK0014SB0361 [0,0,0,0,0,0|2,1,0]=3 121 B13R1.153 CSCCC(=O)NCc1cccs1 WXVL_AK0014SB0361 [0,0,0,0,0,0|2,1,0]=3 122 B13R1.153 CSCCC(=O)NCc1ccn[nH]1 WXVL_AK0459SB0361 [0,0,0,0,0,0|4,0,0]=4 123 B13R1.153 CSCCC(=O)NCc1ccn[nH]1 WXVL_AK0459SB0361 [0,0,0,0,0,0|4,0,0]=4 124 B13R1.153 CSCCC(=O)NCc1ccoc1 WXVL_AK2033SB0361 [0,0,0,0,0,0|4,0,0]=4 125 B13R1.153 CSCCC(=O)NCc1ccoc1 WXVL_AK2033SB0361 [0,0,0,0,0,0|4,0,0]=4 126 B13R1.153 CSCCC(=O)NCc1ccsc1 WXVL_AK00174SB0361 [0,0,0,0,0,0|4,0,0]=4 127 B13R1.153 CSCCC(=O)NCc1ccsc1 WXVL_AK00174SB0361 [0,0,0,0,0,0|4,0,0]=4 128 B13R1.153 CSCCC(=O)NCc1cnc[nH]1 WXVL_AK00778SB0361 [0,0,0,0,0,0|4,0,0]=4 129 B13R1.153 CSCCC(=O)NCc1cnc[nH]1 WXVL_AK00778SB0361 [0,0,0,0,0,0|4,0,0]=4 130 B13R1.153 CSCCC(=O)NCc1cnco1 WXVL_AK1437SB0361 [0,0,0,0,0,0|3,0,0]=3 131 B13R1.153 CSCCC(=O)NCc1cnco1 WXVL_AK1437SB0361 [0,0,0,0,0,0|3,0,0]=3 132 B13R1.153 CSCCC(=O)NCc1cncs1 WXVL_AK0526SB0361 [0,0,0,0,0,0|3,1,0]=4 133 B13R1.153 CSCCC(=O)NCc1cncs1 WXVL_AK0526SB0361 [0,0,0,0,0,0|3,1,0]=4 134 B13R1.153 CSCCC(=O)NCc1cocn1 WXVL_AK00016SB0361 [0,0,0,0,0,0|4,0,0]=4 135 B13R1.153 CSCCC(=O)NCc1cocn1 WXVL_AK00016SB0361 [0,0,0,0,0,0|4,0,0]=4 136 B13R1.153 CSCCC(=O)NCc1cscn1 WXVL_AK0325SB0361 [0,0,0,0,0,0|4,0,0]=4 137 B13R1.153 CSCCC(=O)NCc1cscn1 WXVL_AK0325SB0361 [0,0,0,0,0,0|4,0,0]=4 138 B13R1.153 CSCCC(=O)NCc1nccs1 WXVL_AK0153SB0361 [0,0,0,0,0,0|3,1,0]=4 139 B13R1.153 CSCCC(=O)NCc1nccs1 WXVL_AK0153SB0361 [0,0,0,0,0,0|3,1,0]=4 140 B13R1.153 N#CCNC(=O)CCc1ccco1 WXVL_AK0683SA0167 [0,0,0,0,0,0|3,0,1]=4 141 B13R1.153 N#CCNC(=O)CCc1ccco1 WXVL_AK0683SA0167 [0,0,0,0,0,0|3,0,1]=4 142 B13R1.153 O=C(/C=C/CBr)NCc1ccco1 WXVL_AK0010SB0424 [0,0,0,0,0,0|2,0,2]=4 143 B13R1.153 O=C(/C=C/CBr)NCc1ccco1 WXVL_AK0010SB0424 [0,0,0,0,0,0|2,0,2]=4 144 B13R1.153 O=C(/C=C/c1ccco1)NCCF WXVL_AK00466SA0180 [0,0,0,0,0,0|3,0,1]=4 145 B13R1.153 O=C(/C=C/c1ccco1)NCCF WXVL_AK00466SA0180 [0,0,0,0,0,0|3,0,1]=4 146 B13R1.153 O=C(CCc1ccc[nH]1)NCCF WXVL_AK00466SA0009 [0,0,0,0,0,0|4,0,0]=4 147 B13R1.153 O=C(CCc1ccc[nH]1)NCCF WXVL_AK00466SA0009 [0,0,0,0,0,0|4,0,0]=4 148 B13R1.153 O=C(CCc1ccco1)NCCF WXVL_AK00466SA0167 [0,0,0,0,0,0|3,0,0]=3 149 B13R1.153 O=C(CCc1ccco1)NCCF WXVL_AK00466SA0167 [0,0,0,0,0,0|3,0,0]=3 150 B13R1.153 O=C(CCc1cccs1)NCCF WXVL_AK00466SA0303 [0,0,0,0,0,0|3,1,0]=4 151 B13R1.153 O=C(CCc1cccs1)NCCF WXVL_AK00466SA0303 [0,0,0,0,0,0|3,1,0]=4 152 B13R1.153 O=C(NCCCl)NCc1ccc[nH]1 WXVL_AK00759YV0092 [0,0,0,0,0,0|4,0,0]=4 153 B13R1.153 O=C(NCCCl)NCc1ccc[nH]1 WXVL_AK00759YV0092 [0,0,0,0,0,0|4,0,0]=4 154 B13R1.153 O=C(NCCCl)NCc1ccco1 WXVL_AK0010YV0092 [0,0,0,0,0,0|3,0,0]=3 155 B13R1.153 O=C(NCCCl)NCc1ccco1 WXVL_AK0010YV0092 [0,0,0,0,0,0|3,0,0]=3 156 B13R1.153 O=C(NCCCl)NCc1cccs1 WXVL_AK0014YV0092 [0,0,0,0,0,0|3,1,0]=4 157 B13R1.153 O=C(NCCCl)NCc1cccs1 WXVL_AK0014YV0092 [0,0,0,0,0,0|3,1,0]=4 158 B13R1.153 O=C(NCCCl)NCc1cnco1 WXVL_AK1437YV0092 [0,0,0,0,0,0|4,0,0]=4 159 B13R1.153 O=C(NCCCl)NCc1cnco1 WXVL_AK1437YV0092 [0,0,0,0,0,0|4,0,0]=4 160 B12R1.51 C#CCC(=O)NCc1ccco1 WXVL_AK0010SB3070 [1,0,0,0,0,0|1,0,2]=4 161 B12R1.51 C#CCC(=O)NCc1ccco1 WXVL_AK0010SB3070 [1,0,0,0,0,0|1,0,2]=4 162 B12R1.51 C/C=C/C(=O)NCc1ccco1 WXVL_AK0010SB0340 [1,0,0,0,0,0|1,0,2]=4 163 B12R1.51 C/C=C/C(=O)NCc1ccco1 WXVL_AK0010SB0340 [1,0,0,0,0,0|1,0,2]=4 164 B12R1.51 C=CCC(=O)NCc1ccco1 WXVL_AK0010SB2732 [1,0,0,0,0,0|1,0,2]=4 165 B12R1.51 C=CCC(=O)NCc1ccco1 WXVL_AK0010SB2732 [1,0,0,0,0,0|1,0,2]=4 166 B12R1.51 CC#CC(=O)NCc1ccco1 WXVL_AK0010SB1240 [1,0,0,0,0,0|1,0,2]=4 167 B12R1.51 CC#CC(=O)NCc1ccco1 WXVL_AK0010SB1240 [1,0,0,0,0,0|1,0,2]=4 168 B12R1.51 CCCC(=O)NCc1cc[nH]n1 WXVL_AK00156SB0073 [1,0,0,0,0,0|3,0,0]=4 169 B12R1.51 CCCC(=O)NCc1cc[nH]n1 WXVL_AK00156SB0073 [1,0,0,0,0,0|3,0,0]=4 170 B12R1.51 CCCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0073 [1,0,0,0,0,0|2,0,0]=3 171 B12R1.51 CCCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0073 [1,0,0,0,0,0|2,0,0]=3 172 B12R1.51 CCCC(=O)NCc1ccco1 WXVL_AK0010SB0073 [1,0,0,0,0,0|1,0,0]=2 173 B12R1.51 CCCC(=O)NCc1ccco1 WXVL_AK0010SB0073 [1,0,0,0,0,0|1,0,0]=2 174 B12R1.51 CCCC(=O)NCc1cccs1 WXVL_AK0014SB0073 [1,0,0,0,0,0|1,1,0]=3 175 B12R1.51 CCCC(=O)NCc1cccs1 WXVL_AK0014SB0073 [1,0,0,0,0,0|1,1,0]=3 176 B12R1.51 CCCC(=O)NCc1ccn[nH]1 WXVL_AK0459SB0073 [1,0,0,0,0,0|3,0,0]=4 177 B12R1.51 CCCC(=O)NCc1ccn[nH]1 WXVL_AK0459SB0073 [1,0,0,0,0,0|3,0,0]=4 178 B12R1.51 CCCC(=O)NCc1ccoc1 WXVL_AK2033SB0073 [1,0,0,0,0,0|3,0,0]=4 179 B12R1.51 CCCC(=O)NCc1ccoc1 WXVL_AK2033SB0073 [1,0,0,0,0,0|3,0,0]=4 180 B12R1.51 CCCC(=O)NCc1ccsc1 WXVL_AK00174SB0073 [1,0,0,0,0,0|3,0,0]=4 181 B12R1.51 CCCC(=O)NCc1ccsc1 WXVL_AK00174SB0073 [1,0,0,0,0,0|3,0,0]=4 182 B12R1.51 CCCC(=O)NCc1cnc[nH]1 WXVL_AK00778SB0073 [1,0,0,0,0,0|3,0,0]=4 183 B12R1.51 CCCC(=O)NCc1cnc[nH]1 WXVL_AK00778SB0073 [1,0,0,0,0,0|3,0,0]=4 184 B12R1.51 CCCC(=O)NCc1cnco1 WXVL_AK1437SB0073 [1,0,0,0,0,0|2,0,0]=3 185 B12R1.51 CCCC(=O)NCc1cnco1 WXVL_AK1437SB0073 [1,0,0,0,0,0|2,0,0]=3 186 B12R1.51 CCCC(=O)NCc1cncs1 WXVL_AK0526SB0073 [1,0,0,0,0,0|2,1,0]=4 187 B12R1.51 CCCC(=O)NCc1cncs1 WXVL_AK0526SB0073 [1,0,0,0,0,0|2,1,0]=4 188 B12R1.51 CCCC(=O)NCc1cocn1 WXVL_AK00016SB0073 [1,0,0,0,0,0|3,0,0]=4 189 B12R1.51 CCCC(=O)NCc1cocn1 WXVL_AK00016SB0073 [1,0,0,0,0,0|3,0,0]=4 190 B12R1.51 CCCC(=O)NCc1cscn1 WXVL_AK0325SB0073 [1,0,0,0,0,0|3,0,0]=4 191 B12R1.51 CCCC(=O)NCc1cscn1 WXVL_AK0325SB0073 [1,0,0,0,0,0|3,0,0]=4 192 B12R1.51 CCCC(=O)NCc1nccs1 WXVL_AK0153SB0073 [1,0,0,0,0,0|2,1,0]=4 193 B12R1.51 CCCC(=O)NCc1nccs1 WXVL_AK0153SB0073 [1,0,0,0,0,0|2,1,0]=4 194 B12R1.51 CCNC(=O)/C=C/c1ccco1 WXVL_AK00476SA0180 [1,0,0,0,0,0|2,0,1]=4 195 B12R1.51 CCNC(=O)/C=C/c1ccco1 WXVL_AK00476SA0180 [1,0,0,0,0,0|2,0,1]=4 196 B12R1.51 CCNC(=O)CCc1ccc[nH]1 WXVL_AK00476SA0009 [1,0,0,0,0,0|3,0,0]=4 197 B12R1.51 CCNC(=O)CCc1ccc[nH]1 WXVL_AK00476SA0009 [1,0,0,0,0,0|3,0,0]=4 198 B12R1.51 CCNC(=O)CCc1ccco1 WXVL_AK00476SA0167 [1,0,0,0,0,0|2,0,0]=3 199 B12R1.51 CCNC(=O)CCc1ccco1 WXVL_AK00476SA0167 [1,0,0,0,0,0|2,0,0]=3 200 B12R1.51 CCNC(=O)CCc1cccs1 WXVL_AK00476SA0303 [1,0,0,0,0,0|2,1,0]=4 201 B12R1.51 CCNC(=O)CCc1cccs1 WXVL_AK00476SA0303 [1,0,0,0,0,0|2,1,0]=4 202 B12R1.51 COCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0090 [1,0,0,0,0,0|3,0,0]=4 203 B12R1.51 COCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0090 [1,0,0,0,0,0|3,0,0]=4 204 B12R1.51 COCC(=O)NCc1ccco1 WXVL_AK0010SB0090 [1,0,0,0,0,0|2,0,0]=3 205 B12R1.51 COCC(=O)NCc1ccco1 WXVL_AK0010SB0090 [1,0,0,0,0,0|2,0,0]=3 206 B12R1.51 COCC(=O)NCc1cccs1 WXVL_AK0014SB0090 [1,0,0,0,0,0|2,1,0]=4 207 B12R1.51 COCC(=O)NCc1cccs1 WXVL_AK0014SB0090 [1,0,0,0,0,0|2,1,0]=4 208 B12R1.51 COCC(=O)NCc1cnco1 WXVL_AK1437SB0090 [1,0,0,0,0,0|3,0,0]=4 209 B12R1.51 COCC(=O)NCc1cnco1 WXVL_AK1437SB0090 [1,0,0,0,0,0|3,0,0]=4 210 B12R1.51 CSCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB1267 [1,0,0,0,0,0|3,0,0]=4 211 B12R1.51 CSCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB1267 [1,0,0,0,0,0|3,0,0]=4 212 B12R1.51 CSCC(=O)NCc1ccco1 WXVL_AK0010SB1267 [1,0,0,0,0,0|2,0,0]=3 213 B12R1.51 CSCC(=O)NCc1ccco1 WXVL_AK0010SB1267 [1,0,0,0,0,0|2,0,0]=3 214 B12R1.51 CSCC(=O)NCc1cccs1 WXVL_AK0014SB1267 [1,0,0,0,0,0|2,1,0]=4 215 B12R1.51 CSCC(=O)NCc1cccs1 WXVL_AK0014SB1267 [1,0,0,0,0,0|2,1,0]=4 216 B12R1.51 CSCC(=O)NCc1cnco1 WXVL_AK1437SB1267 [1,0,0,0,0,0|3,0,0]=4 217 B12R1.51 CSCC(=O)NCc1cnco1 WXVL_AK1437SB1267 [1,0,0,0,0,0|3,0,0]=4 218 B12R1.51 N#CCC(=O)NCc1ccco1 WXVL_AK0010SB0057 [1,0,0,0,0,0|2,0,1]=4 219 B12R1.51 N#CCC(=O)NCc1ccco1 WXVL_AK0010SB0057 [1,0,0,0,0,0|2,0,1]=4 220 B14R1.86 C#CCCCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB2709 [0,1,0,0,0,0|2,0,1]=4 221 B14R1.86 C#CCCCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB2709 [0,1,0,0,0,0|2,0,1]=4 222 B14R1.86 C#CCCCC(=O)NCc1ccco1 WXVL_AK0010SB2709 [0,1,0,0,0,0|1,0,1]=3 223 B14R1.86 C#CCCCC(=O)NCc1ccco1 WXVL_AK0010SB2709 [0,1,0,0,0,0|1,0,1]=3 224 B14R1.86 C#CCCCC(=O)NCc1cccs1 WXVL_AK0014SB2709 [0,1,0,0,0,0|1,1,1]=4 225 B14R1.86 C#CCCCC(=O)NCc1cccs1 WXVL_AK0014SB2709 [0,1,0,0,0,0|1,1,1]=4 226 B14R1.86 C#CCCCC(=O)NCc1cnco1 WXVL_AK1437SB2709 [0,1,0,0,0,0|2,0,1]=4 227 B14R1.86 C#CCCCC(=O)NCc1cnco1 WXVL_AK1437SB2709 [0,1,0,0,0,0|2,0,1]=4 228 B14R1.86 C#CCCNC(=O)CCc1ccco1 WXVL_AK3109SA0167 [0,1,0,0,0,0|1,0,2]=4 229 B14R1.86 C#CCCNC(=O)CCc1ccco1 WXVL_AK3109SA0167 [0,1,0,0,0,0|1,0,2]=4 230 B14R1.86 C=CCCCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB2920 [0,1,0,0,0,0|2,0,1]=4 231 B14R1.86 C=CCCCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB2920 [0,1,0,0,0,0|2,0,1]=4 232 B14R1.86 C=CCCCC(=O)NCc1ccco1 WXVL_AK0010SB2920 [0,1,0,0,0,0|1,0,1]=3 233 B14R1.86 C=CCCCC(=O)NCc1ccco1 WXVL_AK0010SB2920 [0,1,0,0,0,0|1,0,1]=3 234 B14R1.86 C=CCCCC(=O)NCc1cccs1 WXVL_AK0014SB2920 [0,1,0,0,0,0|1,1,1]=4 235 B14R1.86 C=CCCCC(=O)NCc1cccs1 WXVL_AK0014SB2920 [0,1,0,0,0,0|1,1,1]=4 236 B14R1.86 C=CCCCC(=O)NCc1cnco1 WXVL_AK1437SB2920 [0,1,0,0,0,0|2,0,1]=4 237 B14R1.86 C=CCCCC(=O)NCc1cnco1 WXVL_AK1437SB2920 [0,1,0,0,0,0|2,0,1]=4 238 B14R1.86 C=CCCNC(=O)CCc1ccco1 WXVL_AK00138SA0167 [0,1,0,0,0,0|1,0,2]=4 239 B14R1.86 C=CCCNC(=O)CCc1ccco1 WXVL_AK00138SA0167 [0,1,0,0,0,0|1,0,2]=4 240 B14R1.86 CC/C=C/CC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0349 [0,1,0,0,0,0|2,0,1]=4 241 B14R1.86 CC/C=C/CC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0349 [0,1,0,0,0,0|2,0,1]=4 242 B14R1.86 CC/C=C/CC(=O)NCc1ccco1 WXVL_AK0010SB0349 [0,1,0,0,0,0|1,0,1]=3 243 B14R1.86 CC/C=C/CC(=O)NCc1ccco1 WXVL_AK0010SB0349 [0,1,0,0,0,0|1,0,1]=3 244 B14R1.86 CC/C=C/CC(=O)NCc1cccs1 WXVL_AK0014SB0349 [0,1,0,0,0,0|1,1,1]=4 245 B14R1.86 CC/C=C/CC(=O)NCc1cccs1 WXVL_AK0014SB0349 [0,1,0,0,0,0|1,1,1]=4 246 B14R1.86 CC/C=C/CC(=O)NCc1cnco1 WXVL_AK1437SB0349 [0,1,0,0,0,0|2,0,1]=4 247 B14R1.86 CC/C=C/CC(=O)NCc1cnco1 WXVL_AK1437SB0349 [0,1,0,0,0,0|2,0,1]=4 248 B14R1.86 CCCCNC(=O)/C=C/c1ccco1 WXVL_AK00588SA0180 [0,1,0,0,0,0|1,0,1]=3 249 B14R1.86 CCCCNC(=O)/C=C/c1ccco1 WXVL_AK00588SA0180 [0,1,0,0,0,0|1,0,1]=3 250 B14R1.86 CCCCNC(=O)/C=C/c1cccs1 WXVL_AK00588SA0001 [0,1,0,0,0,0|1,1,1]=4 251 B14R1.86 CCCCNC(=O)/C=C/c1cccs1 WXVL_AK00588SA0001 [0,1,0,0,0,0|1,1,1]=4 252 B14R1.86 CCCCNC(=O)CCc1ccc[nH]1 WXVL_AK00588SA0009 [0,1,0,0,0,0|2,0,0]=3 253 B14R1.86 CCCCNC(=O)CCc1ccc[nH]1 WXVL_AK00588SA0009 [0,1,0,0,0,0|2,0,0]=3 254 B14R1.86 CCCCNC(=O)CCc1ccco1 WXVL_AK00588SA0167 [0,1,0,0,0,0|1,0,0]=2 255 B14R1.86 CCCCNC(=O)CCc1ccco1 WXVL_AK00588SA0167 [0,1,0,0,0,0|1,0,0]=2 256 B14R1.86 CCCCNC(=O)CCc1cccs1 WXVL_AK00588SA0303 [0,1,0,0,0,0|1,1,0]=3 257 B14R1.86 CCCCNC(=O)CCc1cccs1 WXVL_AK00588SA0303 [0,1,0,0,0,0|1,1,0]=3 258 B14R1.86 CCCCNC(=O)CCc1ccoc1 WXVL_AK00588SA3178 [0,1,0,0,0,0|3,0,0]=4 259 B14R1.86 CCCCNC(=O)CCc1ccoc1 WXVL_AK00588SA3178 [0,1,0,0,0,0|3,0,0]=4 260 B14R1.86 CCCCNC(=O)CCc1ccsc1 WXVL_AK00588SA0008 [0,1,0,0,0,0|3,0,0]=4 261 B14R1.86 CCCCNC(=O)CCc1ccsc1 WXVL_AK00588SA0008 [0,1,0,0,0,0|3,0,0]=4 262 B14R1.86 CCCCNC(=O)CCc1cnc[nH]1 WXVL_AK00588SA0100 [0,1,0,0,0,0|3,0,0]=4 263 B14R1.86 CCCCNC(=O)CCc1cnc[nH]1 WXVL_AK00588SA0100 [0,1,0,0,0,0|3,0,0]=4 264 B14R1.86 CCCCNC(=O)CCc1ncc[nH]1 WXVL_AK00588SA0555 [0,1,0,0,0,0|3,0,0]=4 265 B14R1.86 CCCCNC(=O)CCc1ncc[nH]1 WXVL_AK00588SA0555 [0,1,0,0,0,0|3,0,0]=4 266 B14R1.86 CCO/C=C/C(=O)NCc1ccco1 WXVL_AK0010SB3226 [0,1,0,0,0,0|1,0,2]=4 267 B14R1.86 CCO/C=C/C(=O)NCc1ccco1 WXVL_AK0010SB3226 [0,1,0,0,0,0|1,0,2]=4 268 B14R1.86 CSCCNC(=O)/C=C/c1ccco1 WXVL_AK00440SA0180 [0,1,0,0,0,0|2,0,1]=4 269 B14R1.86 CSCCNC(=O)/C=C/c1ccco1 WXVL_AK00440SA0180 [0,1,0,0,0,0|2,0,1]=4 270 B14R1.86 CSCCNC(=O)CCc1ccc[nH]1 WXVL_AK00440SA0009 [0,1,0,0,0,0|3,0,0]=4 271 B14R1.86 CSCCNC(=O)CCc1ccc[nH]1 WXVL_AK00440SA0009 [0,1,0,0,0,0|3,0,0]=4 272 B14R1.86 CSCCNC(=O)CCc1ccco1 WXVL_AK00440SA0167 [0,1,0,0,0,0|2,0,0]=3 273 B14R1.86 CSCCNC(=O)CCc1ccco1 WXVL_AK00440SA0167 [0,1,0,0,0,0|2,0,0]=3 274 B14R1.86 CSCCNC(=O)CCc1cccs1 WXVL_AK00440SA0303 [0,1,0,0,0,0|2,1,0]=4 275 B14R1.86 CSCCNC(=O)CCc1cccs1 WXVL_AK00440SA0303 [0,1,0,0,0,0|2,1,0]=4 276 B14R1.86 N#CCCNC(=O)CCc1ccco1 WXVL_AK0087SA0167 [0,1,0,0,0,0|2,0,1]=4 277 B14R1.86 N#CCCNC(=O)CCc1ccco1 WXVL_AK0087SA0167 [0,1,0,0,0,0|2,0,1]=4 278 B14R1.86 O=C(/C=C/c1ccco1)NCCCO WXVL_AK0073SA0180 [0,1,0,0,0,0|2,0,1]=4 279 B14R1.86 O=C(/C=C/c1ccco1)NCCCO WXVL_AK0073SA0180 [0,1,0,0,0,0|2,0,1]=4 280 B14R1.86 O=C(CCCCBr)NCc1cc[nH]n1 WXVL_AK00156SB3153 [0,1,0,0,0,0|3,0,0]=4 281 B14R1.86 O=C(CCCCBr)NCc1cc[nH]n1 WXVL_AK00156SB3153 [0,1,0,0,0,0|3,0,0]=4 282 B14R1.86 O=C(CCCCBr)NCc1ccc[nH]1 WXVL_AK00759SB3153 [0,1,0,0,0,0|2,0,0]=3 283 B14R1.86 O=C(CCCCBr)NCc1ccc[nH]1 WXVL_AK00759SB3153 [0,1,0,0,0,0|2,0,0]=3 284 B14R1.86 O=C(CCCCBr)NCc1ccco1 WXVL_AK0010SB3153 [0,1,0,0,0,0|1,0,0]=2 285 B14R1.86 O=C(CCCCBr)NCc1ccco1 WXVL_AK0010SB3153 [0,1,0,0,0,0|1,0,0]=2 286 B14R1.86 O=C(CCCCBr)NCc1cccs1 WXVL_AK0014SB3153 [0,1,0,0,0,0|1,1,0]=3 287 B14R1.86 O=C(CCCCBr)NCc1cccs1 WXVL_AK0014SB3153 [0,1,0,0,0,0|1,1,0]=3 288 B14R1.86 O=C(CCCCBr)NCc1ccn[nH]1 WXVL_AK0459SB3153 [0,1,0,0,0,0|3,0,0]=4 289 B14R1.86 O=C(CCCCBr)NCc1ccn[nH]1 WXVL_AK0459SB3153 [0,1,0,0,0,0|3,0,0]=4 290 B14R1.86 O=C(CCCCBr)NCc1ccoc1 WXVL_AK2033SB3153 [0,1,0,0,0,0|3,0,0]=4 291 B14R1.86 O=C(CCCCBr)NCc1ccoc1 WXVL_AK2033SB3153 [0,1,0,0,0,0|3,0,0]=4 292 B14R1.86 O=C(CCCCBr)NCc1ccsc1 WXVL_AK00174SB3153 [0,1,0,0,0,0|3,0,0]=4 293 B14R1.86 O=C(CCCCBr)NCc1ccsc1 WXVL_AK00174SB3153 [0,1,0,0,0,0|3,0,0]=4 294 B14R1.86 O=C(CCCCBr)NCc1cnc[nH]1 WXVL_AK00778SB3153 [0,1,0,0,0,0|3,0,0]=4 295 B14R1.86 O=C(CCCCBr)NCc1cnc[nH]1 WXVL_AK00778SB3153 [0,1,0,0,0,0|3,0,0]=4 296 B14R1.86 O=C(CCCCBr)NCc1cnco1 WXVL_AK1437SB3153 [0,1,0,0,0,0|2,0,0]=3 297 B14R1.86 O=C(CCCCBr)NCc1cnco1 WXVL_AK1437SB3153 [0,1,0,0,0,0|2,0,0]=3 298 B14R1.86 O=C(CCCCBr)NCc1cncs1 WXVL_AK0526SB3153 [0,1,0,0,0,0|2,1,0]=4 299 B14R1.86 O=C(CCCCBr)NCc1cncs1 WXVL_AK0526SB3153 [0,1,0,0,0,0|2,1,0]=4 300 B14R1.86 O=C(CCCCBr)NCc1cocn1 WXVL_AK00016SB3153 [0,1,0,0,0,0|3,0,0]=4 301 B14R1.86 O=C(CCCCBr)NCc1cocn1 WXVL_AK00016SB3153 [0,1,0,0,0,0|3,0,0]=4 302 B14R1.86 O=C(CCCCBr)NCc1cscn1 WXVL_AK0325SB3153 [0,1,0,0,0,0|3,0,0]=4 303 B14R1.86 O=C(CCCCBr)NCc1cscn1 WXVL_AK0325SB3153 [0,1,0,0,0,0|3,0,0]=4 304 B14R1.86 O=C(CCCCBr)NCc1nccs1 WXVL_AK0153SB3153 [0,1,0,0,0,0|2,1,0]=4 305 B14R1.86 O=C(CCCCBr)NCc1nccs1 WXVL_AK0153SB3153 [0,1,0,0,0,0|2,1,0]=4 306 B14R1.86 O=C(CCCCCl)NCc1cc[nH]n1 WXVL_AK00156SB0379 [0,1,0,0,0,0|3,0,0]=4 307 B14R1.86 O=C(CCCCCl)NCc1cc[nH]n1 WXVL_AK00156SB0379 [0,1,0,0,0,0|3,0,0]=4 308 B14R1.86 O=C(CCCCCl)NCc1ccc[nH]1 WXVL_AK00759SB0379 [0,1,0,0,0,0|2,0,0]=3 309 B14R1.86 O=C(CCCCCl)NCc1ccc[nH]1 WXVL_AK00759SB0379 [0,1,0,0,0,0|2,0,0]=3 310 B14R1.86 O=C(CCCCCl)NCc1ccco1 WXVL_AK0010SB0379 [0,1,0,0,0,0|1,0,0]=2 311 B14R1.86 O=C(CCCCCl)NCc1ccco1 WXVL_AK0010SB0379 [0,1,0,0,0,0|1,0,0]=2 312 B14R1.86 O=C(CCCCCl)NCc1cccs1 WXVL_AK0014SB0379 [0,1,0,0,0,0|1,1,0]=3 313 B14R1.86 O=C(CCCCCl)NCc1cccs1 WXVL_AK0014SB0379 [0,1,0,0,0,0|1,1,0]=3 314 B14R1.86 O=C(CCCCCl)NCc1ccn[nH]1 WXVL_AK0459SB0379 [0,1,0,0,0,0|3,0,0]=4 315 B14R1.86 O=C(CCCCCl)NCc1ccn[nH]1 WXVL_AK0459SB0379 [0,1,0,0,0,0|3,0,0]=4 316 B14R1.86 O=C(CCCCCl)NCc1ccoc1 WXVL_AK2033SB0379 [0,1,0,0,0,0|3,0,0]=4 317 B14R1.86 O=C(CCCCCl)NCc1ccoc1 WXVL_AK2033SB0379 [0,1,0,0,0,0|3,0,0]=4 318 B14R1.86 O=C(CCCCCl)NCc1ccsc1 WXVL_AK00174SB0379 [0,1,0,0,0,0|3,0,0]=4 319 B14R1.86 O=C(CCCCCl)NCc1ccsc1 WXVL_AK00174SB0379 [0,1,0,0,0,0|3,0,0]=4 320 B14R1.86 O=C(CCCCCl)NCc1cnc[nH]1 WXVL_AK00778SB0379 [0,1,0,0,0,0|3,0,0]=4 321 B14R1.86 O=C(CCCCCl)NCc1cnc[nH]1 WXVL_AK00778SB0379 [0,1,0,0,0,0|3,0,0]=4 322 B14R1.86 O=C(CCCCCl)NCc1cnco1 WXVL_AK1437SB0379 [0,1,0,0,0,0|2,0,0]=3 323 B14R1.86 O=C(CCCCCl)NCc1cnco1 WXVL_AK1437SB0379 [0,1,0,0,0,0|2,0,0]=3 324 B14R1.86 O=C(CCCCCl)NCc1cncs1 WXVL_AK0526SB0379 [0,1,0,0,0,0|2,1,0]=4 325 B14R1.86 O=C(CCCCCl)NCc1cncs1 WXVL_AK0526SB0379 [0,1,0,0,0,0|2,1,0]=4 326 B14R1.86 O=C(CCCCCl)NCc1cocn1 WXVL_AK00016SB0379 [0,1,0,0,0,0|3,0,0]=4 327 B14R1.86 O=C(CCCCCl)NCc1cocn1 WXVL_AK00016SB0379 [0,1,0,0,0,0|3,0,0]=4 328 B14R1.86 O=C(CCCCCl)NCc1cscn1 WXVL_AK0325SB0379 [0,1,0,0,0,0|3,0,0]=4 329 B14R1.86 O=C(CCCCCl)NCc1cscn1 WXVL_AK0325SB0379 [0,1,0,0,0,0|3,0,0]=4 330 B14R1.86 O=C(CCCCCl)NCc1nccs1 WXVL_AK0153SB0379 [0,1,0,0,0,0|2,1,0]=4 331 B14R1.86 O=C(CCCCCl)NCc1nccs1 WXVL_AK0153SB0379 [0,1,0,0,0,0|2,1,0]=4 332 B14R1.86 O=C(CCc1ccc[nH]1)NCCCO WXVL_AK0073SA0009 [0,1,0,0,0,0|3,0,0]=4 333 B14R1.86 O=C(CCc1ccc[nH]1)NCCCO WXVL_AK0073SA0009 [0,1,0,0,0,0|3,0,0]=4 334 B14R1.86 O=C(CCc1ccco1)NCCCO WXVL_AK0073SA0167 [0,1,0,0,0,0|2,0,0]=3 335 B14R1.86 O=C(CCc1ccco1)NCCCO WXVL_AK0073SA0167 [0,1,0,0,0,0|2,0,0]=3 336 B14R1.86 O=C(CCc1cccs1)NCCCO WXVL_AK0073SA0303 [0,1,0,0,0,0|2,1,0]=4 337 B14R1.86 O=C(CCc1cccs1)NCCCO WXVL_AK0073SA0303 [0,1,0,0,0,0|2,1,0]=4 338 B14R1.86 O=C(NCCCCl)NCc1ccc[nH]1 WXVL_AK00759YV0130 [0,1,0,0,0,0|3,0,0]=4 339 B14R1.86 O=C(NCCCCl)NCc1ccc[nH]1 WXVL_AK00759YV0130 [0,1,0,0,0,0|3,0,0]=4 340 B14R1.86 O=C(NCCCCl)NCc1ccco1 WXVL_AK0010YV0130 [0,1,0,0,0,0|2,0,0]=3 341 B14R1.86 O=C(NCCCCl)NCc1ccco1 WXVL_AK0010YV0130 [0,1,0,0,0,0|2,0,0]=3 342 B14R1.86 O=C(NCCCCl)NCc1cccs1 WXVL_AK0014YV0130 [0,1,0,0,0,0|2,1,0]=4 343 B14R1.86 O=C(NCCCCl)NCc1cccs1 WXVL_AK0014YV0130 [0,1,0,0,0,0|2,1,0]=4 344 B14R1.86 O=C(NCCCCl)NCc1cnco1 WXVL_AK1437YV0130 [0,1,0,0,0,0|3,0,0]=4 345 B14R1.86 O=C(NCCCCl)NCc1cnco1 WXVL_AK1437YV0130 [0,1,0,0,0,0|3,0,0]=4 346 B14R1.137 CCOCC(=O)NC(C)c1ccno1 WXVL_AK6536SB0091 [0,1,0,0,0,0|3,0,0]=4 347 B14R1.137 CCOCC(=O)NC(C)c1ccno1 WXVL_AK6536SB0091 [0,1,0,0,0,0|3,0,0]=4 348 B14R1.137 CCOCC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB0091 [0,1,0,0,0,0|2,1,0]=4 349 B14R1.137 CCOCC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB0091 [0,1,0,0,0,0|2,1,0]=4 350 B14R1.137 CCSCC(=O)NC(C)c1ccno1 WXVL_AK6536SB0002 [0,1,0,0,0,0|3,0,0]=4 351 B14R1.137 CCSCC(=O)NC(C)c1ccno1 WXVL_AK6536SB0002 [0,1,0,0,0,0|3,0,0]=4 352 B14R1.137 CCSCC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB0002 [0,1,0,0,0,0|2,1,0]=4 353 B14R1.137 CCSCC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB0002 [0,1,0,0,0,0|2,1,0]=4 354 B14R1.137 COCCC(=O)NC(C)c1ccno1 WXVL_AK6536SB0156 [0,1,0,0,0,0|3,0,0]=4 355 B14R1.137 COCCC(=O)NC(C)c1ccno1 WXVL_AK6536SB0156 [0,1,0,0,0,0|3,0,0]=4 356 B14R1.137 COCCC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB0156 [0,1,0,0,0,0|2,1,0]=4 357 B14R1.137 COCCC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB0156 [0,1,0,0,0,0|2,1,0]=4 358 B14R1.137 CSCCC(=O)NC(C)c1ccno1 WXVL_AK6536SB0361 [0,1,0,0,0,0|3,0,0]=4 359 B14R1.137 CSCCC(=O)NC(C)c1ccno1 WXVL_AK6536SB0361 [0,1,0,0,0,0|3,0,0]=4 360 B14R1.137 CSCCC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB0361 [0,1,0,0,0,0|2,1,0]=4 361 B14R1.137 CSCCC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB0361 [0,1,0,0,0,0|2,1,0]=4 362 B14R1.155 CCCNC(=O)CCc1cc(cs1)C WXVL_AK00504SA0123 [0,1,0,0,0,0|2,1,0]=4 363 B14R1.155 CCCNC(=O)CCc1cc(cs1)C WXVL_AK00504SA0123 [0,1,0,0,0,0|2,1,0]=4 364 B14R1.155 CCCNC(=O)CCc1ccc(s1)C WXVL_AK00504SA0110 [0,1,0,0,0,0|2,1,0]=4 365 B14R1.155 CCCNC(=O)CCc1ccc(s1)C WXVL_AK00504SA0110 [0,1,0,0,0,0|2,1,0]=4 366 B14R1.155 CCOCC(=O)NCc1cc(cs1)Br WXVL_AK00192SB0091 [0,1,0,0,0,0|2,1,0]=4 367 B14R1.155 CCOCC(=O)NCc1cc(cs1)Br WXVL_AK00192SB0091 [0,1,0,0,0,0|2,1,0]=4 368 B14R1.155 CCOCC(=O)NCc1cc(no1)Br WXVL_AK1427SB0091 [0,1,0,0,0,0|3,0,0]=4 369 B14R1.155 CCOCC(=O)NCc1cc(no1)Br WXVL_AK1427SB0091 [0,1,0,0,0,0|3,0,0]=4 370 B14R1.155 CCOCC(=O)NCc1cc(no1)C WXVL_AK1064SB0091 [0,1,0,0,0,0|3,0,0]=4 371 B14R1.155 CCOCC(=O)NCc1cc(no1)C WXVL_AK1064SB0091 [0,1,0,0,0,0|3,0,0]=4 372 B14R1.155 CCOCC(=O)NCc1ccc(s1)Br WXVL_AK2468SB0091 [0,1,0,0,0,0|2,1,0]=4 373 B14R1.155 CCOCC(=O)NCc1ccc(s1)Br WXVL_AK2468SB0091 [0,1,0,0,0,0|2,1,0]=4 374 B14R1.155 CCOCC(=O)NCc1ccc(s1)C WXVL_AK0276SB0091 [0,1,0,0,0,0|2,1,0]=4 375 B14R1.155 CCOCC(=O)NCc1ccc(s1)C WXVL_AK0276SB0091 [0,1,0,0,0,0|2,1,0]=4 376 B14R1.155 CCOCC(=O)NCc1ccc(s1)Cl WXVL_AK00166SB0091 [0,1,0,0,0,0|2,1,0]=4 377 B14R1.155 CCOCC(=O)NCc1ccc(s1)Cl WXVL_AK00166SB0091 [0,1,0,0,0,0|2,1,0]=4 378 B14R1.155 CCSCC(=O)NCc1cc(cs1)Br WXVL_AK00192SB0002 [0,1,0,0,0,0|2,1,0]=4 379 B14R1.155 CCSCC(=O)NCc1cc(cs1)Br WXVL_AK00192SB0002 [0,1,0,0,0,0|2,1,0]=4 380 B14R1.155 CCSCC(=O)NCc1cc(no1)Br WXVL_AK1427SB0002 [0,1,0,0,0,0|3,0,0]=4 381 B14R1.155 CCSCC(=O)NCc1cc(no1)Br WXVL_AK1427SB0002 [0,1,0,0,0,0|3,0,0]=4 382 B14R1.155 CCSCC(=O)NCc1cc(no1)C WXVL_AK1064SB0002 [0,1,0,0,0,0|3,0,0]=4 383 B14R1.155 CCSCC(=O)NCc1cc(no1)C WXVL_AK1064SB0002 [0,1,0,0,0,0|3,0,0]=4 384 B14R1.155 CCSCC(=O)NCc1ccc(s1)Br WXVL_AK2468SB0002 [0,1,0,0,0,0|2,1,0]=4 385 B14R1.155 CCSCC(=O)NCc1ccc(s1)Br WXVL_AK2468SB0002 [0,1,0,0,0,0|2,1,0]=4 386 B14R1.155 CCSCC(=O)NCc1ccc(s1)C WXVL_AK0276SB0002 [0,1,0,0,0,0|2,1,0]=4 387 B14R1.155 CCSCC(=O)NCc1ccc(s1)C WXVL_AK0276SB0002 [0,1,0,0,0,0|2,1,0]=4 388 B14R1.155 CCSCC(=O)NCc1ccc(s1)Cl WXVL_AK00166SB0002 [0,1,0,0,0,0|2,1,0]=4 389 B14R1.155 CCSCC(=O)NCc1ccc(s1)Cl WXVL_AK00166SB0002 [0,1,0,0,0,0|2,1,0]=4 390 B14R1.155 COCCC(=O)NCc1cc(cs1)Br WXVL_AK00192SB0156 [0,1,0,0,0,0|2,1,0]=4 391 B14R1.155 COCCC(=O)NCc1cc(cs1)Br WXVL_AK00192SB0156 [0,1,0,0,0,0|2,1,0]=4 392 B14R1.155 COCCC(=O)NCc1cc(no1)Br WXVL_AK1427SB0156 [0,1,0,0,0,0|3,0,0]=4 393 B14R1.155 COCCC(=O)NCc1cc(no1)Br WXVL_AK1427SB0156 [0,1,0,0,0,0|3,0,0]=4 394 B14R1.155 COCCC(=O)NCc1cc(no1)C WXVL_AK1064SB0156 [0,1,0,0,0,0|3,0,0]=4 395 B14R1.155 COCCC(=O)NCc1cc(no1)C WXVL_AK1064SB0156 [0,1,0,0,0,0|3,0,0]=4 396 B14R1.155 COCCC(=O)NCc1ccc(s1)Br WXVL_AK2468SB0156 [0,1,0,0,0,0|2,1,0]=4 397 B14R1.155 COCCC(=O)NCc1ccc(s1)Br WXVL_AK2468SB0156 [0,1,0,0,0,0|2,1,0]=4 398 B14R1.155 COCCC(=O)NCc1ccc(s1)C WXVL_AK0276SB0156 [0,1,0,0,0,0|2,1,0]=4 399 B14R1.155 COCCC(=O)NCc1ccc(s1)C WXVL_AK0276SB0156 [0,1,0,0,0,0|2,1,0]=4 400 B14R1.155 COCCC(=O)NCc1ccc(s1)Cl WXVL_AK00166SB0156 [0,1,0,0,0,0|2,1,0]=4 401 B14R1.155 COCCC(=O)NCc1ccc(s1)Cl WXVL_AK00166SB0156 [0,1,0,0,0,0|2,1,0]=4 402 B14R1.155 CSCCC(=O)NCc1cc(cs1)Br WXVL_AK00192SB0361 [0,1,0,0,0,0|2,1,0]=4 403 B14R1.155 CSCCC(=O)NCc1cc(cs1)Br WXVL_AK00192SB0361 [0,1,0,0,0,0|2,1,0]=4 404 B14R1.155 CSCCC(=O)NCc1cc(no1)Br WXVL_AK1427SB0361 [0,1,0,0,0,0|3,0,0]=4 405 B14R1.155 CSCCC(=O)NCc1cc(no1)Br WXVL_AK1427SB0361 [0,1,0,0,0,0|3,0,0]=4 406 B14R1.155 CSCCC(=O)NCc1cc(no1)C WXVL_AK1064SB0361 [0,1,0,0,0,0|3,0,0]=4 407 B14R1.155 CSCCC(=O)NCc1cc(no1)C WXVL_AK1064SB0361 [0,1,0,0,0,0|3,0,0]=4 408 B14R1.155 CSCCC(=O)NCc1ccc(s1)Br WXVL_AK2468SB0361 [0,1,0,0,0,0|2,1,0]=4 409 B14R1.155 CSCCC(=O)NCc1ccc(s1)Br WXVL_AK2468SB0361 [0,1,0,0,0,0|2,1,0]=4 410 B14R1.155 CSCCC(=O)NCc1ccc(s1)C WXVL_AK0276SB0361 [0,1,0,0,0,0|2,1,0]=4 411 B14R1.155 CSCCC(=O)NCc1ccc(s1)C WXVL_AK0276SB0361 [0,1,0,0,0,0|2,1,0]=4 412 B14R1.155 CSCCC(=O)NCc1ccc(s1)Cl WXVL_AK00166SB0361 [0,1,0,0,0,0|2,1,0]=4 413 B14R1.155 CSCCC(=O)NCc1ccc(s1)Cl WXVL_AK00166SB0361 [0,1,0,0,0,0|2,1,0]=4 414 B14R1.454 CC(Cc1ccco1)C(=O)NCCF WXVL_AK00466SA2637 [0,1,0,0,0,0|3,0,0]=4 415 B14R1.454 CC(Cc1ccco1)C(=O)NCCF WXVL_AK00466SA2637 [0,1,0,0,0,0|3,0,0]=4 416 B14R1.454 CCCNC(=O)C(C)Cc1ccco1 WXVL_AK00504SA2637 [0,1,0,0,0,0|2,0,0]=3 417 B14R1.454 CCCNC(=O)C(C)Cc1ccco1 WXVL_AK00504SA2637 [0,1,0,0,0,0|2,0,0]=3 418 B14R1.588 CCC(C)CC(=O)NCc1cc[nH]n1 WXVL_AK00156SB0353 [0,1,0,0,0,0|3,0,0]=4 419 B14R1.588 CCC(C)CC(=O)NCc1cc[nH]n1 WXVL_AK00156SB0353 [0,1,0,0,0,0|3,0,0]=4 420 B14R1.588 CCC(C)CC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0353 [0,1,0,0,0,0|2,0,0]=3 421 B14R1.588 CCC(C)CC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0353 [0,1,0,0,0,0|2,0,0]=3 422 B14R1.588 CCC(C)CC(=O)NCc1ccco1 WXVL_AK0010SB0353 [0,1,0,0,0,0|1,0,0]=2 423 B14R1.588 CCC(C)CC(=O)NCc1ccco1 WXVL_AK0010SB0353 [0,1,0,0,0,0|1,0,0]=2 424 B14R1.588 CCC(C)CC(=O)NCc1cccs1 WXVL_AK0014SB0353 [0,1,0,0,0,0|1,1,0]=3 425 B14R1.588 CCC(C)CC(=O)NCc1cccs1 WXVL_AK0014SB0353 [0,1,0,0,0,0|1,1,0]=3 426 B14R1.588 CCC(C)CC(=O)NCc1ccn[nH]1 WXVL_AK0459SB0353 [0,1,0,0,0,0|3,0,0]=4 427 B14R1.588 CCC(C)CC(=O)NCc1ccn[nH]1 WXVL_AK0459SB0353 [0,1,0,0,0,0|3,0,0]=4 428 B14R1.588 CCC(C)CC(=O)NCc1ccoc1 WXVL_AK2033SB0353 [0,1,0,0,0,0|3,0,0]=4 429 B14R1.588 CCC(C)CC(=O)NCc1ccoc1 WXVL_AK2033SB0353 [0,1,0,0,0,0|3,0,0]=4 430 B14R1.588 CCC(C)CC(=O)NCc1ccsc1 WXVL_AK00174SB0353 [0,1,0,0,0,0|3,0,0]=4 431 B14R1.588 CCC(C)CC(=O)NCc1ccsc1 WXVL_AK00174SB0353 [0,1,0,0,0,0|3,0,0]=4 432 B14R1.588 CCC(C)CC(=O)NCc1cnc[nH]1 WXVL_AK00778SB0353 [0,1,0,0,0,0|3,0,0]=4 433 B14R1.588 CCC(C)CC(=O)NCc1cnc[nH]1 WXVL_AK00778SB0353 [0,1,0,0,0,0|3,0,0]=4 434 B14R1.588 CCC(C)CC(=O)NCc1cnco1 WXVL_AK1437SB0353 [0,1,0,0,0,0|2,0,0]=3 435 B14R1.588 CCC(C)CC(=O)NCc1cnco1 WXVL_AK1437SB0353 [0,1,0,0,0,0|2,0,0]=3 436 B14R1.588 CCC(C)CC(=O)NCc1cncs1 WXVL_AK0526SB0353 [0,1,0,0,0,0|2,1,0]=4 437 B14R1.588 CCC(C)CC(=O)NCc1cncs1 WXVL_AK0526SB0353 [0,1,0,0,0,0|2,1,0]=4 438 B14R1.588 CCC(C)CC(=O)NCc1cocn1 WXVL_AK00016SB0353 [0,1,0,0,0,0|3,0,0]=4 439 B14R1.588 CCC(C)CC(=O)NCc1cocn1 WXVL_AK00016SB0353 [0,1,0,0,0,0|3,0,0]=4 440 B14R1.588 CCC(C)CC(=O)NCc1cscn1 WXVL_AK0325SB0353 [0,1,0,0,0,0|3,0,0]=4 441 B14R1.588 CCC(C)CC(=O)NCc1cscn1 WXVL_AK0325SB0353 [0,1,0,0,0,0|3,0,0]=4 442 B14R1.588 CCC(C)CC(=O)NCc1nccs1 WXVL_AK0153SB0353 [0,1,0,0,0,0|2,1,0]=4 443 B14R1.588 CCC(C)CC(=O)NCc1nccs1 WXVL_AK0153SB0353 [0,1,0,0,0,0|2,1,0]=4 444 B14R1.588 CCC(O)CC(=O)NCc1cc[nH]n1 WXVL_AK00156SB4092 [0,1,0,0,0,0|3,0,0]=4 445 B14R1.588 CCC(O)CC(=O)NCc1cc[nH]n1 WXVL_AK00156SB4092 [0,1,0,0,0,0|3,0,0]=4 446 B14R1.588 CCC(O)CC(=O)NCc1ccc[nH]1 WXVL_AK00759SB4092 [0,1,0,0,0,0|2,0,0]=3 447 B14R1.588 CCC(O)CC(=O)NCc1ccc[nH]1 WXVL_AK00759SB4092 [0,1,0,0,0,0|2,0,0]=3 448 B14R1.588 CCC(O)CC(=O)NCc1ccco1 WXVL_AK0010SB4092 [0,1,0,0,0,0|1,0,0]=2 449 B14R1.588 CCC(O)CC(=O)NCc1ccco1 WXVL_AK0010SB4092 [0,1,0,0,0,0|1,0,0]=2 450 B14R1.588 CCC(O)CC(=O)NCc1cccs1 WXVL_AK0014SB4092 [0,1,0,0,0,0|1,1,0]=3 451 B14R1.588 CCC(O)CC(=O)NCc1cccs1 WXVL_AK0014SB4092 [0,1,0,0,0,0|1,1,0]=3 452 B14R1.588 CCC(O)CC(=O)NCc1ccn[nH]1 WXVL_AK0459SB4092 [0,1,0,0,0,0|3,0,0]=4 453 B14R1.588 CCC(O)CC(=O)NCc1ccn[nH]1 WXVL_AK0459SB4092 [0,1,0,0,0,0|3,0,0]=4 454 B14R1.588 CCC(O)CC(=O)NCc1ccoc1 WXVL_AK2033SB4092 [0,1,0,0,0,0|3,0,0]=4 455 B14R1.588 CCC(O)CC(=O)NCc1ccoc1 WXVL_AK2033SB4092 [0,1,0,0,0,0|3,0,0]=4 456 B14R1.588 CCC(O)CC(=O)NCc1ccsc1 WXVL_AK00174SB4092 [0,1,0,0,0,0|3,0,0]=4 457 B14R1.588 CCC(O)CC(=O)NCc1ccsc1 WXVL_AK00174SB4092 [0,1,0,0,0,0|3,0,0]=4 458 B14R1.588 CCC(O)CC(=O)NCc1cnc[nH]1 WXVL_AK00778SB4092 [0,1,0,0,0,0|3,0,0]=4 459 B14R1.588 CCC(O)CC(=O)NCc1cnc[nH]1 WXVL_AK00778SB4092 [0,1,0,0,0,0|3,0,0]=4 460 B14R1.588 CCC(O)CC(=O)NCc1cnco1 WXVL_AK1437SB4092 [0,1,0,0,0,0|2,0,0]=3 461 B14R1.588 CCC(O)CC(=O)NCc1cnco1 WXVL_AK1437SB4092 [0,1,0,0,0,0|2,0,0]=3 462 B14R1.588 CCC(O)CC(=O)NCc1cncs1 WXVL_AK0526SB4092 [0,1,0,0,0,0|2,1,0]=4 463 B14R1.588 CCC(O)CC(=O)NCc1cncs1 WXVL_AK0526SB4092 [0,1,0,0,0,0|2,1,0]=4 464 B14R1.588 CCC(O)CC(=O)NCc1cocn1 WXVL_AK00016SB4092 [0,1,0,0,0,0|3,0,0]=4 465 B14R1.588 CCC(O)CC(=O)NCc1cocn1 WXVL_AK00016SB4092 [0,1,0,0,0,0|3,0,0]=4 466 B14R1.588 CCC(O)CC(=O)NCc1cscn1 WXVL_AK0325SB4092 [0,1,0,0,0,0|3,0,0]=4 467 B14R1.588 CCC(O)CC(=O)NCc1cscn1 WXVL_AK0325SB4092 [0,1,0,0,0,0|3,0,0]=4 468 B14R1.588 CCC(O)CC(=O)NCc1nccs1 WXVL_AK0153SB4092 [0,1,0,0,0,0|2,1,0]=4 469 B14R1.588 CCC(O)CC(=O)NCc1nccs1 WXVL_AK0153SB4092 [0,1,0,0,0,0|2,1,0]=4 470 B14R1.588 CC[C@@H](C)CC(=O)NCc1cc[nH]n1 WXVL_AK00156SB8650 [0,1,0,0,0,0|3,0,0]=4 471 B14R1.588 CC[C@@H](C)CC(=O)NCc1cc[nH]n1 WXVL_AK00156SB8650 [0,1,0,0,0,0|3,0,0]=4 472 B14R1.588 CC[C@@H](C)CC(=O)NCc1ccc[nH]1 WXVL_AK00759SB8650 [0,1,0,0,0,0|2,0,0]=3 473 B14R1.588 CC[C@@H](C)CC(=O)NCc1ccc[nH]1 WXVL_AK00759SB8650 [0,1,0,0,0,0|2,0,0]=3 474 B14R1.588 CC[C@@H](C)CC(=O)NCc1ccco1 WXVL_AK0010SB8650 [0,1,0,0,0,0|1,0,0]=2 475 B14R1.588 CC[C@@H](C)CC(=O)NCc1ccco1 WXVL_AK0010SB8650 [0,1,0,0,0,0|1,0,0]=2 476 B14R1.588 CC[C@@H](C)CC(=O)NCc1cccs1 WXVL_AK0014SB8650 [0,1,0,0,0,0|1,1,0]=3 477 B14R1.588 CC[C@@H](C)CC(=O)NCc1cccs1 WXVL_AK0014SB8650 [0,1,0,0,0,0|1,1,0]=3 478 B14R1.588 CC[C@@H](C)CC(=O)NCc1ccn[nH]1 WXVL_AK0459SB8650 [0,1,0,0,0,0|3,0,0]=4 479 B14R1.588 CC[C@@H](C)CC(=O)NCc1ccn[nH]1 WXVL_AK0459SB8650 [0,1,0,0,0,0|3,0,0]=4 480 B14R1.588 CC[C@@H](C)CC(=O)NCc1ccoc1 WXVL_AK2033SB8650 [0,1,0,0,0,0|3,0,0]=4 481 B14R1.588 CC[C@@H](C)CC(=O)NCc1ccoc1 WXVL_AK2033SB8650 [0,1,0,0,0,0|3,0,0]=4 482 B14R1.588 CC[C@@H](C)CC(=O)NCc1ccsc1 WXVL_AK00174SB8650 [0,1,0,0,0,0|3,0,0]=4 483 B14R1.588 CC[C@@H](C)CC(=O)NCc1ccsc1 WXVL_AK00174SB8650 [0,1,0,0,0,0|3,0,0]=4 484 B14R1.588 CC[C@@H](C)CC(=O)NCc1cnc[nH]1 WXVL_AK00778SB8650 [0,1,0,0,0,0|3,0,0]=4 485 B14R1.588 CC[C@@H](C)CC(=O)NCc1cnc[nH]1 WXVL_AK00778SB8650 [0,1,0,0,0,0|3,0,0]=4 486 B14R1.588 CC[C@@H](C)CC(=O)NCc1cnco1 WXVL_AK1437SB8650 [0,1,0,0,0,0|2,0,0]=3 487 B14R1.588 CC[C@@H](C)CC(=O)NCc1cnco1 WXVL_AK1437SB8650 [0,1,0,0,0,0|2,0,0]=3 488 B14R1.588 CC[C@@H](C)CC(=O)NCc1cncs1 WXVL_AK0526SB8650 [0,1,0,0,0,0|2,1,0]=4 489 B14R1.588 CC[C@@H](C)CC(=O)NCc1cncs1 WXVL_AK0526SB8650 [0,1,0,0,0,0|2,1,0]=4 490 B14R1.588 CC[C@@H](C)CC(=O)NCc1cocn1 WXVL_AK00016SB8650 [0,1,0,0,0,0|3,0,0]=4 491 B14R1.588 CC[C@@H](C)CC(=O)NCc1cocn1 WXVL_AK00016SB8650 [0,1,0,0,0,0|3,0,0]=4 492 B14R1.588 CC[C@@H](C)CC(=O)NCc1cscn1 WXVL_AK0325SB8650 [0,1,0,0,0,0|3,0,0]=4 493 B14R1.588 CC[C@@H](C)CC(=O)NCc1cscn1 WXVL_AK0325SB8650 [0,1,0,0,0,0|3,0,0]=4 494 B14R1.588 CC[C@@H](C)CC(=O)NCc1nccs1 WXVL_AK0153SB8650 [0,1,0,0,0,0|2,1,0]=4 495 B14R1.588 CC[C@@H](C)CC(=O)NCc1nccs1 WXVL_AK0153SB8650 [0,1,0,0,0,0|2,1,0]=4 496 B14R1.588 CC[C@H](C)NC(=O)/C=C/c1ccco1 WXVL_AK00678SA0180 [0,1,0,0,0,0|2,0,1]=4 497 B14R1.588 CC[C@H](C)NC(=O)/C=C/c1ccco1 WXVL_AK00678SA0180 [0,1,0,0,0,0|2,0,1]=4 498 B14R1.588 CC[C@H](C)NC(=O)CCc1ccc[nH]1 WXVL_AK00678SA0009 [0,1,0,0,0,0|3,0,0]=4 499 B14R1.588 CC[C@H](C)NC(=O)CCc1ccc[nH]1 WXVL_AK00678SA0009 [0,1,0,0,0,0|3,0,0]=4 500 B14R1.588 CC[C@H](C)NC(=O)CCc1ccco1 WXVL_AK00678SA0167 [0,1,0,0,0,0|2,0,0]=3 501 B14R1.588 CC[C@H](C)NC(=O)CCc1ccco1 WXVL_AK00678SA0167 [0,1,0,0,0,0|2,0,0]=3 502 B14R1.588 CC[C@H](C)NC(=O)CCc1cccs1 WXVL_AK00678SA0303 [0,1,0,0,0,0|2,1,0]=4 503 B14R1.588 CC[C@H](C)NC(=O)CCc1cccs1 WXVL_AK00678SA0303 [0,1,0,0,0,0|2,1,0]=4 504 B14R1.588 COC(=O)CC(=O)NCc1ccco1 WXVL_AK0010SB2790 [0,1,0,0,0,0|2,0,1]=4 505 B14R1.588 COC(=O)CC(=O)NCc1ccco1 WXVL_AK0010SB2790 [0,1,0,0,0,0|2,0,1]=4 506 B14R1.588 C[C@@H](CF)NC(=O)CCc1ccco1 WXVL_AK00558SA0167 [0,1,0,0,0,0|3,0,0]=4 507 B14R1.588 C[C@@H](CF)NC(=O)CCc1ccco1 WXVL_AK00558SA0167 [0,1,0,0,0,0|3,0,0]=4 508 B14R1.588 C[C@@H](CO)NC(=O)CCc1ccco1 WXVL_AK0109SA0167 [0,1,0,0,0,0|3,0,0]=4 509 B14R1.588 C[C@@H](CO)NC(=O)CCc1ccco1 WXVL_AK0109SA0167 [0,1,0,0,0,0|3,0,0]=4 510 B14R1.633 CC/C=C(\C)/C(=O)NCc1ccco1 WXVL_AK0010SB0037 [0,1,0,0,0,0|1,0,2]=4 511 B14R1.633 CC/C=C(\C)/C(=O)NCc1ccco1 WXVL_AK0010SB0037 [0,1,0,0,0,0|1,0,2]=4 512 B14R1.633 CCCC(C)C(=O)NCc1cc[nH]n1 WXVL_AK00156SB0352 [0,1,0,0,0,0|3,0,0]=4 513 B14R1.633 CCCC(C)C(=O)NCc1cc[nH]n1 WXVL_AK00156SB0352 [0,1,0,0,0,0|3,0,0]=4 514 B14R1.633 CCCC(C)C(=O)NCc1ccc[nH]1 WXVL_AK00759SB0352 [0,1,0,0,0,0|2,0,0]=3 515 B14R1.633 CCCC(C)C(=O)NCc1ccc[nH]1 WXVL_AK00759SB0352 [0,1,0,0,0,0|2,0,0]=3 516 B14R1.633 CCCC(C)C(=O)NCc1ccco1 WXVL_AK0010SB0352 [0,1,0,0,0,0|1,0,0]=2 517 B14R1.633 CCCC(C)C(=O)NCc1ccco1 WXVL_AK0010SB0352 [0,1,0,0,0,0|1,0,0]=2 518 B14R1.633 CCCC(C)C(=O)NCc1cccs1 WXVL_AK0014SB0352 [0,1,0,0,0,0|1,1,0]=3 519 B14R1.633 CCCC(C)C(=O)NCc1cccs1 WXVL_AK0014SB0352 [0,1,0,0,0,0|1,1,0]=3 520 B14R1.633 CCCC(C)C(=O)NCc1ccn[nH]1 WXVL_AK0459SB0352 [0,1,0,0,0,0|3,0,0]=4 521 B14R1.633 CCCC(C)C(=O)NCc1ccn[nH]1 WXVL_AK0459SB0352 [0,1,0,0,0,0|3,0,0]=4 522 B14R1.633 CCCC(C)C(=O)NCc1ccoc1 WXVL_AK2033SB0352 [0,1,0,0,0,0|3,0,0]=4 523 B14R1.633 CCCC(C)C(=O)NCc1ccoc1 WXVL_AK2033SB0352 [0,1,0,0,0,0|3,0,0]=4 524 B14R1.633 CCCC(C)C(=O)NCc1ccsc1 WXVL_AK00174SB0352 [0,1,0,0,0,0|3,0,0]=4 525 B14R1.633 CCCC(C)C(=O)NCc1ccsc1 WXVL_AK00174SB0352 [0,1,0,0,0,0|3,0,0]=4 526 B14R1.633 CCCC(C)C(=O)NCc1cnc[nH]1 WXVL_AK00778SB0352 [0,1,0,0,0,0|3,0,0]=4 527 B14R1.633 CCCC(C)C(=O)NCc1cnc[nH]1 WXVL_AK00778SB0352 [0,1,0,0,0,0|3,0,0]=4 528 B14R1.633 CCCC(C)C(=O)NCc1cnco1 WXVL_AK1437SB0352 [0,1,0,0,0,0|2,0,0]=3 529 B14R1.633 CCCC(C)C(=O)NCc1cnco1 WXVL_AK1437SB0352 [0,1,0,0,0,0|2,0,0]=3 530 B14R1.633 CCCC(C)C(=O)NCc1cncs1 WXVL_AK0526SB0352 [0,1,0,0,0,0|2,1,0]=4 531 B14R1.633 CCCC(C)C(=O)NCc1cncs1 WXVL_AK0526SB0352 [0,1,0,0,0,0|2,1,0]=4 532 B14R1.633 CCCC(C)C(=O)NCc1cocn1 WXVL_AK00016SB0352 [0,1,0,0,0,0|3,0,0]=4 533 B14R1.633 CCCC(C)C(=O)NCc1cocn1 WXVL_AK00016SB0352 [0,1,0,0,0,0|3,0,0]=4 534 B14R1.633 CCCC(C)C(=O)NCc1cscn1 WXVL_AK0325SB0352 [0,1,0,0,0,0|3,0,0]=4 535 B14R1.633 CCCC(C)C(=O)NCc1cscn1 WXVL_AK0325SB0352 [0,1,0,0,0,0|3,0,0]=4 536 B14R1.633 CCCC(C)C(=O)NCc1nccs1 WXVL_AK0153SB0352 [0,1,0,0,0,0|2,1,0]=4 537 B14R1.633 CCCC(C)C(=O)NCc1nccs1 WXVL_AK0153SB0352 [0,1,0,0,0,0|2,1,0]=4 538 B14R1.633 CCC[C@H](O)C(=O)NCc1cc[nH]n1 WXVL_AK00156SB3627 [0,1,0,0,0,0|3,0,0]=4 539 B14R1.633 CCC[C@H](O)C(=O)NCc1cc[nH]n1 WXVL_AK00156SB3627 [0,1,0,0,0,0|3,0,0]=4 540 B14R1.633 CCC[C@H](O)C(=O)NCc1ccc[nH]1 WXVL_AK00759SB3627 [0,1,0,0,0,0|2,0,0]=3 541 B14R1.633 CCC[C@H](O)C(=O)NCc1ccc[nH]1 WXVL_AK00759SB3627 [0,1,0,0,0,0|2,0,0]=3 542 B14R1.633 CCC[C@H](O)C(=O)NCc1ccco1 WXVL_AK0010SB3627 [0,1,0,0,0,0|1,0,0]=2 543 B14R1.633 CCC[C@H](O)C(=O)NCc1ccco1 WXVL_AK0010SB3627 [0,1,0,0,0,0|1,0,0]=2 544 B14R1.633 CCC[C@H](O)C(=O)NCc1cccs1 WXVL_AK0014SB3627 [0,1,0,0,0,0|1,1,0]=3 545 B14R1.633 CCC[C@H](O)C(=O)NCc1cccs1 WXVL_AK0014SB3627 [0,1,0,0,0,0|1,1,0]=3 546 B14R1.633 CCC[C@H](O)C(=O)NCc1ccn[nH]1 WXVL_AK0459SB3627 [0,1,0,0,0,0|3,0,0]=4 547 B14R1.633 CCC[C@H](O)C(=O)NCc1ccn[nH]1 WXVL_AK0459SB3627 [0,1,0,0,0,0|3,0,0]=4 548 B14R1.633 CCC[C@H](O)C(=O)NCc1ccoc1 WXVL_AK2033SB3627 [0,1,0,0,0,0|3,0,0]=4 549 B14R1.633 CCC[C@H](O)C(=O)NCc1ccoc1 WXVL_AK2033SB3627 [0,1,0,0,0,0|3,0,0]=4 550 B14R1.633 CCC[C@H](O)C(=O)NCc1ccsc1 WXVL_AK00174SB3627 [0,1,0,0,0,0|3,0,0]=4 551 B14R1.633 CCC[C@H](O)C(=O)NCc1ccsc1 WXVL_AK00174SB3627 [0,1,0,0,0,0|3,0,0]=4 552 B14R1.633 CCC[C@H](O)C(=O)NCc1cnc[nH]1 WXVL_AK00778SB3627 [0,1,0,0,0,0|3,0,0]=4 553 B14R1.633 CCC[C@H](O)C(=O)NCc1cnc[nH]1 WXVL_AK00778SB3627 [0,1,0,0,0,0|3,0,0]=4 554 B14R1.633 CCC[C@H](O)C(=O)NCc1cnco1 WXVL_AK1437SB3627 [0,1,0,0,0,0|2,0,0]=3 555 B14R1.633 CCC[C@H](O)C(=O)NCc1cnco1 WXVL_AK1437SB3627 [0,1,0,0,0,0|2,0,0]=3 556 B14R1.633 CCC[C@H](O)C(=O)NCc1cncs1 WXVL_AK0526SB3627 [0,1,0,0,0,0|2,1,0]=4 557 B14R1.633 CCC[C@H](O)C(=O)NCc1cncs1 WXVL_AK0526SB3627 [0,1,0,0,0,0|2,1,0]=4 558 B14R1.633 CCC[C@H](O)C(=O)NCc1cocn1 WXVL_AK00016SB3627 [0,1,0,0,0,0|3,0,0]=4 559 B14R1.633 CCC[C@H](O)C(=O)NCc1cocn1 WXVL_AK00016SB3627 [0,1,0,0,0,0|3,0,0]=4 560 B14R1.633 CCC[C@H](O)C(=O)NCc1cscn1 WXVL_AK0325SB3627 [0,1,0,0,0,0|3,0,0]=4 561 B14R1.633 CCC[C@H](O)C(=O)NCc1cscn1 WXVL_AK0325SB3627 [0,1,0,0,0,0|3,0,0]=4 562 B14R1.633 CCC[C@H](O)C(=O)NCc1nccs1 WXVL_AK0153SB3627 [0,1,0,0,0,0|2,1,0]=4 563 B14R1.633 CCC[C@H](O)C(=O)NCc1nccs1 WXVL_AK0153SB3627 [0,1,0,0,0,0|2,1,0]=4 564 B14R1.633 CCOC(=O)C(=O)NCc1ccco1 WXVL_AK0010SB4144 [0,1,0,0,0,0|2,0,1]=4 565 B14R1.633 CCOC(=O)C(=O)NCc1ccco1 WXVL_AK0010SB4144 [0,1,0,0,0,0|2,0,1]=4 566 B14R1.633 CN(CCO)C(=O)CCc1ccco1 WXVL_AN2670SA0167 [0,1,0,0,0,0|3,0,0]=4 567 B14R1.633 CN(CCO)C(=O)CCc1ccco1 WXVL_AN2670SA0167 [0,1,0,0,0,0|3,0,0]=4 568 B14R1.916 CCOCC(=O)NCc1cccn1C WXVL_AK0499SB0091 [0,1,0,0,0,0|3,0,0]=4 569 B14R1.916 CCOCC(=O)NCc1cccn1C WXVL_AK0499SB0091 [0,1,0,0,0,0|3,0,0]=4 570 B14R1.916 CCOCC(=O)NCc1sccc1Cl WXVL_AK4332SB0091 [0,1,0,0,0,0|2,1,0]=4 571 B14R1.916 CCOCC(=O)NCc1sccc1Cl WXVL_AK4332SB0091 [0,1,0,0,0,0|2,1,0]=4 572 B14R1.916 CCSCC(=O)NCc1cccn1C WXVL_AK0499SB0002 [0,1,0,0,0,0|3,0,0]=4 573 B14R1.916 CCSCC(=O)NCc1cccn1C WXVL_AK0499SB0002 [0,1,0,0,0,0|3,0,0]=4 574 B14R1.916 CCSCC(=O)NCc1sccc1Cl WXVL_AK4332SB0002 [0,1,0,0,0,0|2,1,0]=4 575 B14R1.916 CCSCC(=O)NCc1sccc1Cl WXVL_AK4332SB0002 [0,1,0,0,0,0|2,1,0]=4 576 B14R1.916 COCCC(=O)NCc1cccn1C WXVL_AK0499SB0156 [0,1,0,0,0,0|3,0,0]=4 577 B14R1.916 COCCC(=O)NCc1cccn1C WXVL_AK0499SB0156 [0,1,0,0,0,0|3,0,0]=4 578 B14R1.916 COCCC(=O)NCc1sccc1Cl WXVL_AK4332SB0156 [0,1,0,0,0,0|2,1,0]=4 579 B14R1.916 COCCC(=O)NCc1sccc1Cl WXVL_AK4332SB0156 [0,1,0,0,0,0|2,1,0]=4 580 B14R1.916 CSCCC(=O)NCc1cccn1C WXVL_AK0499SB0361 [0,1,0,0,0,0|3,0,0]=4 581 B14R1.916 CSCCC(=O)NCc1cccn1C WXVL_AK0499SB0361 [0,1,0,0,0,0|3,0,0]=4 582 B14R1.916 CSCCC(=O)NCc1sccc1Cl WXVL_AK4332SB0361 [0,1,0,0,0,0|2,1,0]=4 583 B14R1.916 CSCCC(=O)NCc1sccc1Cl WXVL_AK4332SB0361 [0,1,0,0,0,0|2,1,0]=4 584 B14R1.4526 C=C(C)CNC(=O)CCc1ccco1 WXVL_AK0761SA0167 [0,1,0,0,0,0|2,0,1]=4 585 B14R1.4526 C=C(C)CNC(=O)CCc1ccco1 WXVL_AK0761SA0167 [0,1,0,0,0,0|2,0,1]=4 586 B14R1.4526 CC(=O)CCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0072 [0,1,0,0,0,0|2,0,1]=4 587 B14R1.4526 CC(=O)CCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0072 [0,1,0,0,0,0|2,0,1]=4 588 B14R1.4526 CC(=O)CCC(=O)NCc1ccco1 WXVL_AK0010SB0072 [0,1,0,0,0,0|1,0,1]=3 589 B14R1.4526 CC(=O)CCC(=O)NCc1ccco1 WXVL_AK0010SB0072 [0,1,0,0,0,0|1,0,1]=3 590 B14R1.4526 CC(=O)CCC(=O)NCc1cccs1 WXVL_AK0014SB0072 [0,1,0,0,0,0|1,1,1]=4 591 B14R1.4526 CC(=O)CCC(=O)NCc1cccs1 WXVL_AK0014SB0072 [0,1,0,0,0,0|1,1,1]=4 592 B14R1.4526 CC(=O)CCC(=O)NCc1cnco1 WXVL_AK1437SB0072 [0,1,0,0,0,0|2,0,1]=4 593 B14R1.4526 CC(=O)CCC(=O)NCc1cnco1 WXVL_AK1437SB0072 [0,1,0,0,0,0|2,0,1]=4 594 B14R1.4526 CC(=O)NCC(=O)NCc1ccco1 WXVL_AK0010SB0357 [0,1,0,0,0,0|2,0,1]=4 595 B14R1.4526 CC(=O)NCC(=O)NCc1ccco1 WXVL_AK0010SB0357 [0,1,0,0,0,0|2,0,1]=4 596 B14R1.4526 CC(=O)OCC(=O)NCc1ccco1 WXVL_AK0010SB2824 [0,1,0,0,0,0|2,0,1]=4 597 B14R1.4526 CC(=O)OCC(=O)NCc1ccco1 WXVL_AK0010SB2824 [0,1,0,0,0,0|2,0,1]=4 598 B14R1.4526 CC(=O)SCC(=O)NCc1ccco1 WXVL_AK0010SB3992 [0,1,0,0,0,0|2,0,1]=4 599 B14R1.4526 CC(=O)SCC(=O)NCc1ccco1 WXVL_AK0010SB3992 [0,1,0,0,0,0|2,0,1]=4 600 B14R1.4526 CC(C)/C=C/C(=O)NCc1ccco1 WXVL_AK0010SB0036 [0,1,0,0,0,0|1,0,2]=4 601 B14R1.4526 CC(C)/C=C/C(=O)NCc1ccco1 WXVL_AK0010SB0036 [0,1,0,0,0,0|1,0,2]=4 602 B14R1.4526 CC(C)CCC(=O)NCc1cc[nH]n1 WXVL_AK00156SB0354 [0,1,0,0,0,0|3,0,0]=4 603 B14R1.4526 CC(C)CCC(=O)NCc1cc[nH]n1 WXVL_AK00156SB0354 [0,1,0,0,0,0|3,0,0]=4 604 B14R1.4526 CC(C)CCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0354 [0,1,0,0,0,0|2,0,0]=3 605 B14R1.4526 CC(C)CCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0354 [0,1,0,0,0,0|2,0,0]=3 606 B14R1.4526 CC(C)CCC(=O)NCc1ccco1 WXVL_AK0010SB0354 [0,1,0,0,0,0|1,0,0]=2 607 B14R1.4526 CC(C)CCC(=O)NCc1ccco1 WXVL_AK0010SB0354 [0,1,0,0,0,0|1,0,0]=2 608 B14R1.4526 CC(C)CCC(=O)NCc1cccs1 WXVL_AK0014SB0354 [0,1,0,0,0,0|1,1,0]=3 609 B14R1.4526 CC(C)CCC(=O)NCc1cccs1 WXVL_AK0014SB0354 [0,1,0,0,0,0|1,1,0]=3 610 B14R1.4526 CC(C)CCC(=O)NCc1ccn[nH]1 WXVL_AK0459SB0354 [0,1,0,0,0,0|3,0,0]=4 611 B14R1.4526 CC(C)CCC(=O)NCc1ccn[nH]1 WXVL_AK0459SB0354 [0,1,0,0,0,0|3,0,0]=4 612 B14R1.4526 CC(C)CCC(=O)NCc1ccoc1 WXVL_AK2033SB0354 [0,1,0,0,0,0|3,0,0]=4 613 B14R1.4526 CC(C)CCC(=O)NCc1ccoc1 WXVL_AK2033SB0354 [0,1,0,0,0,0|3,0,0]=4 614 B14R1.4526 CC(C)CCC(=O)NCc1ccsc1 WXVL_AK00174SB0354 [0,1,0,0,0,0|3,0,0]=4 615 B14R1.4526 CC(C)CCC(=O)NCc1ccsc1 WXVL_AK00174SB0354 [0,1,0,0,0,0|3,0,0]=4 616 B14R1.4526 CC(C)CCC(=O)NCc1cnc[nH]1 WXVL_AK00778SB0354 [0,1,0,0,0,0|3,0,0]=4 617 B14R1.4526 CC(C)CCC(=O)NCc1cnc[nH]1 WXVL_AK00778SB0354 [0,1,0,0,0,0|3,0,0]=4 618 B14R1.4526 CC(C)CCC(=O)NCc1cnco1 WXVL_AK1437SB0354 [0,1,0,0,0,0|2,0,0]=3 619 B14R1.4526 CC(C)CCC(=O)NCc1cnco1 WXVL_AK1437SB0354 [0,1,0,0,0,0|2,0,0]=3 620 B14R1.4526 CC(C)CCC(=O)NCc1cncs1 WXVL_AK0526SB0354 [0,1,0,0,0,0|2,1,0]=4 621 B14R1.4526 CC(C)CCC(=O)NCc1cncs1 WXVL_AK0526SB0354 [0,1,0,0,0,0|2,1,0]=4 622 B14R1.4526 CC(C)CCC(=O)NCc1cocn1 WXVL_AK00016SB0354 [0,1,0,0,0,0|3,0,0]=4 623 B14R1.4526 CC(C)CCC(=O)NCc1cocn1 WXVL_AK00016SB0354 [0,1,0,0,0,0|3,0,0]=4 624 B14R1.4526 CC(C)CCC(=O)NCc1cscn1 WXVL_AK0325SB0354 [0,1,0,0,0,0|3,0,0]=4 625 B14R1.4526 CC(C)CCC(=O)NCc1cscn1 WXVL_AK0325SB0354 [0,1,0,0,0,0|3,0,0]=4 626 B14R1.4526 CC(C)CCC(=O)NCc1nccs1 WXVL_AK0153SB0354 [0,1,0,0,0,0|2,1,0]=4 627 B14R1.4526 CC(C)CCC(=O)NCc1nccs1 WXVL_AK0153SB0354 [0,1,0,0,0,0|2,1,0]=4 628 B14R1.4526 CC(C)CNC(=O)/C=C/c1ccco1 WXVL_AK00544SA0180 [0,1,0,0,0,0|2,0,1]=4 629 B14R1.4526 CC(C)CNC(=O)/C=C/c1ccco1 WXVL_AK00544SA0180 [0,1,0,0,0,0|2,0,1]=4 630 B14R1.4526 CC(C)CNC(=O)CCc1ccc[nH]1 WXVL_AK00544SA0009 [0,1,0,0,0,0|3,0,0]=4 631 B14R1.4526 CC(C)CNC(=O)CCc1ccc[nH]1 WXVL_AK00544SA0009 [0,1,0,0,0,0|3,0,0]=4 632 B14R1.4526 CC(C)CNC(=O)CCc1ccco1 WXVL_AK00544SA0167 [0,1,0,0,0,0|2,0,0]=3 633 B14R1.4526 CC(C)CNC(=O)CCc1ccco1 WXVL_AK00544SA0167 [0,1,0,0,0,0|2,0,0]=3 634 B14R1.4526 CC(C)CNC(=O)CCc1cccs1 WXVL_AK00544SA0303 [0,1,0,0,0,0|2,1,0]=4 635 B14R1.4526 CC(C)CNC(=O)CCc1cccs1 WXVL_AK00544SA0303 [0,1,0,0,0,0|2,1,0]=4 636 B14R1.4526 CC(C)OCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0213 [0,1,0,0,0,0|3,0,0]=4 637 B14R1.4526 CC(C)OCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0213 [0,1,0,0,0,0|3,0,0]=4 638 B14R1.4526 CC(C)OCC(=O)NCc1ccco1 WXVL_AK0010SB0213 [0,1,0,0,0,0|2,0,0]=3 639 B14R1.4526 CC(C)OCC(=O)NCc1ccco1 WXVL_AK0010SB0213 [0,1,0,0,0,0|2,0,0]=3 640 B14R1.4526 CC(C)OCC(=O)NCc1cccs1 WXVL_AK0014SB0213 [0,1,0,0,0,0|2,1,0]=4 641 B14R1.4526 CC(C)OCC(=O)NCc1cccs1 WXVL_AK0014SB0213 [0,1,0,0,0,0|2,1,0]=4 642 B14R1.4526 CC(C)OCC(=O)NCc1cnco1 WXVL_AK1437SB0213 [0,1,0,0,0,0|3,0,0]=4 643 B14R1.4526 CC(C)OCC(=O)NCc1cnco1 WXVL_AK1437SB0213 [0,1,0,0,0,0|3,0,0]=4 644 B14R1.4526 CC(O)CNC(=O)/C=C/c1ccco1 WXVL_AK0052SA0180 [0,1,0,0,0,0|2,0,1]=4 645 B14R1.4526 CC(O)CNC(=O)/C=C/c1ccco1 WXVL_AK0052SA0180 [0,1,0,0,0,0|2,0,1]=4 646 B14R1.4526 CC(O)CNC(=O)CCc1ccc[nH]1 WXVL_AK0052SA0009 [0,1,0,0,0,0|3,0,0]=4 647 B14R1.4526 CC(O)CNC(=O)CCc1ccc[nH]1 WXVL_AK0052SA0009 [0,1,0,0,0,0|3,0,0]=4 648 B14R1.4526 CC(O)CNC(=O)CCc1ccco1 WXVL_AK0052SA0167 [0,1,0,0,0,0|2,0,0]=3 649 B14R1.4526 CC(O)CNC(=O)CCc1ccco1 WXVL_AK0052SA0167 [0,1,0,0,0,0|2,0,0]=3 650 B14R1.4526 CC(O)CNC(=O)CCc1cccs1 WXVL_AK0052SA0303 [0,1,0,0,0,0|2,1,0]=4 651 B14R1.4526 CC(O)CNC(=O)CCc1cccs1 WXVL_AK0052SA0303 [0,1,0,0,0,0|2,1,0]=4 652 B14R1.4526 CN(C)CCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB00052 [0,1,0,0,0,0|3,0,0]=4 653 B14R1.4526 CN(C)CCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB00052 [0,1,0,0,0,0|3,0,0]=4 654 B14R1.4526 CN(C)CCC(=O)NCc1ccco1 WXVL_AK0010SB00052 [0,1,0,0,0,0|2,0,0]=3 655 B14R1.4526 CN(C)CCC(=O)NCc1ccco1 WXVL_AK0010SB00052 [0,1,0,0,0,0|2,0,0]=3 656 B14R1.4526 CN(C)CCC(=O)NCc1cccs1 WXVL_AK0014SB00052 [0,1,0,0,0,0|2,1,0]=4 657 B14R1.4526 CN(C)CCC(=O)NCc1cccs1 WXVL_AK0014SB00052 [0,1,0,0,0,0|2,1,0]=4 658 B14R1.4526 CN(C)CCC(=O)NCc1cnco1 WXVL_AK1437SB00052 [0,1,0,0,0,0|3,0,0]=4 659 B14R1.4526 CN(C)CCC(=O)NCc1cnco1 WXVL_AK1437SB00052 [0,1,0,0,0,0|3,0,0]=4 660 B14R1.4526 C[C@H](O)CNC(=O)/C=C/c1ccco1 WXVL_AK0113SA0180 [0,1,0,0,0,0|2,0,1]=4 661 B14R1.4526 C[C@H](O)CNC(=O)/C=C/c1ccco1 WXVL_AK0113SA0180 [0,1,0,0,0,0|2,0,1]=4 662 B14R1.4526 C[C@H](O)CNC(=O)CCc1ccc[nH]1 WXVL_AK0113SA0009 [0,1,0,0,0,0|3,0,0]=4 663 B14R1.4526 C[C@H](O)CNC(=O)CCc1ccc[nH]1 WXVL_AK0113SA0009 [0,1,0,0,0,0|3,0,0]=4 664 B14R1.4526 C[C@H](O)CNC(=O)CCc1ccco1 WXVL_AK0113SA0167 [0,1,0,0,0,0|2,0,0]=3 665 B14R1.4526 C[C@H](O)CNC(=O)CCc1ccco1 WXVL_AK0113SA0167 [0,1,0,0,0,0|2,0,0]=3 666 B14R1.4526 C[C@H](O)CNC(=O)CCc1cccs1 WXVL_AK0113SA0303 [0,1,0,0,0,0|2,1,0]=4 667 B14R1.4526 C[C@H](O)CNC(=O)CCc1cccs1 WXVL_AK0113SA0303 [0,1,0,0,0,0|2,1,0]=4 668 B14R1.4526 NC(=O)CCC(=O)NCc1ccco1 WXVL_AK0010SB0358 [0,1,0,0,0,0|2,0,1]=4 669 B14R1.4526 NC(=O)CCC(=O)NCc1ccco1 WXVL_AK0010SB0358 [0,1,0,0,0,0|2,0,1]=4 670 B14R1.4526 O=C(CCc1ccco1)NCC(F)F WXVL_AK0136SA0167 [0,1,0,0,0,0|3,0,0]=4 671 B14R1.4526 O=C(CCc1ccco1)NCC(F)F WXVL_AK0136SA0167 [0,1,0,0,0,0|3,0,0]=4 672 B14R1.4531 CCCCS(=O)(=O)NCc1ccc[nH]1 WXVL_AK00759HU0031 [0,1,0,0,0,0|3,0,0]=4 673 B14R1.4531 CCCCS(=O)(=O)NCc1ccc[nH]1 WXVL_AK00759HU0031 [0,1,0,0,0,0|3,0,0]=4 674 B14R1.4531 CCCCS(=O)(=O)NCc1ccco1 WXVL_AK0010HU0031 [0,1,0,0,0,0|2,0,0]=3 675 B14R1.4531 CCCCS(=O)(=O)NCc1ccco1 WXVL_AK0010HU0031 [0,1,0,0,0,0|2,0,0]=3 676 B14R1.4531 CCCCS(=O)(=O)NCc1cccs1 WXVL_AK0014HU0031 [0,1,0,0,0,0|2,1,0]=4 677 B14R1.4531 CCCCS(=O)(=O)NCc1cccs1 WXVL_AK0014HU0031 [0,1,0,0,0,0|2,1,0]=4 678 B14R1.4531 CCCCS(=O)(=O)NCc1cnco1 WXVL_AK1437HU0031 [0,1,0,0,0,0|3,0,0]=4 679 B14R1.4531 CCCCS(=O)(=O)NCc1cnco1 WXVL_AK1437HU0031 [0,1,0,0,0,0|3,0,0]=4 680 B14R1.4531 COCCS(=O)(=O)NCc1ccco1 WXVL_AK0010HU0155 [0,1,0,0,0,0|3,0,0]=4 681 B14R1.4531 COCCS(=O)(=O)NCc1ccco1 WXVL_AK0010HU0155 [0,1,0,0,0,0|3,0,0]=4 682 B14R1.4531 O=S(=O)(CCCCl)NCc1ccco1 WXVL_AK0010HU0162 [0,1,0,0,0,0|3,0,0]=4 683 B14R1.4531 O=S(=O)(CCCCl)NCc1ccco1 WXVL_AK0010HU0162 [0,1,0,0,0,0|3,0,0]=4 684 B14R2.674 CC1CC1C(=O)NCc2cc[nH]n2 WXVL_AK00156SB0041 [0,0,0,1,0,0|3,0,0]=4 685 B14R2.674 CC1CC1C(=O)NCc2cc[nH]n2 WXVL_AK00156SB0041 [0,0,0,1,0,0|3,0,0]=4 686 B14R2.674 CC1CC1C(=O)NCc2ccc[nH]2 WXVL_AK00759SB0041 [0,0,0,1,0,0|2,0,0]=3 687 B14R2.674 CC1CC1C(=O)NCc2ccc[nH]2 WXVL_AK00759SB0041 [0,0,0,1,0,0|2,0,0]=3 688 B14R2.674 CC1CC1C(=O)NCc2ccco2 WXVL_AK0010SB0041 [0,0,0,1,0,0|1,0,0]=2 689 B14R2.674 CC1CC1C(=O)NCc2ccco2 WXVL_AK0010SB0041 [0,0,0,1,0,0|1,0,0]=2 690 B14R2.674 CC1CC1C(=O)NCc2cccs2 WXVL_AK0014SB0041 [0,0,0,1,0,0|1,1,0]=3 691 B14R2.674 CC1CC1C(=O)NCc2cccs2 WXVL_AK0014SB0041 [0,0,0,1,0,0|1,1,0]=3 692 B14R2.674 CC1CC1C(=O)NCc2ccn[nH]2 WXVL_AK0459SB0041 [0,0,0,1,0,0|3,0,0]=4 693 B14R2.674 CC1CC1C(=O)NCc2ccn[nH]2 WXVL_AK0459SB0041 [0,0,0,1,0,0|3,0,0]=4 694 B14R2.674 CC1CC1C(=O)NCc2ccoc2 WXVL_AK2033SB0041 [0,0,0,1,0,0|3,0,0]=4 695 B14R2.674 CC1CC1C(=O)NCc2ccoc2 WXVL_AK2033SB0041 [0,0,0,1,0,0|3,0,0]=4 696 B14R2.674 CC1CC1C(=O)NCc2ccsc2 WXVL_AK00174SB0041 [0,0,0,1,0,0|3,0,0]=4 697 B14R2.674 CC1CC1C(=O)NCc2ccsc2 WXVL_AK00174SB0041 [0,0,0,1,0,0|3,0,0]=4 698 B14R2.674 CC1CC1C(=O)NCc2cnc[nH]2 WXVL_AK00778SB0041 [0,0,0,1,0,0|3,0,0]=4 699 B14R2.674 CC1CC1C(=O)NCc2cnc[nH]2 WXVL_AK00778SB0041 [0,0,0,1,0,0|3,0,0]=4 700 B14R2.674 CC1CC1C(=O)NCc2cnco2 WXVL_AK1437SB0041 [0,0,0,1,0,0|2,0,0]=3 701 B14R2.674 CC1CC1C(=O)NCc2cnco2 WXVL_AK1437SB0041 [0,0,0,1,0,0|2,0,0]=3 702 B14R2.674 CC1CC1C(=O)NCc2cncs2 WXVL_AK0526SB0041 [0,0,0,1,0,0|2,1,0]=4 703 B14R2.674 CC1CC1C(=O)NCc2cncs2 WXVL_AK0526SB0041 [0,0,0,1,0,0|2,1,0]=4 704 B14R2.674 CC1CC1C(=O)NCc2cocn2 WXVL_AK00016SB0041 [0,0,0,1,0,0|3,0,0]=4 705 B14R2.674 CC1CC1C(=O)NCc2cocn2 WXVL_AK00016SB0041 [0,0,0,1,0,0|3,0,0]=4 706 B14R2.674 CC1CC1C(=O)NCc2cscn2 WXVL_AK0325SB0041 [0,0,0,1,0,0|3,0,0]=4 707 B14R2.674 CC1CC1C(=O)NCc2cscn2 WXVL_AK0325SB0041 [0,0,0,1,0,0|3,0,0]=4 708 B14R2.674 CC1CC1C(=O)NCc2nccs2 WXVL_AK0153SB0041 [0,0,0,1,0,0|2,1,0]=4 709 B14R2.674 CC1CC1C(=O)NCc2nccs2 WXVL_AK0153SB0041 [0,0,0,1,0,0|2,1,0]=4 710 B14R2.674 O=C(NCc1ccc[nH]1)[C@@H]2C[C@@H]2F WXVL_AK00759SB1245 [0,0,0,1,0,0|3,0,0]=4 711 B14R2.674 O=C(NCc1ccc[nH]1)[C@@H]2C[C@@H]2F WXVL_AK00759SB1245 [0,0,0,1,0,0|3,0,0]=4 712 B14R2.674 O=C(NCc1ccc[nH]1)[C@H]2C[C@H]2F WXVL_AK00759SB00019 [0,0,0,1,0,0|3,0,0]=4 713 B14R2.674 O=C(NCc1ccc[nH]1)[C@H]2C[C@H]2F WXVL_AK00759SB00019 [0,0,0,1,0,0|3,0,0]=4 714 B14R2.674 O=C(NCc1ccco1)[C@@H]2C[C@@H]2F WXVL_AK0010SB1245 [0,0,0,1,0,0|2,0,0]=3 715 B14R2.674 O=C(NCc1ccco1)[C@@H]2C[C@@H]2F WXVL_AK0010SB1245 [0,0,0,1,0,0|2,0,0]=3 716 B14R2.674 O=C(NCc1ccco1)[C@H]2C[C@H]2F WXVL_AK0010SB00019 [0,0,0,1,0,0|2,0,0]=3 717 B14R2.674 O=C(NCc1ccco1)[C@H]2C[C@H]2F WXVL_AK0010SB00019 [0,0,0,1,0,0|2,0,0]=3 718 B14R2.674 O=C(NCc1cccs1)[C@@H]2C[C@@H]2F WXVL_AK0014SB1245 [0,0,0,1,0,0|2,1,0]=4 719 B14R2.674 O=C(NCc1cccs1)[C@@H]2C[C@@H]2F WXVL_AK0014SB1245 [0,0,0,1,0,0|2,1,0]=4 720 B14R2.674 O=C(NCc1cccs1)[C@H]2C[C@H]2F WXVL_AK0014SB00019 [0,0,0,1,0,0|2,1,0]=4 721 B14R2.674 O=C(NCc1cccs1)[C@H]2C[C@H]2F WXVL_AK0014SB00019 [0,0,0,1,0,0|2,1,0]=4 722 B14R2.674 O=C(NCc1cnco1)[C@@H]2C[C@@H]2F WXVL_AK1437SB1245 [0,0,0,1,0,0|3,0,0]=4 723 B14R2.674 O=C(NCc1cnco1)[C@@H]2C[C@@H]2F WXVL_AK1437SB1245 [0,0,0,1,0,0|3,0,0]=4 724 B14R2.674 O=C(NCc1cnco1)[C@H]2C[C@H]2F WXVL_AK1437SB00019 [0,0,0,1,0,0|3,0,0]=4 725 B14R2.674 O=C(NCc1cnco1)[C@H]2C[C@H]2F WXVL_AK1437SB00019 [0,0,0,1,0,0|3,0,0]=4 726 B14R2.13184 O=C(/C=C/c1ccco1)NC2CC2 WXVL_AK0001SA0180 [0,0,0,1,0,0|2,0,1]=4 727 B14R2.13184 O=C(/C=C/c1ccco1)NC2CC2 WXVL_AK0001SA0180 [0,0,0,1,0,0|2,0,1]=4 728 B14R2.13184 O=C(CC1CC1)NCc2cc[nH]n2 WXVL_AK00156SB0155 [0,0,0,1,0,0|3,0,0]=4 729 B14R2.13184 O=C(CC1CC1)NCc2cc[nH]n2 WXVL_AK00156SB0155 [0,0,0,1,0,0|3,0,0]=4 730 B14R2.13184 O=C(CC1CC1)NCc2ccc[nH]2 WXVL_AK00759SB0155 [0,0,0,1,0,0|2,0,0]=3 731 B14R2.13184 O=C(CC1CC1)NCc2ccc[nH]2 WXVL_AK00759SB0155 [0,0,0,1,0,0|2,0,0]=3 732 B14R2.13184 O=C(CC1CC1)NCc2ccco2 WXVL_AK0010SB0155 [0,0,0,1,0,0|1,0,0]=2 733 B14R2.13184 O=C(CC1CC1)NCc2ccco2 WXVL_AK0010SB0155 [0,0,0,1,0,0|1,0,0]=2 734 B14R2.13184 O=C(CC1CC1)NCc2cccs2 WXVL_AK0014SB0155 [0,0,0,1,0,0|1,1,0]=3 735 B14R2.13184 O=C(CC1CC1)NCc2cccs2 WXVL_AK0014SB0155 [0,0,0,1,0,0|1,1,0]=3 736 B14R2.13184 O=C(CC1CC1)NCc2ccn[nH]2 WXVL_AK0459SB0155 [0,0,0,1,0,0|3,0,0]=4 737 B14R2.13184 O=C(CC1CC1)NCc2ccn[nH]2 WXVL_AK0459SB0155 [0,0,0,1,0,0|3,0,0]=4 738 B14R2.13184 O=C(CC1CC1)NCc2ccoc2 WXVL_AK2033SB0155 [0,0,0,1,0,0|3,0,0]=4 739 B14R2.13184 O=C(CC1CC1)NCc2ccoc2 WXVL_AK2033SB0155 [0,0,0,1,0,0|3,0,0]=4 740 B14R2.13184 O=C(CC1CC1)NCc2ccsc2 WXVL_AK00174SB0155 [0,0,0,1,0,0|3,0,0]=4 741 B14R2.13184 O=C(CC1CC1)NCc2ccsc2 WXVL_AK00174SB0155 [0,0,0,1,0,0|3,0,0]=4 742 B14R2.13184 O=C(CC1CC1)NCc2cnc[nH]2 WXVL_AK00778SB0155 [0,0,0,1,0,0|3,0,0]=4 743 B14R2.13184 O=C(CC1CC1)NCc2cnc[nH]2 WXVL_AK00778SB0155 [0,0,0,1,0,0|3,0,0]=4 744 B14R2.13184 O=C(CC1CC1)NCc2cnco2 WXVL_AK1437SB0155 [0,0,0,1,0,0|2,0,0]=3 745 B14R2.13184 O=C(CC1CC1)NCc2cnco2 WXVL_AK1437SB0155 [0,0,0,1,0,0|2,0,0]=3 746 B14R2.13184 O=C(CC1CC1)NCc2cncs2 WXVL_AK0526SB0155 [0,0,0,1,0,0|2,1,0]=4 747 B14R2.13184 O=C(CC1CC1)NCc2cncs2 WXVL_AK0526SB0155 [0,0,0,1,0,0|2,1,0]=4 748 B14R2.13184 O=C(CC1CC1)NCc2cocn2 WXVL_AK00016SB0155 [0,0,0,1,0,0|3,0,0]=4 749 B14R2.13184 O=C(CC1CC1)NCc2cocn2 WXVL_AK00016SB0155 [0,0,0,1,0,0|3,0,0]=4 750 B14R2.13184 O=C(CC1CC1)NCc2cscn2 WXVL_AK0325SB0155 [0,0,0,1,0,0|3,0,0]=4 751 B14R2.13184 O=C(CC1CC1)NCc2cscn2 WXVL_AK0325SB0155 [0,0,0,1,0,0|3,0,0]=4 752 B14R2.13184 O=C(CC1CC1)NCc2nccs2 WXVL_AK0153SB0155 [0,0,0,1,0,0|2,1,0]=4 753 B14R2.13184 O=C(CC1CC1)NCc2nccs2 WXVL_AK0153SB0155 [0,0,0,1,0,0|2,1,0]=4 754 B14R2.13184 O=C(CCc1ccc[nH]1)NC2CC2 WXVL_AK0001SA0009 [0,0,0,1,0,0|3,0,0]=4 755 B14R2.13184 O=C(CCc1ccc[nH]1)NC2CC2 WXVL_AK0001SA0009 [0,0,0,1,0,0|3,0,0]=4 756 B14R2.13184 O=C(CCc1ccco1)NC2CC2 WXVL_AK0001SA0167 [0,0,0,1,0,0|2,0,0]=3 757 B14R2.13184 O=C(CCc1ccco1)NC2CC2 WXVL_AK0001SA0167 [0,0,0,1,0,0|2,0,0]=3 758 B14R2.13184 O=C(CCc1cccs1)NC2CC2 WXVL_AK0001SA0303 [0,0,0,1,0,0|2,1,0]=4 759 B14R2.13184 O=C(CCc1cccs1)NC2CC2 WXVL_AK0001SA0303 [0,0,0,1,0,0|2,1,0]=4 760 B14R2.40225 O=C(NCc1cc[nH]n1)C2CCC2 WXVL_AK00156SB0042 [0,0,0,1,0,0|3,0,0]=4 761 B14R2.40225 O=C(NCc1cc[nH]n1)C2CCC2 WXVL_AK00156SB0042 [0,0,0,1,0,0|3,0,0]=4 762 B14R2.40225 O=C(NCc1ccc[nH]1)C2CCC2 WXVL_AK00759SB0042 [0,0,0,1,0,0|2,0,0]=3 763 B14R2.40225 O=C(NCc1ccc[nH]1)C2CCC2 WXVL_AK00759SB0042 [0,0,0,1,0,0|2,0,0]=3 764 B14R2.40225 O=C(NCc1ccco1)C2CCC2 WXVL_AK0010SB0042 [0,0,0,1,0,0|1,0,0]=2 765 B14R2.40225 O=C(NCc1ccco1)C2CCC2 WXVL_AK0010SB0042 [0,0,0,1,0,0|1,0,0]=2 766 B14R2.40225 O=C(NCc1cccs1)C2CCC2 WXVL_AK0014SB0042 [0,0,0,1,0,0|1,1,0]=3 767 B14R2.40225 O=C(NCc1cccs1)C2CCC2 WXVL_AK0014SB0042 [0,0,0,1,0,0|1,1,0]=3 768 B14R2.40225 O=C(NCc1ccn[nH]1)C2CCC2 WXVL_AK0459SB0042 [0,0,0,1,0,0|3,0,0]=4 769 B14R2.40225 O=C(NCc1ccn[nH]1)C2CCC2 WXVL_AK0459SB0042 [0,0,0,1,0,0|3,0,0]=4 770 B14R2.40225 O=C(NCc1ccoc1)C2CCC2 WXVL_AK2033SB0042 [0,0,0,1,0,0|3,0,0]=4 771 B14R2.40225 O=C(NCc1ccoc1)C2CCC2 WXVL_AK2033SB0042 [0,0,0,1,0,0|3,0,0]=4 772 B14R2.40225 O=C(NCc1ccsc1)C2CCC2 WXVL_AK00174SB0042 [0,0,0,1,0,0|3,0,0]=4 773 B14R2.40225 O=C(NCc1ccsc1)C2CCC2 WXVL_AK00174SB0042 [0,0,0,1,0,0|3,0,0]=4 774 B14R2.40225 O=C(NCc1cnc[nH]1)C2CCC2 WXVL_AK00778SB0042 [0,0,0,1,0,0|3,0,0]=4 775 B14R2.40225 O=C(NCc1cnc[nH]1)C2CCC2 WXVL_AK00778SB0042 [0,0,0,1,0,0|3,0,0]=4 776 B14R2.40225 O=C(NCc1cnco1)C2CCC2 WXVL_AK1437SB0042 [0,0,0,1,0,0|2,0,0]=3 777 B14R2.40225 O=C(NCc1cnco1)C2CCC2 WXVL_AK1437SB0042 [0,0,0,1,0,0|2,0,0]=3 778 B14R2.40225 O=C(NCc1cncs1)C2CCC2 WXVL_AK0526SB0042 [0,0,0,1,0,0|2,1,0]=4 779 B14R2.40225 O=C(NCc1cncs1)C2CCC2 WXVL_AK0526SB0042 [0,0,0,1,0,0|2,1,0]=4 780 B14R2.40225 O=C(NCc1cocn1)C2CCC2 WXVL_AK00016SB0042 [0,0,0,1,0,0|3,0,0]=4 781 B14R2.40225 O=C(NCc1cocn1)C2CCC2 WXVL_AK00016SB0042 [0,0,0,1,0,0|3,0,0]=4 782 B14R2.40225 O=C(NCc1cscn1)C2CCC2 WXVL_AK0325SB0042 [0,0,0,1,0,0|3,0,0]=4 783 B14R2.40225 O=C(NCc1cscn1)C2CCC2 WXVL_AK0325SB0042 [0,0,0,1,0,0|3,0,0]=4 784 B14R2.40225 O=C(NCc1nccs1)C2CCC2 WXVL_AK0153SB0042 [0,0,0,1,0,0|2,1,0]=4 785 B14R2.40225 O=C(NCc1nccs1)C2CCC2 WXVL_AK0153SB0042 [0,0,0,1,0,0|2,1,0]=4 786 B12R1.53 CCCNC(=O)Cc1cccs1 WXVL_AK00504SA0018 [0,0,0,0,1,0|1,1,0]=3 787 B12R1.53 CCCNC(=O)Cc1cccs1 WXVL_AK00504SA0018 [0,0,0,0,1,0|1,1,0]=3 788 B12R1.53 CCCNC(=O)Cc1ccn[nH]1 WXVL_AK00504SA00008 [0,0,0,0,1,0|3,0,0]=4 789 B12R1.53 CCCNC(=O)Cc1ccn[nH]1 WXVL_AK00504SA00008 [0,0,0,0,1,0|3,0,0]=4 790 B12R1.53 CCCNC(=O)Cc1ccsc1 WXVL_AK00504SA0020 [0,0,0,0,1,0|3,0,0]=4 791 B12R1.53 CCCNC(=O)Cc1ccsc1 WXVL_AK00504SA0020 [0,0,0,0,1,0|3,0,0]=4 792 B12R1.53 CCCNC(=O)Cc1cscn1 WXVL_AK00504SA0012 [0,0,0,0,1,0|3,0,0]=4 793 B12R1.53 CCCNC(=O)Cc1cscn1 WXVL_AK00504SA0012 [0,0,0,0,1,0|3,0,0]=4 794 B12R1.53 CCCNC(=O)Cn1cccn1 WXVL_AK00504SA0030 [0,0,0,0,1,0|3,0,0]=4 795 B12R1.53 CCCNC(=O)Cn1cccn1 WXVL_AK00504SA0030 [0,0,0,0,1,0|3,0,0]=4 796 B12R1.53 CCOCC(=O)Nc1ccno1 WXVL_AF0588SB0091 [0,0,0,0,1,0|3,0,0]=4 797 B12R1.53 CCOCC(=O)Nc1ccno1 WXVL_AF0588SB0091 [0,0,0,0,1,0|3,0,0]=4 798 B12R1.53 CCOCC(=O)Nc1ncco1 WXVL_AF0235SB0091 [0,0,0,0,1,0|3,0,0]=4 799 B12R1.53 CCOCC(=O)Nc1ncco1 WXVL_AF0235SB0091 [0,0,0,0,1,0|3,0,0]=4 800 B12R1.53 CCSCC(=O)Nc1ccno1 WXVL_AF0588SB0002 [0,0,0,0,1,0|3,0,0]=4 801 B12R1.53 CCSCC(=O)Nc1ccno1 WXVL_AF0588SB0002 [0,0,0,0,1,0|3,0,0]=4 802 B12R1.53 CCSCC(=O)Nc1ncco1 WXVL_AF0235SB0002 [0,0,0,0,1,0|3,0,0]=4 803 B12R1.53 CCSCC(=O)Nc1ncco1 WXVL_AF0235SB0002 [0,0,0,0,1,0|3,0,0]=4 804 B12R1.53 COCCC(=O)Nc1ccno1 WXVL_AF0588SB0156 [0,0,0,0,1,0|3,0,0]=4 805 B12R1.53 COCCC(=O)Nc1ccno1 WXVL_AF0588SB0156 [0,0,0,0,1,0|3,0,0]=4 806 B12R1.53 COCCC(=O)Nc1ncco1 WXVL_AF0235SB0156 [0,0,0,0,1,0|3,0,0]=4 807 B12R1.53 COCCC(=O)Nc1ncco1 WXVL_AF0235SB0156 [0,0,0,0,1,0|3,0,0]=4 808 B12R1.53 CSCCC(=O)Nc1ccno1 WXVL_AF0588SB0361 [0,0,0,0,1,0|3,0,0]=4 809 B12R1.53 CSCCC(=O)Nc1ccno1 WXVL_AF0588SB0361 [0,0,0,0,1,0|3,0,0]=4 810 B12R1.53 CSCCC(=O)Nc1ncco1 WXVL_AF0235SB0361 [0,0,0,0,1,0|3,0,0]=4 811 B12R1.53 CSCCC(=O)Nc1ncco1 WXVL_AF0235SB0361 [0,0,0,0,1,0|3,0,0]=4 812 B12R1.53 O=C(Cc1cccs1)NCCF WXVL_AK00466SA0018 [0,0,0,0,1,0|2,1,0]=4 813 B12R1.53 O=C(Cc1cccs1)NCCF WXVL_AK00466SA0018 [0,0,0,0,1,0|2,1,0]=4 814 B14R1.156 CCCNC(=O)CCc1ccccc1 WXVL_AK00504SB0067 [0,0,0,0,0,1|3,0,0]=4 815 B14R1.156 CCCNC(=O)CCc1ccccc1 WXVL_AK00504SB0067 [0,0,0,0,0,1|3,0,0]=4 816 B14R1.156 CCCNC(=O)CCc1ccccn1 WXVL_AK00504SA0316 [0,0,0,0,0,1|3,0,0]=4 817 B14R1.156 CCCNC(=O)CCc1ccccn1 WXVL_AK00504SA0316 [0,0,0,0,0,1|3,0,0]=4 818 B14R1.156 CCCNC(=O)CCc1cccnc1 WXVL_AK00504SA0031 [0,0,0,0,0,1|3,0,0]=4 819 B14R1.156 CCCNC(=O)CCc1cccnc1 WXVL_AK00504SA0031 [0,0,0,0,0,1|3,0,0]=4 820 B14R1.156 CCCNC(=O)CCc1cnccn1 WXVL_AK00504SA2354 [0,0,0,0,0,1|3,0,0]=4 821 B14R1.156 CCCNC(=O)CCc1cnccn1 WXVL_AK00504SA2354 [0,0,0,0,0,1|3,0,0]=4 822 B14R1.156 CCOCC(=O)NCc1ccccc1 WXVL_AK00502SB0091 [0,0,0,0,0,1|3,0,0]=4 823 B14R1.156 CCOCC(=O)NCc1ccccc1 WXVL_AK00502SB0091 [0,0,0,0,0,1|3,0,0]=4 824 B14R1.156 CCOCC(=O)NCc1ccccn1 WXVL_AK0018SB0091 [0,0,0,0,0,1|3,0,0]=4 825 B14R1.156 CCOCC(=O)NCc1ccccn1 WXVL_AK0018SB0091 [0,0,0,0,0,1|3,0,0]=4 826 B14R1.156 CCOCC(=O)NCc1cccnc1 WXVL_AK0020SB0091 [0,0,0,0,0,1|3,0,0]=4 827 B14R1.156 CCOCC(=O)NCc1cccnc1 WXVL_AK0020SB0091 [0,0,0,0,0,1|3,0,0]=4 828 B14R1.156 CCOCC(=O)NCc1ccncc1 WXVL_AK0021SB0091 [0,0,0,0,0,1|3,0,0]=4 829 B14R1.156 CCOCC(=O)NCc1ccncc1 WXVL_AK0021SB0091 [0,0,0,0,0,1|3,0,0]=4 830 B14R1.156 CCOCC(=O)NCc1ccncn1 WXVL_AK1356SB0091 [0,0,0,0,0,1|3,0,0]=4 831 B14R1.156 CCOCC(=O)NCc1ccncn1 WXVL_AK1356SB0091 [0,0,0,0,0,1|3,0,0]=4 832 B14R1.156 CCOCC(=O)NCc1cnccn1 WXVL_AK00262SB0091 [0,0,0,0,0,1|3,0,0]=4 833 B14R1.156 CCOCC(=O)NCc1cnccn1 WXVL_AK00262SB0091 [0,0,0,0,0,1|3,0,0]=4 834 B14R1.156 CCOCC(=O)NCc1ncccn1 WXVL_AK0279SB0091 [0,0,0,0,0,1|3,0,0]=4 835 B14R1.156 CCOCC(=O)NCc1ncccn1 WXVL_AK0279SB0091 [0,0,0,0,0,1|3,0,0]=4 836 B14R1.156 CCSCC(=O)NCc1ccccc1 WXVL_AK00502SB0002 [0,0,0,0,0,1|3,0,0]=4 837 B14R1.156 CCSCC(=O)NCc1ccccc1 WXVL_AK00502SB0002 [0,0,0,0,0,1|3,0,0]=4 838 B14R1.156 CCSCC(=O)NCc1ccccn1 WXVL_AK0018SB0002 [0,0,0,0,0,1|3,0,0]=4 839 B14R1.156 CCSCC(=O)NCc1ccccn1 WXVL_AK0018SB0002 [0,0,0,0,0,1|3,0,0]=4 840 B14R1.156 CCSCC(=O)NCc1cccnc1 WXVL_AK0020SB0002 [0,0,0,0,0,1|3,0,0]=4 841 B14R1.156 CCSCC(=O)NCc1cccnc1 WXVL_AK0020SB0002 [0,0,0,0,0,1|3,0,0]=4 842 B14R1.156 CCSCC(=O)NCc1ccncc1 WXVL_AK0021SB0002 [0,0,0,0,0,1|3,0,0]=4 843 B14R1.156 CCSCC(=O)NCc1ccncc1 WXVL_AK0021SB0002 [0,0,0,0,0,1|3,0,0]=4 844 B14R1.156 CCSCC(=O)NCc1ccncn1 WXVL_AK1356SB0002 [0,0,0,0,0,1|3,0,0]=4 845 B14R1.156 CCSCC(=O)NCc1ccncn1 WXVL_AK1356SB0002 [0,0,0,0,0,1|3,0,0]=4 846 B14R1.156 CCSCC(=O)NCc1cnccn1 WXVL_AK00262SB0002 [0,0,0,0,0,1|3,0,0]=4 847 B14R1.156 CCSCC(=O)NCc1cnccn1 WXVL_AK00262SB0002 [0,0,0,0,0,1|3,0,0]=4 848 B14R1.156 CCSCC(=O)NCc1ncccn1 WXVL_AK0279SB0002 [0,0,0,0,0,1|3,0,0]=4 849 B14R1.156 CCSCC(=O)NCc1ncccn1 WXVL_AK0279SB0002 [0,0,0,0,0,1|3,0,0]=4 850 B14R1.156 COCCC(=O)NCc1ccccc1 WXVL_AK00502SB0156 [0,0,0,0,0,1|3,0,0]=4 851 B14R1.156 COCCC(=O)NCc1ccccc1 WXVL_AK00502SB0156 [0,0,0,0,0,1|3,0,0]=4 852 B14R1.156 COCCC(=O)NCc1ccccn1 WXVL_AK0018SB0156 [0,0,0,0,0,1|3,0,0]=4 853 B14R1.156 COCCC(=O)NCc1ccccn1 WXVL_AK0018SB0156 [0,0,0,0,0,1|3,0,0]=4 854 B14R1.156 COCCC(=O)NCc1cccnc1 WXVL_AK0020SB0156 [0,0,0,0,0,1|3,0,0]=4 855 B14R1.156 COCCC(=O)NCc1cccnc1 WXVL_AK0020SB0156 [0,0,0,0,0,1|3,0,0]=4 856 B14R1.156 COCCC(=O)NCc1ccncc1 WXVL_AK0021SB0156 [0,0,0,0,0,1|3,0,0]=4 857 B14R1.156 COCCC(=O)NCc1ccncc1 WXVL_AK0021SB0156 [0,0,0,0,0,1|3,0,0]=4 858 B14R1.156 COCCC(=O)NCc1ccncn1 WXVL_AK1356SB0156 [0,0,0,0,0,1|3,0,0]=4 859 B14R1.156 COCCC(=O)NCc1ccncn1 WXVL_AK1356SB0156 [0,0,0,0,0,1|3,0,0]=4 860 B14R1.156 COCCC(=O)NCc1cnccn1 WXVL_AK00262SB0156 [0,0,0,0,0,1|3,0,0]=4 861 B14R1.156 COCCC(=O)NCc1cnccn1 WXVL_AK00262SB0156 [0,0,0,0,0,1|3,0,0]=4 862 B14R1.156 COCCC(=O)NCc1ncccn1 WXVL_AK0279SB0156 [0,0,0,0,0,1|3,0,0]=4 863 B14R1.156 COCCC(=O)NCc1ncccn1 WXVL_AK0279SB0156 [0,0,0,0,0,1|3,0,0]=4 864 B14R1.156 CSCCC(=O)NCc1ccccc1 WXVL_AK00502SB0361 [0,0,0,0,0,1|3,0,0]=4 865 B14R1.156 CSCCC(=O)NCc1ccccc1 WXVL_AK00502SB0361 [0,0,0,0,0,1|3,0,0]=4 866 B14R1.156 CSCCC(=O)NCc1ccccn1 WXVL_AK0018SB0361 [0,0,0,0,0,1|3,0,0]=4 867 B14R1.156 CSCCC(=O)NCc1ccccn1 WXVL_AK0018SB0361 [0,0,0,0,0,1|3,0,0]=4 868 B14R1.156 CSCCC(=O)NCc1cccnc1 WXVL_AK0020SB0361 [0,0,0,0,0,1|3,0,0]=4 869 B14R1.156 CSCCC(=O)NCc1cccnc1 WXVL_AK0020SB0361 [0,0,0,0,0,1|3,0,0]=4 870 B14R1.156 CSCCC(=O)NCc1ccncc1 WXVL_AK0021SB0361 [0,0,0,0,0,1|3,0,0]=4 871 B14R1.156 CSCCC(=O)NCc1ccncc1 WXVL_AK0021SB0361 [0,0,0,0,0,1|3,0,0]=4 872 B14R1.156 CSCCC(=O)NCc1ccncn1 WXVL_AK1356SB0361 [0,0,0,0,0,1|3,0,0]=4 873 B14R1.156 CSCCC(=O)NCc1ccncn1 WXVL_AK1356SB0361 [0,0,0,0,0,1|3,0,0]=4 874 B14R1.156 CSCCC(=O)NCc1cnccn1 WXVL_AK00262SB0361 [0,0,0,0,0,1|3,0,0]=4 875 B14R1.156 CSCCC(=O)NCc1cnccn1 WXVL_AK00262SB0361 [0,0,0,0,0,1|3,0,0]=4 876 B14R1.156 CSCCC(=O)NCc1ncccn1 WXVL_AK0279SB0361 [0,0,0,0,0,1|3,0,0]=4 877 B14R1.156 CSCCC(=O)NCc1ncccn1 WXVL_AK0279SB0361 [0,0,0,0,0,1|3,0,0]=4 878 B14R1.177 C#CCCC(=O)NCCc1ccco1 WXVL_AK0989SB2189 [0,0,0,0,0,1|1,0,2]=4 879 B14R1.177 C#CCCC(=O)NCCc1ccco1 WXVL_AK0989SB2189 [0,0,0,0,0,1|1,0,2]=4 880 B14R1.177 C=CCCC(=O)NCCc1ccco1 WXVL_AK0989SB1035 [0,0,0,0,0,1|1,0,2]=4 881 B14R1.177 C=CCCC(=O)NCCc1ccco1 WXVL_AK0989SB1035 [0,0,0,0,0,1|1,0,2]=4 882 B14R1.177 CCOCC(=O)NCCc1ccco1 WXVL_AK0989SB0091 [0,0,0,0,0,1|2,0,0]=3 883 B14R1.177 CCOCC(=O)NCCc1ccco1 WXVL_AK0989SB0091 [0,0,0,0,0,1|2,0,0]=3 884 B14R1.177 CCOCC(=O)NCCc1cccs1 WXVL_AK0098SB0091 [0,0,0,0,0,1|2,1,0]=4 885 B14R1.177 CCOCC(=O)NCCc1cccs1 WXVL_AK0098SB0091 [0,0,0,0,0,1|2,1,0]=4 886 B14R1.177 CCSCC(=O)NCCc1ccco1 WXVL_AK0989SB0002 [0,0,0,0,0,1|2,0,0]=3 887 B14R1.177 CCSCC(=O)NCCc1ccco1 WXVL_AK0989SB0002 [0,0,0,0,0,1|2,0,0]=3 888 B14R1.177 CCSCC(=O)NCCc1cccs1 WXVL_AK0098SB0002 [0,0,0,0,0,1|2,1,0]=4 889 B14R1.177 CCSCC(=O)NCCc1cccs1 WXVL_AK0098SB0002 [0,0,0,0,0,1|2,1,0]=4 890 B14R1.177 COCCC(=O)NCCc1ccco1 WXVL_AK0989SB0156 [0,0,0,0,0,1|2,0,0]=3 891 B14R1.177 COCCC(=O)NCCc1ccco1 WXVL_AK0989SB0156 [0,0,0,0,0,1|2,0,0]=3 892 B14R1.177 COCCC(=O)NCCc1cccs1 WXVL_AK0098SB0156 [0,0,0,0,0,1|2,1,0]=4 893 B14R1.177 COCCC(=O)NCCc1cccs1 WXVL_AK0098SB0156 [0,0,0,0,0,1|2,1,0]=4 894 B14R1.177 CSCCC(=O)NCCc1ccco1 WXVL_AK0989SB0361 [0,0,0,0,0,1|2,0,0]=3 895 B14R1.177 CSCCC(=O)NCCc1ccco1 WXVL_AK0989SB0361 [0,0,0,0,0,1|2,0,0]=3 896 B14R1.177 CSCCC(=O)NCCc1cccs1 WXVL_AK0098SB0361 [0,0,0,0,0,1|2,1,0]=4 897 B14R1.177 CSCCC(=O)NCCc1cccs1 WXVL_AK0098SB0361 [0,0,0,0,0,1|2,1,0]=4 898 B14R1.177 O=C(NCCCl)NCCc1ccco1 WXVL_AK0989YV0092 [0,0,0,0,0,1|3,0,0]=4 899 B14R1.177 O=C(NCCCl)NCCc1ccco1 WXVL_AK0989YV0092 [0,0,0,0,0,1|3,0,0]=4 900 B11R1.25 CCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0064 [2,0,0,0,0,0|2,0,0]=4 901 B11R1.25 CCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0064 [2,0,0,0,0,0|2,0,0]=4 902 B11R1.25 CCC(=O)NCc1ccco1 WXVL_AK0010SB0064 [2,0,0,0,0,0|1,0,0]=3 903 B11R1.25 CCC(=O)NCc1ccco1 WXVL_AK0010SB0064 [2,0,0,0,0,0|1,0,0]=3 904 B11R1.25 CCC(=O)NCc1cccs1 WXVL_AK0014SB0064 [2,0,0,0,0,0|1,1,0]=4 905 B11R1.25 CCC(=O)NCc1cccs1 WXVL_AK0014SB0064 [2,0,0,0,0,0|1,1,0]=4 906 B11R1.25 CCC(=O)NCc1cnco1 WXVL_AK1437SB0064 [2,0,0,0,0,0|2,0,0]=4 907 B11R1.25 CCC(=O)NCc1cnco1 WXVL_AK1437SB0064 [2,0,0,0,0,0|2,0,0]=4 908 B11R1.25 CNC(=O)CCc1ccco1 WXVL_AK00442SA0167 [2,0,0,0,0,0|2,0,0]=4 909 B11R1.25 CNC(=O)CCc1ccco1 WXVL_AK00442SA0167 [2,0,0,0,0,0|2,0,0]=4 910 B11R1.25 O=C(CO)NCc1ccco1 WXVL_AK0010SB2706 [2,0,0,0,0,0|2,0,0]=4 911 B11R1.25 O=C(CO)NCc1ccco1 WXVL_AK0010SB2706 [2,0,0,0,0,0|2,0,0]=4 912 B13R1.33 CCCC(=O)NC(C)c1ccno1 WXVL_AK6536SB0073 [1,1,0,0,0,0|2,0,0]=4 913 B13R1.33 CCCC(=O)NC(C)c1ccno1 WXVL_AK6536SB0073 [1,1,0,0,0,0|2,0,0]=4 914 B13R1.33 CCCC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB0073 [1,1,0,0,0,0|1,1,0]=4 915 B13R1.33 CCCC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB0073 [1,1,0,0,0,0|1,1,0]=4 916 B13R1.41 CCCC(=O)NCc1cc(cs1)Br WXVL_AK00192SB0073 [1,1,0,0,0,0|1,1,0]=4 917 B13R1.41 CCCC(=O)NCc1cc(cs1)Br WXVL_AK00192SB0073 [1,1,0,0,0,0|1,1,0]=4 918 B13R1.41 CCCC(=O)NCc1cc(no1)Br WXVL_AK1427SB0073 [1,1,0,0,0,0|2,0,0]=4 919 B13R1.41 CCCC(=O)NCc1cc(no1)Br WXVL_AK1427SB0073 [1,1,0,0,0,0|2,0,0]=4 920 B13R1.41 CCCC(=O)NCc1cc(no1)C WXVL_AK1064SB0073 [1,1,0,0,0,0|2,0,0]=4 921 B13R1.41 CCCC(=O)NCc1cc(no1)C WXVL_AK1064SB0073 [1,1,0,0,0,0|2,0,0]=4 922 B13R1.41 CCCC(=O)NCc1ccc(s1)Br WXVL_AK2468SB0073 [1,1,0,0,0,0|1,1,0]=4 923 B13R1.41 CCCC(=O)NCc1ccc(s1)Br WXVL_AK2468SB0073 [1,1,0,0,0,0|1,1,0]=4 924 B13R1.41 CCCC(=O)NCc1ccc(s1)C WXVL_AK0276SB0073 [1,1,0,0,0,0|1,1,0]=4 925 B13R1.41 CCCC(=O)NCc1ccc(s1)C WXVL_AK0276SB0073 [1,1,0,0,0,0|1,1,0]=4 926 B13R1.41 CCCC(=O)NCc1ccc(s1)Cl WXVL_AK00166SB0073 [1,1,0,0,0,0|1,1,0]=4 927 B13R1.41 CCCC(=O)NCc1ccc(s1)Cl WXVL_AK00166SB0073 [1,1,0,0,0,0|1,1,0]=4 928 B13R1.66 CCNC(=O)C(C)Cc1ccco1 WXVL_AK00476SA2637 [1,1,0,0,0,0|2,0,0]=4 929 B13R1.66 CCNC(=O)C(C)Cc1ccco1 WXVL_AK00476SA2637 [1,1,0,0,0,0|2,0,0]=4 930 B13R1.444 CCCC(=O)NCc1cccn1C WXVL_AK0499SB0073 [1,1,0,0,0,0|2,0,0]=4 931 B13R1.444 CCCC(=O)NCc1cccn1C WXVL_AK0499SB0073 [1,1,0,0,0,0|2,0,0]=4 932 B13R1.444 CCCC(=O)NCc1sccc1Cl WXVL_AK4332SB0073 [1,1,0,0,0,0|1,1,0]=4 933 B13R1.444 CCCC(=O)NCc1sccc1Cl WXVL_AK4332SB0073 [1,1,0,0,0,0|1,1,0]=4 934 B13R1.554 CCC(=O)C(=O)NCc1ccco1 WXVL_AK0010SB0344 [1,1,0,0,0,0|1,0,1]=4 935 B13R1.554 CCC(=O)C(=O)NCc1ccco1 WXVL_AK0010SB0344 [1,1,0,0,0,0|1,0,1]=4 936 B13R1.554 CCC(C)C(=O)NCc1ccc[nH]1 WXVL_AK00759SB0054 [1,1,0,0,0,0|2,0,0]=4 937 B13R1.554 CCC(C)C(=O)NCc1ccc[nH]1 WXVL_AK00759SB0054 [1,1,0,0,0,0|2,0,0]=4 938 B13R1.554 CCC(C)C(=O)NCc1ccco1 WXVL_AK0010SB0054 [1,1,0,0,0,0|1,0,0]=3 939 B13R1.554 CCC(C)C(=O)NCc1ccco1 WXVL_AK0010SB0054 [1,1,0,0,0,0|1,0,0]=3 940 B13R1.554 CCC(C)C(=O)NCc1cccs1 WXVL_AK0014SB0054 [1,1,0,0,0,0|1,1,0]=4 941 B13R1.554 CCC(C)C(=O)NCc1cccs1 WXVL_AK0014SB0054 [1,1,0,0,0,0|1,1,0]=4 942 B13R1.554 CCC(C)C(=O)NCc1cnco1 WXVL_AK1437SB0054 [1,1,0,0,0,0|2,0,0]=4 943 B13R1.554 CCC(C)C(=O)NCc1cnco1 WXVL_AK1437SB0054 [1,1,0,0,0,0|2,0,0]=4 944 B13R1.554 CC[C@@H](C)C(=O)NCc1ccc[nH]1 WXVL_AK00759SB00054 [1,1,0,0,0,0|2,0,0]=4 945 B13R1.554 CC[C@@H](C)C(=O)NCc1ccc[nH]1 WXVL_AK00759SB00054 [1,1,0,0,0,0|2,0,0]=4 946 B13R1.554 CC[C@@H](C)C(=O)NCc1ccco1 WXVL_AK0010SB00054 [1,1,0,0,0,0|1,0,0]=3 947 B13R1.554 CC[C@@H](C)C(=O)NCc1ccco1 WXVL_AK0010SB00054 [1,1,0,0,0,0|1,0,0]=3 948 B13R1.554 CC[C@@H](C)C(=O)NCc1cccs1 WXVL_AK0014SB00054 [1,1,0,0,0,0|1,1,0]=4 949 B13R1.554 CC[C@@H](C)C(=O)NCc1cccs1 WXVL_AK0014SB00054 [1,1,0,0,0,0|1,1,0]=4 950 B13R1.554 CC[C@@H](C)C(=O)NCc1cnco1 WXVL_AK1437SB00054 [1,1,0,0,0,0|2,0,0]=4 951 B13R1.554 CC[C@@H](C)C(=O)NCc1cnco1 WXVL_AK1437SB00054 [1,1,0,0,0,0|2,0,0]=4 952 B13R1.554 CC[C@H](O)C(=O)NCc1ccc[nH]1 WXVL_AK00759SB3573 [1,1,0,0,0,0|2,0,0]=4 953 B13R1.554 CC[C@H](O)C(=O)NCc1ccc[nH]1 WXVL_AK00759SB3573 [1,1,0,0,0,0|2,0,0]=4 954 B13R1.554 CC[C@H](O)C(=O)NCc1ccco1 WXVL_AK0010SB3573 [1,1,0,0,0,0|1,0,0]=3 955 B13R1.554 CC[C@H](O)C(=O)NCc1ccco1 WXVL_AK0010SB3573 [1,1,0,0,0,0|1,0,0]=3 956 B13R1.554 CC[C@H](O)C(=O)NCc1cccs1 WXVL_AK0014SB3573 [1,1,0,0,0,0|1,1,0]=4 957 B13R1.554 CC[C@H](O)C(=O)NCc1cccs1 WXVL_AK0014SB3573 [1,1,0,0,0,0|1,1,0]=4 958 B13R1.554 CC[C@H](O)C(=O)NCc1cnco1 WXVL_AK1437SB3573 [1,1,0,0,0,0|2,0,0]=4 959 B13R1.554 CC[C@H](O)C(=O)NCc1cnco1 WXVL_AK1437SB3573 [1,1,0,0,0,0|2,0,0]=4 960 B13R1.554 CO[C@H](C)C(=O)NCc1ccco1 WXVL_AK0010SB2926 [1,1,0,0,0,0|2,0,0]=4 961 B13R1.554 CO[C@H](C)C(=O)NCc1ccco1 WXVL_AK0010SB2926 [1,1,0,0,0,0|2,0,0]=4 962 B13R1.593 CC(C)CC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0063 [1,1,0,0,0,0|2,0,0]=4 963 B13R1.593 CC(C)CC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0063 [1,1,0,0,0,0|2,0,0]=4 964 B13R1.593 CC(C)CC(=O)NCc1ccco1 WXVL_AK0010SB0063 [1,1,0,0,0,0|1,0,0]=3 965 B13R1.593 CC(C)CC(=O)NCc1ccco1 WXVL_AK0010SB0063 [1,1,0,0,0,0|1,0,0]=3 966 B13R1.593 CC(C)CC(=O)NCc1cccs1 WXVL_AK0014SB0063 [1,1,0,0,0,0|1,1,0]=4 967 B13R1.593 CC(C)CC(=O)NCc1cccs1 WXVL_AK0014SB0063 [1,1,0,0,0,0|1,1,0]=4 968 B13R1.593 CC(C)CC(=O)NCc1cnco1 WXVL_AK1437SB0063 [1,1,0,0,0,0|2,0,0]=4 969 B13R1.593 CC(C)CC(=O)NCc1cnco1 WXVL_AK1437SB0063 [1,1,0,0,0,0|2,0,0]=4 970 B13R1.593 CC(C)NC(=O)CCc1ccco1 WXVL_AK0030SA0167 [1,1,0,0,0,0|2,0,0]=4 971 B13R1.593 CC(C)NC(=O)CCc1ccco1 WXVL_AK0030SA0167 [1,1,0,0,0,0|2,0,0]=4 972 B13R1.593 CC(O)CC(=O)NCc1ccc[nH]1 WXVL_AK00759SB3643 [1,1,0,0,0,0|2,0,0]=4 973 B13R1.593 CC(O)CC(=O)NCc1ccc[nH]1 WXVL_AK00759SB3643 [1,1,0,0,0,0|2,0,0]=4 974 B13R1.593 CC(O)CC(=O)NCc1ccco1 WXVL_AK0010SB3643 [1,1,0,0,0,0|1,0,0]=3 975 B13R1.593 CC(O)CC(=O)NCc1ccco1 WXVL_AK0010SB3643 [1,1,0,0,0,0|1,0,0]=3 976 B13R1.593 CC(O)CC(=O)NCc1cccs1 WXVL_AK0014SB3643 [1,1,0,0,0,0|1,1,0]=4 977 B13R1.593 CC(O)CC(=O)NCc1cccs1 WXVL_AK0014SB3643 [1,1,0,0,0,0|1,1,0]=4 978 B13R1.593 CC(O)CC(=O)NCc1cnco1 WXVL_AK1437SB3643 [1,1,0,0,0,0|2,0,0]=4 979 B13R1.593 CC(O)CC(=O)NCc1cnco1 WXVL_AK1437SB3643 [1,1,0,0,0,0|2,0,0]=4 980 B13R1.593 CN(C)CC(=O)NCc1ccco1 WXVL_AK0010SB0085 [1,1,0,0,0,0|2,0,0]=4 981 B13R1.593 CN(C)CC(=O)NCc1ccco1 WXVL_AK0010SB0085 [1,1,0,0,0,0|2,0,0]=4 982 B13R1.1330 CCCS(=O)(=O)NCc1ccco1 WXVL_AK0010HU0030 [1,1,0,0,0,0|2,0,0]=4 983 B13R1.1330 CCCS(=O)(=O)NCc1ccco1 WXVL_AK0010HU0030 [1,1,0,0,0,0|2,0,0]=4 984 B13R1.43 CCCNC(=O)Cc1cc(cs1)Br WXVL_AK00504SA0181 [0,1,0,0,1,0|1,1,0]=4 985 B13R1.43 CCCNC(=O)Cc1cc(cs1)Br WXVL_AK00504SA0181 [0,1,0,0,1,0|1,1,0]=4 986 B13R1.43 CCCNC(=O)Cc1cc(no1)C WXVL_AK00504SA0039 [0,1,0,0,1,0|2,0,0]=4 987 B13R1.43 CCCNC(=O)Cc1cc(no1)C WXVL_AK00504SA0039 [0,1,0,0,1,0|2,0,0]=4 988 B13R1.43 CCCNC(=O)Cc1ccc(s1)Cl WXVL_AK00504SA0043 [0,1,0,0,1,0|1,1,0]=4 989 B13R1.43 CCCNC(=O)Cc1ccc(s1)Cl WXVL_AK00504SA0043 [0,1,0,0,1,0|1,1,0]=4 990 B13R1.166 CCCNC(=O)C(=O)c1ccco1 WXVL_AK00504SA0049 [0,1,0,0,1,0|1,0,1]=4 991 B13R1.166 CCCNC(=O)C(=O)c1ccco1 WXVL_AK00504SA0049 [0,1,0,0,1,0|1,0,1]=4 992 B13R1.166 CCCNC(=O)C(C)c1cccs1 WXVL_AK00504SA1203 [0,1,0,0,1,0|1,1,0]=4 993 B13R1.166 CCCNC(=O)C(C)c1cccs1 WXVL_AK00504SA1203 [0,1,0,0,1,0|1,1,0]=4 994 B13R1.344 CC(C)CCC(=O)Nc1ccno1 WXVL_AF0588SB0354 [0,1,0,0,1,0|2,0,0]=4 995 B13R1.344 CC(C)CCC(=O)Nc1ccno1 WXVL_AF0588SB0354 [0,1,0,0,1,0|2,0,0]=4 996 B13R1.344 CC(C)CCC(=O)Nc1ncco1 WXVL_AF0235SB0354 [0,1,0,0,1,0|2,0,0]=4 997 B13R1.344 CC(C)CCC(=O)Nc1ncco1 WXVL_AF0235SB0354 [0,1,0,0,1,0|2,0,0]=4 998 B13R1.344 CC(C)CNC(=O)Cc1cccs1 WXVL_AK00544SA0018 [0,1,0,0,1,0|1,1,0]=4 999 B13R1.344 CC(C)CNC(=O)Cc1cccs1 WXVL_AK00544SA0018 [0,1,0,0,1,0|1,1,0]=4 1000 B13R1.344 CC(O)CNC(=O)Cc1cccs1 WXVL_AK0052SA0018 [0,1,0,0,1,0|1,1,0]=4 1001 B13R1.344 CC(O)CNC(=O)Cc1cccs1 WXVL_AK0052SA0018 [0,1,0,0,1,0|1,1,0]=4 1002 B13R1.344 C[C@H](O)CNC(=O)Cc1cccs1 WXVL_AK0113SA0018 [0,1,0,0,1,0|1,1,0]=4 1003 B13R1.344 C[C@H](O)CNC(=O)Cc1cccs1 WXVL_AK0113SA0018 [0,1,0,0,1,0|1,1,0]=4 1004 B13R1.545 CCC(C)CC(=O)Nc1ccno1 WXVL_AF0588SB0353 [0,1,0,0,1,0|2,0,0]=4 1005 B13R1.545 CCC(C)CC(=O)Nc1ccno1 WXVL_AF0588SB0353 [0,1,0,0,1,0|2,0,0]=4 1006 B13R1.545 CCC(C)CC(=O)Nc1ncco1 WXVL_AF0235SB0353 [0,1,0,0,1,0|2,0,0]=4 1007 B13R1.545 CCC(C)CC(=O)Nc1ncco1 WXVL_AF0235SB0353 [0,1,0,0,1,0|2,0,0]=4 1008 B13R1.545 CCC(O)CC(=O)Nc1ccno1 WXVL_AF0588SB4092 [0,1,0,0,1,0|2,0,0]=4 1009 B13R1.545 CCC(O)CC(=O)Nc1ccno1 WXVL_AF0588SB4092 [0,1,0,0,1,0|2,0,0]=4 1010 B13R1.545 CCC(O)CC(=O)Nc1ncco1 WXVL_AF0235SB4092 [0,1,0,0,1,0|2,0,0]=4 1011 B13R1.545 CCC(O)CC(=O)Nc1ncco1 WXVL_AF0235SB4092 [0,1,0,0,1,0|2,0,0]=4 1012 B13R1.545 CC[C@@H](C)CC(=O)Nc1ccno1 WXVL_AF0588SB8650 [0,1,0,0,1,0|2,0,0]=4 1013 B13R1.545 CC[C@@H](C)CC(=O)Nc1ccno1 WXVL_AF0588SB8650 [0,1,0,0,1,0|2,0,0]=4 1014 B13R1.545 CC[C@@H](C)CC(=O)Nc1ncco1 WXVL_AF0235SB8650 [0,1,0,0,1,0|2,0,0]=4 1015 B13R1.545 CC[C@@H](C)CC(=O)Nc1ncco1 WXVL_AF0235SB8650 [0,1,0,0,1,0|2,0,0]=4 1016 B13R1.545 CC[C@H](C)NC(=O)Cc1cccs1 WXVL_AK00678SA0018 [0,1,0,0,1,0|1,1,0]=4 1017 B13R1.545 CC[C@H](C)NC(=O)Cc1cccs1 WXVL_AK00678SA0018 [0,1,0,0,1,0|1,1,0]=4 1018 B15R1.78 CCCCNC(=O)CCc1ccccc1 WXVL_AK00588SB0067 [0,1,0,0,0,1|2,0,0]=4 1019 B15R1.78 CCCCNC(=O)CCc1ccccc1 WXVL_AK00588SB0067 [0,1,0,0,0,1|2,0,0]=4 1020 B15R1.78 CCCCNC(=O)CCc1ccccn1 WXVL_AK00588SA0316 [0,1,0,0,0,1|2,0,0]=4 1021 B15R1.78 CCCCNC(=O)CCc1ccccn1 WXVL_AK00588SA0316 [0,1,0,0,0,1|2,0,0]=4 1022 B15R1.78 CCCCNC(=O)CCc1cccnc1 WXVL_AK00588SA0031 [0,1,0,0,0,1|2,0,0]=4 1023 B15R1.78 CCCCNC(=O)CCc1cccnc1 WXVL_AK00588SA0031 [0,1,0,0,0,1|2,0,0]=4 1024 B15R1.78 CCCCNC(=O)CCc1cnccn1 WXVL_AK00588SA2354 [0,1,0,0,0,1|2,0,0]=4 1025 B15R1.78 CCCCNC(=O)CCc1cnccn1 WXVL_AK00588SA2354 [0,1,0,0,0,1|2,0,0]=4 1026 B15R1.78 O=C(CCCCBr)NCc1ccccc1 WXVL_AK00502SB3153 [0,1,0,0,0,1|2,0,0]=4 1027 B15R1.78 O=C(CCCCBr)NCc1ccccc1 WXVL_AK00502SB3153 [0,1,0,0,0,1|2,0,0]=4 1028 B15R1.78 O=C(CCCCBr)NCc1ccccn1 WXVL_AK0018SB3153 [0,1,0,0,0,1|2,0,0]=4 1029 B15R1.78 O=C(CCCCBr)NCc1ccccn1 WXVL_AK0018SB3153 [0,1,0,0,0,1|2,0,0]=4 1030 B15R1.78 O=C(CCCCBr)NCc1cccnc1 WXVL_AK0020SB3153 [0,1,0,0,0,1|2,0,0]=4 1031 B15R1.78 O=C(CCCCBr)NCc1cccnc1 WXVL_AK0020SB3153 [0,1,0,0,0,1|2,0,0]=4 1032 B15R1.78 O=C(CCCCBr)NCc1ccncc1 WXVL_AK0021SB3153 [0,1,0,0,0,1|2,0,0]=4 1033 B15R1.78 O=C(CCCCBr)NCc1ccncc1 WXVL_AK0021SB3153 [0,1,0,0,0,1|2,0,0]=4 1034 B15R1.78 O=C(CCCCBr)NCc1ccncn1 WXVL_AK1356SB3153 [0,1,0,0,0,1|2,0,0]=4 1035 B15R1.78 O=C(CCCCBr)NCc1ccncn1 WXVL_AK1356SB3153 [0,1,0,0,0,1|2,0,0]=4 1036 B15R1.78 O=C(CCCCBr)NCc1cnccn1 WXVL_AK00262SB3153 [0,1,0,0,0,1|2,0,0]=4 1037 B15R1.78 O=C(CCCCBr)NCc1cnccn1 WXVL_AK00262SB3153 [0,1,0,0,0,1|2,0,0]=4 1038 B15R1.78 O=C(CCCCBr)NCc1ncccn1 WXVL_AK0279SB3153 [0,1,0,0,0,1|2,0,0]=4 1039 B15R1.78 O=C(CCCCBr)NCc1ncccn1 WXVL_AK0279SB3153 [0,1,0,0,0,1|2,0,0]=4 1040 B15R1.78 O=C(CCCCCl)NCc1ccccc1 WXVL_AK00502SB0379 [0,1,0,0,0,1|2,0,0]=4 1041 B15R1.78 O=C(CCCCCl)NCc1ccccc1 WXVL_AK00502SB0379 [0,1,0,0,0,1|2,0,0]=4 1042 B15R1.78 O=C(CCCCCl)NCc1ccccn1 WXVL_AK0018SB0379 [0,1,0,0,0,1|2,0,0]=4 1043 B15R1.78 O=C(CCCCCl)NCc1ccccn1 WXVL_AK0018SB0379 [0,1,0,0,0,1|2,0,0]=4 1044 B15R1.78 O=C(CCCCCl)NCc1cccnc1 WXVL_AK0020SB0379 [0,1,0,0,0,1|2,0,0]=4 1045 B15R1.78 O=C(CCCCCl)NCc1cccnc1 WXVL_AK0020SB0379 [0,1,0,0,0,1|2,0,0]=4 1046 B15R1.78 O=C(CCCCCl)NCc1ccncc1 WXVL_AK0021SB0379 [0,1,0,0,0,1|2,0,0]=4 1047 B15R1.78 O=C(CCCCCl)NCc1ccncc1 WXVL_AK0021SB0379 [0,1,0,0,0,1|2,0,0]=4 1048 B15R1.78 O=C(CCCCCl)NCc1ccncn1 WXVL_AK1356SB0379 [0,1,0,0,0,1|2,0,0]=4 1049 B15R1.78 O=C(CCCCCl)NCc1ccncn1 WXVL_AK1356SB0379 [0,1,0,0,0,1|2,0,0]=4 1050 B15R1.78 O=C(CCCCCl)NCc1cnccn1 WXVL_AK00262SB0379 [0,1,0,0,0,1|2,0,0]=4 1051 B15R1.78 O=C(CCCCCl)NCc1cnccn1 WXVL_AK00262SB0379 [0,1,0,0,0,1|2,0,0]=4 1052 B15R1.78 O=C(CCCCCl)NCc1ncccn1 WXVL_AK0279SB0379 [0,1,0,0,0,1|2,0,0]=4 1053 B15R1.78 O=C(CCCCCl)NCc1ncccn1 WXVL_AK0279SB0379 [0,1,0,0,0,1|2,0,0]=4 1054 B15R1.741 CCC(C)CC(=O)NCc1ccccc1 WXVL_AK00502SB0353 [0,1,0,0,0,1|2,0,0]=4 1055 B15R1.741 CCC(C)CC(=O)NCc1ccccc1 WXVL_AK00502SB0353 [0,1,0,0,0,1|2,0,0]=4 1056 B15R1.741 CCC(C)CC(=O)NCc1ccccn1 WXVL_AK0018SB0353 [0,1,0,0,0,1|2,0,0]=4 1057 B15R1.741 CCC(C)CC(=O)NCc1ccccn1 WXVL_AK0018SB0353 [0,1,0,0,0,1|2,0,0]=4 1058 B15R1.741 CCC(C)CC(=O)NCc1cccnc1 WXVL_AK0020SB0353 [0,1,0,0,0,1|2,0,0]=4 1059 B15R1.741 CCC(C)CC(=O)NCc1cccnc1 WXVL_AK0020SB0353 [0,1,0,0,0,1|2,0,0]=4 1060 B15R1.741 CCC(C)CC(=O)NCc1ccncc1 WXVL_AK0021SB0353 [0,1,0,0,0,1|2,0,0]=4 1061 B15R1.741 CCC(C)CC(=O)NCc1ccncc1 WXVL_AK0021SB0353 [0,1,0,0,0,1|2,0,0]=4 1062 B15R1.741 CCC(C)CC(=O)NCc1ccncn1 WXVL_AK1356SB0353 [0,1,0,0,0,1|2,0,0]=4 1063 B15R1.741 CCC(C)CC(=O)NCc1ccncn1 WXVL_AK1356SB0353 [0,1,0,0,0,1|2,0,0]=4 1064 B15R1.741 CCC(C)CC(=O)NCc1cnccn1 WXVL_AK00262SB0353 [0,1,0,0,0,1|2,0,0]=4 1065 B15R1.741 CCC(C)CC(=O)NCc1cnccn1 WXVL_AK00262SB0353 [0,1,0,0,0,1|2,0,0]=4 1066 B15R1.741 CCC(C)CC(=O)NCc1ncccn1 WXVL_AK0279SB0353 [0,1,0,0,0,1|2,0,0]=4 1067 B15R1.741 CCC(C)CC(=O)NCc1ncccn1 WXVL_AK0279SB0353 [0,1,0,0,0,1|2,0,0]=4 1068 B15R1.741 CCC(O)CC(=O)NCc1ccccc1 WXVL_AK00502SB4092 [0,1,0,0,0,1|2,0,0]=4 1069 B15R1.741 CCC(O)CC(=O)NCc1ccccc1 WXVL_AK00502SB4092 [0,1,0,0,0,1|2,0,0]=4 1070 B15R1.741 CCC(O)CC(=O)NCc1ccccn1 WXVL_AK0018SB4092 [0,1,0,0,0,1|2,0,0]=4 1071 B15R1.741 CCC(O)CC(=O)NCc1ccccn1 WXVL_AK0018SB4092 [0,1,0,0,0,1|2,0,0]=4 1072 B15R1.741 CCC(O)CC(=O)NCc1cccnc1 WXVL_AK0020SB4092 [0,1,0,0,0,1|2,0,0]=4 1073 B15R1.741 CCC(O)CC(=O)NCc1cccnc1 WXVL_AK0020SB4092 [0,1,0,0,0,1|2,0,0]=4 1074 B15R1.741 CCC(O)CC(=O)NCc1ccncc1 WXVL_AK0021SB4092 [0,1,0,0,0,1|2,0,0]=4 1075 B15R1.741 CCC(O)CC(=O)NCc1ccncc1 WXVL_AK0021SB4092 [0,1,0,0,0,1|2,0,0]=4 1076 B15R1.741 CCC(O)CC(=O)NCc1ccncn1 WXVL_AK1356SB4092 [0,1,0,0,0,1|2,0,0]=4 1077 B15R1.741 CCC(O)CC(=O)NCc1ccncn1 WXVL_AK1356SB4092 [0,1,0,0,0,1|2,0,0]=4 1078 B15R1.741 CCC(O)CC(=O)NCc1cnccn1 WXVL_AK00262SB4092 [0,1,0,0,0,1|2,0,0]=4 1079 B15R1.741 CCC(O)CC(=O)NCc1cnccn1 WXVL_AK00262SB4092 [0,1,0,0,0,1|2,0,0]=4 1080 B15R1.741 CCC(O)CC(=O)NCc1ncccn1 WXVL_AK0279SB4092 [0,1,0,0,0,1|2,0,0]=4 1081 B15R1.741 CCC(O)CC(=O)NCc1ncccn1 WXVL_AK0279SB4092 [0,1,0,0,0,1|2,0,0]=4 1082 B15R1.741 CC[C@@H](C)CC(=O)NCc1ccccc1 WXVL_AK00502SB8650 [0,1,0,0,0,1|2,0,0]=4 1083 B15R1.741 CC[C@@H](C)CC(=O)NCc1ccccc1 WXVL_AK00502SB8650 [0,1,0,0,0,1|2,0,0]=4 1084 B15R1.741 CC[C@@H](C)CC(=O)NCc1ccccn1 WXVL_AK0018SB8650 [0,1,0,0,0,1|2,0,0]=4 1085 B15R1.741 CC[C@@H](C)CC(=O)NCc1ccccn1 WXVL_AK0018SB8650 [0,1,0,0,0,1|2,0,0]=4 1086 B15R1.741 CC[C@@H](C)CC(=O)NCc1cccnc1 WXVL_AK0020SB8650 [0,1,0,0,0,1|2,0,0]=4 1087 B15R1.741 CC[C@@H](C)CC(=O)NCc1cccnc1 WXVL_AK0020SB8650 [0,1,0,0,0,1|2,0,0]=4 1088 B15R1.741 CC[C@@H](C)CC(=O)NCc1ccncc1 WXVL_AK0021SB8650 [0,1,0,0,0,1|2,0,0]=4 1089 B15R1.741 CC[C@@H](C)CC(=O)NCc1ccncc1 WXVL_AK0021SB8650 [0,1,0,0,0,1|2,0,0]=4 1090 B15R1.741 CC[C@@H](C)CC(=O)NCc1ccncn1 WXVL_AK1356SB8650 [0,1,0,0,0,1|2,0,0]=4 1091 B15R1.741 CC[C@@H](C)CC(=O)NCc1ccncn1 WXVL_AK1356SB8650 [0,1,0,0,0,1|2,0,0]=4 1092 B15R1.741 CC[C@@H](C)CC(=O)NCc1cnccn1 WXVL_AK00262SB8650 [0,1,0,0,0,1|2,0,0]=4 1093 B15R1.741 CC[C@@H](C)CC(=O)NCc1cnccn1 WXVL_AK00262SB8650 [0,1,0,0,0,1|2,0,0]=4 1094 B15R1.741 CC[C@@H](C)CC(=O)NCc1ncccn1 WXVL_AK0279SB8650 [0,1,0,0,0,1|2,0,0]=4 1095 B15R1.741 CC[C@@H](C)CC(=O)NCc1ncccn1 WXVL_AK0279SB8650 [0,1,0,0,0,1|2,0,0]=4 1096 B15R1.826 CCCC(C)C(=O)NCc1ccccc1 WXVL_AK00502SB0352 [0,1,0,0,0,1|2,0,0]=4 1097 B15R1.826 CCCC(C)C(=O)NCc1ccccc1 WXVL_AK00502SB0352 [0,1,0,0,0,1|2,0,0]=4 1098 B15R1.826 CCCC(C)C(=O)NCc1ccccn1 WXVL_AK0018SB0352 [0,1,0,0,0,1|2,0,0]=4 1099 B15R1.826 CCCC(C)C(=O)NCc1ccccn1 WXVL_AK0018SB0352 [0,1,0,0,0,1|2,0,0]=4 1100 B15R1.826 CCCC(C)C(=O)NCc1cccnc1 WXVL_AK0020SB0352 [0,1,0,0,0,1|2,0,0]=4 1101 B15R1.826 CCCC(C)C(=O)NCc1cccnc1 WXVL_AK0020SB0352 [0,1,0,0,0,1|2,0,0]=4 1102 B15R1.826 CCCC(C)C(=O)NCc1ccncc1 WXVL_AK0021SB0352 [0,1,0,0,0,1|2,0,0]=4 1103 B15R1.826 CCCC(C)C(=O)NCc1ccncc1 WXVL_AK0021SB0352 [0,1,0,0,0,1|2,0,0]=4 1104 B15R1.826 CCCC(C)C(=O)NCc1ccncn1 WXVL_AK1356SB0352 [0,1,0,0,0,1|2,0,0]=4 1105 B15R1.826 CCCC(C)C(=O)NCc1ccncn1 WXVL_AK1356SB0352 [0,1,0,0,0,1|2,0,0]=4 1106 B15R1.826 CCCC(C)C(=O)NCc1cnccn1 WXVL_AK00262SB0352 [0,1,0,0,0,1|2,0,0]=4 1107 B15R1.826 CCCC(C)C(=O)NCc1cnccn1 WXVL_AK00262SB0352 [0,1,0,0,0,1|2,0,0]=4 1108 B15R1.826 CCCC(C)C(=O)NCc1ncccn1 WXVL_AK0279SB0352 [0,1,0,0,0,1|2,0,0]=4 1109 B15R1.826 CCCC(C)C(=O)NCc1ncccn1 WXVL_AK0279SB0352 [0,1,0,0,0,1|2,0,0]=4 1110 B15R1.826 CCC[C@H](O)C(=O)NCc1ccccc1 WXVL_AK00502SB3627 [0,1,0,0,0,1|2,0,0]=4 1111 B15R1.826 CCC[C@H](O)C(=O)NCc1ccccc1 WXVL_AK00502SB3627 [0,1,0,0,0,1|2,0,0]=4 1112 B15R1.826 CCC[C@H](O)C(=O)NCc1ccccn1 WXVL_AK0018SB3627 [0,1,0,0,0,1|2,0,0]=4 1113 B15R1.826 CCC[C@H](O)C(=O)NCc1ccccn1 WXVL_AK0018SB3627 [0,1,0,0,0,1|2,0,0]=4 1114 B15R1.826 CCC[C@H](O)C(=O)NCc1cccnc1 WXVL_AK0020SB3627 [0,1,0,0,0,1|2,0,0]=4 1115 B15R1.826 CCC[C@H](O)C(=O)NCc1cccnc1 WXVL_AK0020SB3627 [0,1,0,0,0,1|2,0,0]=4 1116 B15R1.826 CCC[C@H](O)C(=O)NCc1ccncc1 WXVL_AK0021SB3627 [0,1,0,0,0,1|2,0,0]=4 1117 B15R1.826 CCC[C@H](O)C(=O)NCc1ccncc1 WXVL_AK0021SB3627 [0,1,0,0,0,1|2,0,0]=4 1118 B15R1.826 CCC[C@H](O)C(=O)NCc1ccncn1 WXVL_AK1356SB3627 [0,1,0,0,0,1|2,0,0]=4 1119 B15R1.826 CCC[C@H](O)C(=O)NCc1ccncn1 WXVL_AK1356SB3627 [0,1,0,0,0,1|2,0,0]=4 1120 B15R1.826 CCC[C@H](O)C(=O)NCc1cnccn1 WXVL_AK00262SB3627 [0,1,0,0,0,1|2,0,0]=4 1121 B15R1.826 CCC[C@H](O)C(=O)NCc1cnccn1 WXVL_AK00262SB3627 [0,1,0,0,0,1|2,0,0]=4 1122 B15R1.826 CCC[C@H](O)C(=O)NCc1ncccn1 WXVL_AK0279SB3627 [0,1,0,0,0,1|2,0,0]=4 1123 B15R1.826 CCC[C@H](O)C(=O)NCc1ncccn1 WXVL_AK0279SB3627 [0,1,0,0,0,1|2,0,0]=4 1124 B15R1.5919 CC(C)CCC(=O)NCc1ccccc1 WXVL_AK00502SB0354 [0,1,0,0,0,1|2,0,0]=4 1125 B15R1.5919 CC(C)CCC(=O)NCc1ccccc1 WXVL_AK00502SB0354 [0,1,0,0,0,1|2,0,0]=4 1126 B15R1.5919 CC(C)CCC(=O)NCc1ccccn1 WXVL_AK0018SB0354 [0,1,0,0,0,1|2,0,0]=4 1127 B15R1.5919 CC(C)CCC(=O)NCc1ccccn1 WXVL_AK0018SB0354 [0,1,0,0,0,1|2,0,0]=4 1128 B15R1.5919 CC(C)CCC(=O)NCc1cccnc1 WXVL_AK0020SB0354 [0,1,0,0,0,1|2,0,0]=4 1129 B15R1.5919 CC(C)CCC(=O)NCc1cccnc1 WXVL_AK0020SB0354 [0,1,0,0,0,1|2,0,0]=4 1130 B15R1.5919 CC(C)CCC(=O)NCc1ccncc1 WXVL_AK0021SB0354 [0,1,0,0,0,1|2,0,0]=4 1131 B15R1.5919 CC(C)CCC(=O)NCc1ccncc1 WXVL_AK0021SB0354 [0,1,0,0,0,1|2,0,0]=4 1132 B15R1.5919 CC(C)CCC(=O)NCc1ccncn1 WXVL_AK1356SB0354 [0,1,0,0,0,1|2,0,0]=4 1133 B15R1.5919 CC(C)CCC(=O)NCc1ccncn1 WXVL_AK1356SB0354 [0,1,0,0,0,1|2,0,0]=4 1134 B15R1.5919 CC(C)CCC(=O)NCc1cnccn1 WXVL_AK00262SB0354 [0,1,0,0,0,1|2,0,0]=4 1135 B15R1.5919 CC(C)CCC(=O)NCc1cnccn1 WXVL_AK00262SB0354 [0,1,0,0,0,1|2,0,0]=4 1136 B15R1.5919 CC(C)CCC(=O)NCc1ncccn1 WXVL_AK0279SB0354 [0,1,0,0,0,1|2,0,0]=4 1137 B15R1.5919 CC(C)CCC(=O)NCc1ncccn1 WXVL_AK0279SB0354 [0,1,0,0,0,1|2,0,0]=4 1138 B15R1.739 CCC(C)CC(=O)NCCc1ccco1 WXVL_AK0989SB0353 [0,1,0,0,0,1|1,0,0]=3 1139 B15R1.739 CCC(C)CC(=O)NCCc1ccco1 WXVL_AK0989SB0353 [0,1,0,0,0,1|1,0,0]=3 1140 B15R1.739 CCC(C)CC(=O)NCCc1cccs1 WXVL_AK0098SB0353 [0,1,0,0,0,1|1,1,0]=4 1141 B15R1.739 CCC(C)CC(=O)NCCc1cccs1 WXVL_AK0098SB0353 [0,1,0,0,0,1|1,1,0]=4 1142 B15R1.739 CCC(O)CC(=O)NCCc1ccco1 WXVL_AK0989SB4092 [0,1,0,0,0,1|1,0,0]=3 1143 B15R1.739 CCC(O)CC(=O)NCCc1ccco1 WXVL_AK0989SB4092 [0,1,0,0,0,1|1,0,0]=3 1144 B15R1.739 CCC(O)CC(=O)NCCc1cccs1 WXVL_AK0098SB4092 [0,1,0,0,0,1|1,1,0]=4 1145 B15R1.739 CCC(O)CC(=O)NCCc1cccs1 WXVL_AK0098SB4092 [0,1,0,0,0,1|1,1,0]=4 1146 B15R1.739 CC[C@@H](C)CC(=O)NCCc1ccco1 WXVL_AK0989SB8650 [0,1,0,0,0,1|1,0,0]=3 1147 B15R1.739 CC[C@@H](C)CC(=O)NCCc1ccco1 WXVL_AK0989SB8650 [0,1,0,0,0,1|1,0,0]=3 1148 B15R1.739 CC[C@@H](C)CC(=O)NCCc1cccs1 WXVL_AK0098SB8650 [0,1,0,0,0,1|1,1,0]=4 1149 B15R1.739 CC[C@@H](C)CC(=O)NCCc1cccs1 WXVL_AK0098SB8650 [0,1,0,0,0,1|1,1,0]=4 1150 B15R1.1376 C#CCCCC(=O)NCCc1ccco1 WXVL_AK0989SB2709 [0,1,0,0,0,1|1,0,1]=4 1151 B15R1.1376 C#CCCCC(=O)NCCc1ccco1 WXVL_AK0989SB2709 [0,1,0,0,0,1|1,0,1]=4 1152 B15R1.1376 C=CCCCC(=O)NCCc1ccco1 WXVL_AK0989SB2920 [0,1,0,0,0,1|1,0,1]=4 1153 B15R1.1376 C=CCCCC(=O)NCCc1ccco1 WXVL_AK0989SB2920 [0,1,0,0,0,1|1,0,1]=4 1154 B15R1.1376 CC/C=C/CC(=O)NCCc1ccco1 WXVL_AK0989SB0349 [0,1,0,0,0,1|1,0,1]=4 1155 B15R1.1376 CC/C=C/CC(=O)NCCc1ccco1 WXVL_AK0989SB0349 [0,1,0,0,0,1|1,0,1]=4 1156 B15R1.1376 O=C(CCCCBr)NCCc1ccco1 WXVL_AK0989SB3153 [0,1,0,0,0,1|1,0,0]=3 1157 B15R1.1376 O=C(CCCCBr)NCCc1ccco1 WXVL_AK0989SB3153 [0,1,0,0,0,1|1,0,0]=3 1158 B15R1.1376 O=C(CCCCBr)NCCc1cccs1 WXVL_AK0098SB3153 [0,1,0,0,0,1|1,1,0]=4 1159 B15R1.1376 O=C(CCCCBr)NCCc1cccs1 WXVL_AK0098SB3153 [0,1,0,0,0,1|1,1,0]=4 1160 B15R1.1376 O=C(CCCCCl)NCCc1ccco1 WXVL_AK0989SB0379 [0,1,0,0,0,1|1,0,0]=3 1161 B15R1.1376 O=C(CCCCCl)NCCc1ccco1 WXVL_AK0989SB0379 [0,1,0,0,0,1|1,0,0]=3 1162 B15R1.1376 O=C(CCCCCl)NCCc1cccs1 WXVL_AK0098SB0379 [0,1,0,0,0,1|1,1,0]=4 1163 B15R1.1376 O=C(CCCCCl)NCCc1cccs1 WXVL_AK0098SB0379 [0,1,0,0,0,1|1,1,0]=4 1164 B15R1.1376 O=C(NCCCCl)NCCc1ccco1 WXVL_AK0989YV0130 [0,1,0,0,0,1|2,0,0]=4 1165 B15R1.1376 O=C(NCCCCl)NCCc1ccco1 WXVL_AK0989YV0130 [0,1,0,0,0,1|2,0,0]=4 1166 B15R1.9921 CCCC(C)C(=O)NCCc1ccco1 WXVL_AK0989SB0352 [0,1,0,0,0,1|1,0,0]=3 1167 B15R1.9921 CCCC(C)C(=O)NCCc1ccco1 WXVL_AK0989SB0352 [0,1,0,0,0,1|1,0,0]=3 1168 B15R1.9921 CCCC(C)C(=O)NCCc1cccs1 WXVL_AK0098SB0352 [0,1,0,0,0,1|1,1,0]=4 1169 B15R1.9921 CCCC(C)C(=O)NCCc1cccs1 WXVL_AK0098SB0352 [0,1,0,0,0,1|1,1,0]=4 1170 B15R1.9921 CCC[C@H](O)C(=O)NCCc1ccco1 WXVL_AK0989SB3627 [0,1,0,0,0,1|1,0,0]=3 1171 B15R1.9921 CCC[C@H](O)C(=O)NCCc1ccco1 WXVL_AK0989SB3627 [0,1,0,0,0,1|1,0,0]=3 1172 B15R1.9921 CCC[C@H](O)C(=O)NCCc1cccs1 WXVL_AK0098SB3627 [0,1,0,0,0,1|1,1,0]=4 1173 B15R1.9921 CCC[C@H](O)C(=O)NCCc1cccs1 WXVL_AK0098SB3627 [0,1,0,0,0,1|1,1,0]=4 1174 B15R1.12056 CCCCS(=O)(=O)NCCc1ccco1 WXVL_AK0989HU0031 [0,1,0,0,0,1|2,0,0]=4 1175 B15R1.12056 CCCCS(=O)(=O)NCCc1ccco1 WXVL_AK0989HU0031 [0,1,0,0,0,1|2,0,0]=4 1176 B15R1.12292 CC(=O)CCC(=O)NCCc1ccco1 WXVL_AK0989SB0072 [0,1,0,0,0,1|1,0,1]=4 1177 B15R1.12292 CC(=O)CCC(=O)NCCc1ccco1 WXVL_AK0989SB0072 [0,1,0,0,0,1|1,0,1]=4 1178 B15R1.12292 CC(C)CCC(=O)NCCc1ccco1 WXVL_AK0989SB0354 [0,1,0,0,0,1|1,0,0]=3 1179 B15R1.12292 CC(C)CCC(=O)NCCc1ccco1 WXVL_AK0989SB0354 [0,1,0,0,0,1|1,0,0]=3 1180 B15R1.12292 CC(C)CCC(=O)NCCc1cccs1 WXVL_AK0098SB0354 [0,1,0,0,0,1|1,1,0]=4 1181 B15R1.12292 CC(C)CCC(=O)NCCc1cccs1 WXVL_AK0098SB0354 [0,1,0,0,0,1|1,1,0]=4 1182 B15R1.12292 CC(C)OCC(=O)NCCc1ccco1 WXVL_AK0989SB0213 [0,1,0,0,0,1|2,0,0]=4 1183 B15R1.12292 CC(C)OCC(=O)NCCc1ccco1 WXVL_AK0989SB0213 [0,1,0,0,0,1|2,0,0]=4 1184 B15R1.12292 CN(C)CCC(=O)NCCc1ccco1 WXVL_AK0989SB00052 [0,1,0,0,0,1|2,0,0]=4 1185 B15R1.12292 CN(C)CCC(=O)NCCc1ccco1 WXVL_AK0989SB00052 [0,1,0,0,0,1|2,0,0]=4 1186 B15R1.51 CC(NC(=O)CCCCBr)c1ccno1 WXVL_AK6536SB3153 [0,2,0,0,0,0|2,0,0]=4 1187 B15R1.51 CC(NC(=O)CCCCBr)c1ccno1 WXVL_AK6536SB3153 [0,2,0,0,0,0|2,0,0]=4 1188 B15R1.51 CC(NC(=O)CCCCCl)c1ccno1 WXVL_AK6536SB0379 [0,2,0,0,0,0|2,0,0]=4 1189 B15R1.51 CC(NC(=O)CCCCCl)c1ccno1 WXVL_AK6536SB0379 [0,2,0,0,0,0|2,0,0]=4 1190 B15R1.51 C[C@H](NC(=O)CCCCBr)c1cccs1 WXVL_AK00667SB3153 [0,2,0,0,0,0|1,1,0]=4 1191 B15R1.51 C[C@H](NC(=O)CCCCBr)c1cccs1 WXVL_AK00667SB3153 [0,2,0,0,0,0|1,1,0]=4 1192 B15R1.51 C[C@H](NC(=O)CCCCCl)c1cccs1 WXVL_AK00667SB0379 [0,2,0,0,0,0|1,1,0]=4 1193 B15R1.51 C[C@H](NC(=O)CCCCCl)c1cccs1 WXVL_AK00667SB0379 [0,2,0,0,0,0|1,1,0]=4 1194 B15R1.77 CCCCNC(=O)CCc1cc(cs1)C WXVL_AK00588SA0123 [0,2,0,0,0,0|1,1,0]=4 1195 B15R1.77 CCCCNC(=O)CCc1cc(cs1)C WXVL_AK00588SA0123 [0,2,0,0,0,0|1,1,0]=4 1196 B15R1.77 CCCCNC(=O)CCc1ccc(s1)C WXVL_AK00588SA0110 [0,2,0,0,0,0|1,1,0]=4 1197 B15R1.77 CCCCNC(=O)CCc1ccc(s1)C WXVL_AK00588SA0110 [0,2,0,0,0,0|1,1,0]=4 1198 B15R1.77 Cc1cc(on1)CNC(=O)CCCCBr WXVL_AK1064SB3153 [0,2,0,0,0,0|2,0,0]=4 1199 B15R1.77 Cc1cc(on1)CNC(=O)CCCCBr WXVL_AK1064SB3153 [0,2,0,0,0,0|2,0,0]=4 1200 B15R1.77 Cc1cc(on1)CNC(=O)CCCCCl WXVL_AK1064SB0379 [0,2,0,0,0,0|2,0,0]=4 1201 B15R1.77 Cc1cc(on1)CNC(=O)CCCCCl WXVL_AK1064SB0379 [0,2,0,0,0,0|2,0,0]=4 1202 B15R1.77 Cc1ccc(s1)CNC(=O)CCCCBr WXVL_AK0276SB3153 [0,2,0,0,0,0|1,1,0]=4 1203 B15R1.77 Cc1ccc(s1)CNC(=O)CCCCBr WXVL_AK0276SB3153 [0,2,0,0,0,0|1,1,0]=4 1204 B15R1.77 Cc1ccc(s1)CNC(=O)CCCCCl WXVL_AK0276SB0379 [0,2,0,0,0,0|1,1,0]=4 1205 B15R1.77 Cc1ccc(s1)CNC(=O)CCCCCl WXVL_AK0276SB0379 [0,2,0,0,0,0|1,1,0]=4 1206 B15R1.77 O=C(CCCCBr)NCc1cc(cs1)Br WXVL_AK00192SB3153 [0,2,0,0,0,0|1,1,0]=4 1207 B15R1.77 O=C(CCCCBr)NCc1cc(cs1)Br WXVL_AK00192SB3153 [0,2,0,0,0,0|1,1,0]=4 1208 B15R1.77 O=C(CCCCBr)NCc1cc(no1)Br WXVL_AK1427SB3153 [0,2,0,0,0,0|2,0,0]=4 1209 B15R1.77 O=C(CCCCBr)NCc1cc(no1)Br WXVL_AK1427SB3153 [0,2,0,0,0,0|2,0,0]=4 1210 B15R1.77 O=C(CCCCBr)NCc1ccc(s1)Br WXVL_AK2468SB3153 [0,2,0,0,0,0|1,1,0]=4 1211 B15R1.77 O=C(CCCCBr)NCc1ccc(s1)Br WXVL_AK2468SB3153 [0,2,0,0,0,0|1,1,0]=4 1212 B15R1.77 O=C(CCCCBr)NCc1ccc(s1)Cl WXVL_AK00166SB3153 [0,2,0,0,0,0|1,1,0]=4 1213 B15R1.77 O=C(CCCCBr)NCc1ccc(s1)Cl WXVL_AK00166SB3153 [0,2,0,0,0,0|1,1,0]=4 1214 B15R1.77 O=C(CCCCCl)NCc1cc(cs1)Br WXVL_AK00192SB0379 [0,2,0,0,0,0|1,1,0]=4 1215 B15R1.77 O=C(CCCCCl)NCc1cc(cs1)Br WXVL_AK00192SB0379 [0,2,0,0,0,0|1,1,0]=4 1216 B15R1.77 O=C(CCCCCl)NCc1cc(no1)Br WXVL_AK1427SB0379 [0,2,0,0,0,0|2,0,0]=4 1217 B15R1.77 O=C(CCCCCl)NCc1cc(no1)Br WXVL_AK1427SB0379 [0,2,0,0,0,0|2,0,0]=4 1218 B15R1.77 O=C(CCCCCl)NCc1ccc(s1)Br WXVL_AK2468SB0379 [0,2,0,0,0,0|1,1,0]=4 1219 B15R1.77 O=C(CCCCCl)NCc1ccc(s1)Br WXVL_AK2468SB0379 [0,2,0,0,0,0|1,1,0]=4 1220 B15R1.77 O=C(CCCCCl)NCc1ccc(s1)Cl WXVL_AK00166SB0379 [0,2,0,0,0,0|1,1,0]=4 1221 B15R1.77 O=C(CCCCCl)NCc1ccc(s1)Cl WXVL_AK00166SB0379 [0,2,0,0,0,0|1,1,0]=4 1222 B15R1.503 CC(=CCCC(=O)NCc1ccco1)C WXVL_AK0010SB00030 [0,2,0,0,0,0|1,0,1]=4 1223 B15R1.503 CC(=CCCC(=O)NCc1ccco1)C WXVL_AK0010SB00030 [0,2,0,0,0,0|1,0,1]=4 1224 B15R1.503 CC(=O)NCCC(=O)NCc1ccco1 WXVL_AK0010SB0374 [0,2,0,0,0,0|1,0,1]=4 1225 B15R1.503 CC(=O)NCCC(=O)NCc1ccco1 WXVL_AK0010SB0374 [0,2,0,0,0,0|1,0,1]=4 1226 B15R1.503 CC(C)CCCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB1301 [0,2,0,0,0,0|2,0,0]=4 1227 B15R1.503 CC(C)CCCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB1301 [0,2,0,0,0,0|2,0,0]=4 1228 B15R1.503 CC(C)CCCC(=O)NCc1ccco1 WXVL_AK0010SB1301 [0,2,0,0,0,0|1,0,0]=3 1229 B15R1.503 CC(C)CCCC(=O)NCc1ccco1 WXVL_AK0010SB1301 [0,2,0,0,0,0|1,0,0]=3 1230 B15R1.503 CC(C)CCCC(=O)NCc1cccs1 WXVL_AK0014SB1301 [0,2,0,0,0,0|1,1,0]=4 1231 B15R1.503 CC(C)CCCC(=O)NCc1cccs1 WXVL_AK0014SB1301 [0,2,0,0,0,0|1,1,0]=4 1232 B15R1.503 CC(C)CCCC(=O)NCc1cnco1 WXVL_AK1437SB1301 [0,2,0,0,0,0|2,0,0]=4 1233 B15R1.503 CC(C)CCCC(=O)NCc1cnco1 WXVL_AK1437SB1301 [0,2,0,0,0,0|2,0,0]=4 1234 B15R1.503 CC(C)CCNC(=O)/C=C/c1ccco1 WXVL_AK0068SA0180 [0,2,0,0,0,0|1,0,1]=4 1235 B15R1.503 CC(C)CCNC(=O)/C=C/c1ccco1 WXVL_AK0068SA0180 [0,2,0,0,0,0|1,0,1]=4 1236 B15R1.503 CC(C)CCNC(=O)CCc1ccc[nH]1 WXVL_AK0068SA0009 [0,2,0,0,0,0|2,0,0]=4 1237 B15R1.503 CC(C)CCNC(=O)CCc1ccc[nH]1 WXVL_AK0068SA0009 [0,2,0,0,0,0|2,0,0]=4 1238 B15R1.503 CC(C)CCNC(=O)CCc1ccco1 WXVL_AK0068SA0167 [0,2,0,0,0,0|1,0,0]=3 1239 B15R1.503 CC(C)CCNC(=O)CCc1ccco1 WXVL_AK0068SA0167 [0,2,0,0,0,0|1,0,0]=3 1240 B15R1.503 CC(C)CCNC(=O)CCc1cccs1 WXVL_AK0068SA0303 [0,2,0,0,0,0|1,1,0]=4 1241 B15R1.503 CC(C)CCNC(=O)CCc1cccs1 WXVL_AK0068SA0303 [0,2,0,0,0,0|1,1,0]=4 1242 B15R1.503 CN(C)CCCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB00055 [0,2,0,0,0,0|2,0,0]=4 1243 B15R1.503 CN(C)CCCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB00055 [0,2,0,0,0,0|2,0,0]=4 1244 B15R1.503 CN(C)CCCC(=O)NCc1ccco1 WXVL_AK0010SB00055 [0,2,0,0,0,0|1,0,0]=3 1245 B15R1.503 CN(C)CCCC(=O)NCc1ccco1 WXVL_AK0010SB00055 [0,2,0,0,0,0|1,0,0]=3 1246 B15R1.503 CN(C)CCCC(=O)NCc1cccs1 WXVL_AK0014SB00055 [0,2,0,0,0,0|1,1,0]=4 1247 B15R1.503 CN(C)CCCC(=O)NCc1cccs1 WXVL_AK0014SB00055 [0,2,0,0,0,0|1,1,0]=4 1248 B15R1.503 CN(C)CCCC(=O)NCc1cnco1 WXVL_AK1437SB00055 [0,2,0,0,0,0|2,0,0]=4 1249 B15R1.503 CN(C)CCCC(=O)NCc1cnco1 WXVL_AK1437SB00055 [0,2,0,0,0,0|2,0,0]=4 1250 B15R1.503 CN(C)CCNC(=O)CCc1ccco1 WXVL_AK0058SA0167 [0,2,0,0,0,0|2,0,0]=4 1251 B15R1.503 CN(C)CCNC(=O)CCc1ccco1 WXVL_AK0058SA0167 [0,2,0,0,0,0|2,0,0]=4 1252 B15R1.579 C#CCCCNC(=O)CCc1ccco1 WXVL_AK00218SA0167 [0,2,0,0,0,0|1,0,1]=4 1253 B15R1.579 C#CCCCNC(=O)CCc1ccco1 WXVL_AK00218SA0167 [0,2,0,0,0,0|1,0,1]=4 1254 B15R1.579 C#CCOCCC(=O)NCc1ccco1 WXVL_AK0010SBD927 [0,2,0,0,0,0|1,0,1]=4 1255 B15R1.579 C#CCOCCC(=O)NCc1ccco1 WXVL_AK0010SBD927 [0,2,0,0,0,0|1,0,1]=4 1256 B15R1.579 CCCCCNC(=O)/C=C/c1ccco1 WXVL_AK0076SA0180 [0,2,0,0,0,0|1,0,1]=4 1257 B15R1.579 CCCCCNC(=O)/C=C/c1ccco1 WXVL_AK0076SA0180 [0,2,0,0,0,0|1,0,1]=4 1258 B15R1.579 CCCCCNC(=O)CCc1ccc[nH]1 WXVL_AK0076SA0009 [0,2,0,0,0,0|2,0,0]=4 1259 B15R1.579 CCCCCNC(=O)CCc1ccc[nH]1 WXVL_AK0076SA0009 [0,2,0,0,0,0|2,0,0]=4 1260 B15R1.579 CCCCCNC(=O)CCc1ccco1 WXVL_AK0076SA0167 [0,2,0,0,0,0|1,0,0]=3 1261 B15R1.579 CCCCCNC(=O)CCc1ccco1 WXVL_AK0076SA0167 [0,2,0,0,0,0|1,0,0]=3 1262 B15R1.579 CCCCCNC(=O)CCc1cccs1 WXVL_AK0076SA0303 [0,2,0,0,0,0|1,1,0]=4 1263 B15R1.579 CCCCCNC(=O)CCc1cccs1 WXVL_AK0076SA0303 [0,2,0,0,0,0|1,1,0]=4 1264 B15R1.579 CCSCCNC(=O)/C=C/c1ccco1 WXVL_AK00494SA0180 [0,2,0,0,0,0|1,0,1]=4 1265 B15R1.579 CCSCCNC(=O)/C=C/c1ccco1 WXVL_AK00494SA0180 [0,2,0,0,0,0|1,0,1]=4 1266 B15R1.579 CCSCCNC(=O)CCc1ccc[nH]1 WXVL_AK00494SA0009 [0,2,0,0,0,0|2,0,0]=4 1267 B15R1.579 CCSCCNC(=O)CCc1ccc[nH]1 WXVL_AK00494SA0009 [0,2,0,0,0,0|2,0,0]=4 1268 B15R1.579 CCSCCNC(=O)CCc1ccco1 WXVL_AK00494SA0167 [0,2,0,0,0,0|1,0,0]=3 1269 B15R1.579 CCSCCNC(=O)CCc1ccco1 WXVL_AK00494SA0167 [0,2,0,0,0,0|1,0,0]=3 1270 B15R1.579 CCSCCNC(=O)CCc1cccs1 WXVL_AK00494SA0303 [0,2,0,0,0,0|1,1,0]=4 1271 B15R1.579 CCSCCNC(=O)CCc1cccs1 WXVL_AK00494SA0303 [0,2,0,0,0,0|1,1,0]=4 1272 B15R1.579 COCCCNC(=O)/C=C/c1ccco1 WXVL_AK00637SA0180 [0,2,0,0,0,0|1,0,1]=4 1273 B15R1.579 COCCCNC(=O)/C=C/c1ccco1 WXVL_AK00637SA0180 [0,2,0,0,0,0|1,0,1]=4 1274 B15R1.579 COCCCNC(=O)CCc1ccc[nH]1 WXVL_AK00637SA0009 [0,2,0,0,0,0|2,0,0]=4 1275 B15R1.579 COCCCNC(=O)CCc1ccc[nH]1 WXVL_AK00637SA0009 [0,2,0,0,0,0|2,0,0]=4 1276 B15R1.579 COCCCNC(=O)CCc1ccco1 WXVL_AK00637SA0167 [0,2,0,0,0,0|1,0,0]=3 1277 B15R1.579 COCCCNC(=O)CCc1ccco1 WXVL_AK00637SA0167 [0,2,0,0,0,0|1,0,0]=3 1278 B15R1.579 COCCCNC(=O)CCc1cccs1 WXVL_AK00637SA0303 [0,2,0,0,0,0|1,1,0]=4 1279 B15R1.579 COCCCNC(=O)CCc1cccs1 WXVL_AK00637SA0303 [0,2,0,0,0,0|1,1,0]=4 1280 B15R1.579 COCCOCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0159 [0,2,0,0,0,0|2,0,0]=4 1281 B15R1.579 COCCOCC(=O)NCc1ccc[nH]1 WXVL_AK00759SB0159 [0,2,0,0,0,0|2,0,0]=4 1282 B15R1.579 COCCOCC(=O)NCc1ccco1 WXVL_AK0010SB0159 [0,2,0,0,0,0|1,0,0]=3 1283 B15R1.579 COCCOCC(=O)NCc1ccco1 WXVL_AK0010SB0159 [0,2,0,0,0,0|1,0,0]=3 1284 B15R1.579 COCCOCC(=O)NCc1cccs1 WXVL_AK0014SB0159 [0,2,0,0,0,0|1,1,0]=4 1285 B15R1.579 COCCOCC(=O)NCc1cccs1 WXVL_AK0014SB0159 [0,2,0,0,0,0|1,1,0]=4 1286 B15R1.579 COCCOCC(=O)NCc1cnco1 WXVL_AK1437SB0159 [0,2,0,0,0,0|2,0,0]=4 1287 B15R1.579 COCCOCC(=O)NCc1cnco1 WXVL_AK1437SB0159 [0,2,0,0,0,0|2,0,0]=4 1288 B15R1.579 CSCCCNC(=O)/C=C/c1ccco1 WXVL_AK0965SA0180 [0,2,0,0,0,0|1,0,1]=4 1289 B15R1.579 CSCCCNC(=O)/C=C/c1ccco1 WXVL_AK0965SA0180 [0,2,0,0,0,0|1,0,1]=4 1290 B15R1.579 CSCCCNC(=O)CCc1ccc[nH]1 WXVL_AK0965SA0009 [0,2,0,0,0,0|2,0,0]=4 1291 B15R1.579 CSCCCNC(=O)CCc1ccc[nH]1 WXVL_AK0965SA0009 [0,2,0,0,0,0|2,0,0]=4 1292 B15R1.579 CSCCCNC(=O)CCc1ccco1 WXVL_AK0965SA0167 [0,2,0,0,0,0|1,0,0]=3 1293 B15R1.579 CSCCCNC(=O)CCc1ccco1 WXVL_AK0965SA0167 [0,2,0,0,0,0|1,0,0]=3 1294 B15R1.579 CSCCCNC(=O)CCc1cccs1 WXVL_AK0965SA0303 [0,2,0,0,0,0|1,1,0]=4 1295 B15R1.579 CSCCCNC(=O)CCc1cccs1 WXVL_AK0965SA0303 [0,2,0,0,0,0|1,1,0]=4 1296 B15R1.579 O=C(/C=C/c1ccco1)NCCCCO WXVL_AK0075SA0180 [0,2,0,0,0,0|1,0,1]=4 1297 B15R1.579 O=C(/C=C/c1ccco1)NCCCCO WXVL_AK0075SA0180 [0,2,0,0,0,0|1,0,1]=4 1298 B15R1.579 O=C(CCCCCBr)NCc1ccc[nH]1 WXVL_AK00759SB2192 [0,2,0,0,0,0|2,0,0]=4 1299 B15R1.579 O=C(CCCCCBr)NCc1ccc[nH]1 WXVL_AK00759SB2192 [0,2,0,0,0,0|2,0,0]=4 1300 B15R1.579 O=C(CCCCCBr)NCc1ccco1 WXVL_AK0010SB2192 [0,2,0,0,0,0|1,0,0]=3 1301 B15R1.579 O=C(CCCCCBr)NCc1ccco1 WXVL_AK0010SB2192 [0,2,0,0,0,0|1,0,0]=3 1302 B15R1.579 O=C(CCCCCBr)NCc1cccs1 WXVL_AK0014SB2192 [0,2,0,0,0,0|1,1,0]=4 1303 B15R1.579 O=C(CCCCCBr)NCc1cccs1 WXVL_AK0014SB2192 [0,2,0,0,0,0|1,1,0]=4 1304 B15R1.579 O=C(CCCCCBr)NCc1cnco1 WXVL_AK1437SB2192 [0,2,0,0,0,0|2,0,0]=4 1305 B15R1.579 O=C(CCCCCBr)NCc1cnco1 WXVL_AK1437SB2192 [0,2,0,0,0,0|2,0,0]=4 1306 B15R1.579 O=C(CCCCCO)NCc1ccc[nH]1 WXVL_AK00759SB2973 [0,2,0,0,0,0|2,0,0]=4 1307 B15R1.579 O=C(CCCCCO)NCc1ccc[nH]1 WXVL_AK00759SB2973 [0,2,0,0,0,0|2,0,0]=4 1308 B15R1.579 O=C(CCCCCO)NCc1ccco1 WXVL_AK0010SB2973 [0,2,0,0,0,0|1,0,0]=3 1309 B15R1.579 O=C(CCCCCO)NCc1ccco1 WXVL_AK0010SB2973 [0,2,0,0,0,0|1,0,0]=3 1310 B15R1.579 O=C(CCCCCO)NCc1cccs1 WXVL_AK0014SB2973 [0,2,0,0,0,0|1,1,0]=4 1311 B15R1.579 O=C(CCCCCO)NCc1cccs1 WXVL_AK0014SB2973 [0,2,0,0,0,0|1,1,0]=4 1312 B15R1.579 O=C(CCCCCO)NCc1cnco1 WXVL_AK1437SB2973 [0,2,0,0,0,0|2,0,0]=4 1313 B15R1.579 O=C(CCCCCO)NCc1cnco1 WXVL_AK1437SB2973 [0,2,0,0,0,0|2,0,0]=4 1314 B15R1.579 O=C(CCc1ccc[nH]1)NCCCCO WXVL_AK0075SA0009 [0,2,0,0,0,0|2,0,0]=4 1315 B15R1.579 O=C(CCc1ccc[nH]1)NCCCCO WXVL_AK0075SA0009 [0,2,0,0,0,0|2,0,0]=4 1316 B15R1.579 O=C(CCc1ccco1)NCCCCO WXVL_AK0075SA0167 [0,2,0,0,0,0|1,0,0]=3 1317 B15R1.579 O=C(CCc1ccco1)NCCCCO WXVL_AK0075SA0167 [0,2,0,0,0,0|1,0,0]=3 1318 B15R1.579 O=C(CCc1cccs1)NCCCCO WXVL_AK0075SA0303 [0,2,0,0,0,0|1,1,0]=4 1319 B15R1.579 O=C(CCc1cccs1)NCCCCO WXVL_AK0075SA0303 [0,2,0,0,0,0|1,1,0]=4 1320 B15R1.1021 CC(Cc1ccco1)C(=O)NCCCO WXVL_AK0073SA2637 [0,2,0,0,0,0|2,0,0]=4 1321 B15R1.1021 CC(Cc1ccco1)C(=O)NCCCO WXVL_AK0073SA2637 [0,2,0,0,0,0|2,0,0]=4 1322 B15R1.1021 CCCCNC(=O)C(C)Cc1ccco1 WXVL_AK00588SA2637 [0,2,0,0,0,0|1,0,0]=3 1323 B15R1.1021 CCCCNC(=O)C(C)Cc1ccco1 WXVL_AK00588SA2637 [0,2,0,0,0,0|1,0,0]=3 1324 B15R1.1021 CSCCNC(=O)C(C)Cc1ccco1 WXVL_AK00440SA2637 [0,2,0,0,0,0|2,0,0]=4 1325 B15R1.1021 CSCCNC(=O)C(C)Cc1ccco1 WXVL_AK00440SA2637 [0,2,0,0,0,0|2,0,0]=4 1326 B15R1.1115 COC(=O)CCC(=O)NCc1ccco1 WXVL_AK0010SB0069 [0,2,0,0,0,0|1,0,1]=4 1327 B15R1.1115 COC(=O)CCC(=O)NCc1ccco1 WXVL_AK0010SB0069 [0,2,0,0,0,0|1,0,1]=4 1328 B15R1.1115 CO[C@H](C)CNC(=O)CCc1ccco1 WXVL_AK00704SA0167 [0,2,0,0,0,0|2,0,0]=4 1329 B15R1.1115 CO[C@H](C)CNC(=O)CCc1ccco1 WXVL_AK00704SA0167 [0,2,0,0,0,0|2,0,0]=4 1330 B15R1.1115 O=C(CCc1ccco1)NC[C@@H](F)CO WXVL_AK00590SA0167 [0,2,0,0,0,0|2,0,0]=4 1331 B15R1.1115 O=C(CCc1ccco1)NC[C@@H](F)CO WXVL_AK00590SA0167 [0,2,0,0,0,0|2,0,0]=4 1332 B15R1.1115 O=C(CCc1ccco1)NC[C@H](O)CO WXVL_AK00483SA0167 [0,2,0,0,0,0|2,0,0]=4 1333 B15R1.1115 O=C(CCc1ccco1)NC[C@H](O)CO WXVL_AK00483SA0167 [0,2,0,0,0,0|2,0,0]=4 1334 B15R1.1284 CC(CCO)NC(=O)CCc1ccco1 WXVL_AK1288SA0167 [0,2,0,0,0,0|2,0,0]=4 1335 B15R1.1284 CC(CCO)NC(=O)CCc1ccco1 WXVL_AK1288SA0167 [0,2,0,0,0,0|2,0,0]=4 1336 B15R1.1284 CCC[C@H](C)NC(=O)/C=C/c1ccco1 WXVL_AK00682SA0180 [0,2,0,0,0,0|1,0,1]=4 1337 B15R1.1284 CCC[C@H](C)NC(=O)/C=C/c1ccco1 WXVL_AK00682SA0180 [0,2,0,0,0,0|1,0,1]=4 1338 B15R1.1284 CCC[C@H](C)NC(=O)CCc1ccc[nH]1 WXVL_AK00682SA0009 [0,2,0,0,0,0|2,0,0]=4 1339 B15R1.1284 CCC[C@H](C)NC(=O)CCc1ccc[nH]1 WXVL_AK00682SA0009 [0,2,0,0,0,0|2,0,0]=4 1340 B15R1.1284 CCC[C@H](C)NC(=O)CCc1ccco1 WXVL_AK00682SA0167 [0,2,0,0,0,0|1,0,0]=3 1341 B15R1.1284 CCC[C@H](C)NC(=O)CCc1ccco1 WXVL_AK00682SA0167 [0,2,0,0,0,0|1,0,0]=3 1342 B15R1.1284 CCC[C@H](C)NC(=O)CCc1cccs1 WXVL_AK00682SA0303 [0,2,0,0,0,0|1,1,0]=4 1343 B15R1.1284 CCC[C@H](C)NC(=O)CCc1cccs1 WXVL_AK00682SA0303 [0,2,0,0,0,0|1,1,0]=4 1344 B15R1.1284 CCOC(=O)CC(=O)NCc1ccco1 WXVL_AK0010SB3094 [0,2,0,0,0,0|1,0,1]=4 1345 B15R1.1284 CCOC(=O)CC(=O)NCc1ccco1 WXVL_AK0010SB3094 [0,2,0,0,0,0|1,0,1]=4 1346 B15R1.1284 COC[C@@H](C)NC(=O)CCc1ccco1 WXVL_AK00613SA0167 [0,2,0,0,0,0|2,0,0]=4 1347 B15R1.1284 COC[C@@H](C)NC(=O)CCc1ccco1 WXVL_AK00613SA0167 [0,2,0,0,0,0|2,0,0]=4 1348 B15R1.1284 COC[C@H](C)NC(=O)CCc1ccco1 WXVL_AK0137SA0167 [0,2,0,0,0,0|2,0,0]=4 1349 B15R1.1284 COC[C@H](C)NC(=O)CCc1ccco1 WXVL_AK0137SA0167 [0,2,0,0,0,0|2,0,0]=4 1350 B15R1.1378 Cn1cccc1CNC(=O)CCCCBr WXVL_AK0499SB3153 [0,2,0,0,0,0|2,0,0]=4 1351 B15R1.1378 Cn1cccc1CNC(=O)CCCCBr WXVL_AK0499SB3153 [0,2,0,0,0,0|2,0,0]=4 1352 B15R1.1378 Cn1cccc1CNC(=O)CCCCCl WXVL_AK0499SB0379 [0,2,0,0,0,0|2,0,0]=4 1353 B15R1.1378 Cn1cccc1CNC(=O)CCCCCl WXVL_AK0499SB0379 [0,2,0,0,0,0|2,0,0]=4 1354 B15R1.1378 O=C(CCCCBr)NCc1sccc1Cl WXVL_AK4332SB3153 [0,2,0,0,0,0|1,1,0]=4 1355 B15R1.1378 O=C(CCCCBr)NCc1sccc1Cl WXVL_AK4332SB3153 [0,2,0,0,0,0|1,1,0]=4 1356 B15R1.1378 O=C(CCCCCl)NCc1sccc1Cl WXVL_AK4332SB0379 [0,2,0,0,0,0|1,1,0]=4 1357 B15R1.1378 O=C(CCCCCl)NCc1sccc1Cl WXVL_AK4332SB0379 [0,2,0,0,0,0|1,1,0]=4 1358 B15R1.2075 CCOCCS(=O)(=O)NCc1ccco1 WXVL_AK0010HU0315 [0,2,0,0,0,0|2,0,0]=4 1359 B15R1.2075 CCOCCS(=O)(=O)NCc1ccco1 WXVL_AK0010HU0315 [0,2,0,0,0,0|2,0,0]=4 1360 B15R1.2075 O=S(=O)(CCCCCl)NCc1ccco1 WXVL_AK0010HU0456 [0,2,0,0,0,0|2,0,0]=4 1361 B15R1.2075 O=S(=O)(CCCCCl)NCc1ccco1 WXVL_AK0010HU0456 [0,2,0,0,0,0|2,0,0]=4 1362 B15R1.738 CCC(C)CC(=O)NC(C)c1ccno1 WXVL_AK6536SB0353 [0,2,0,0,0,0|2,0,0]=4 1363 B15R1.738 CCC(C)CC(=O)NC(C)c1ccno1 WXVL_AK6536SB0353 [0,2,0,0,0,0|2,0,0]=4 1364 B15R1.738 CCC(C)CC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB0353 [0,2,0,0,0,0|1,1,0]=4 1365 B15R1.738 CCC(C)CC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB0353 [0,2,0,0,0,0|1,1,0]=4 1366 B15R1.738 CCC(O)CC(=O)NC(C)c1ccno1 WXVL_AK6536SB4092 [0,2,0,0,0,0|2,0,0]=4 1367 B15R1.738 CCC(O)CC(=O)NC(C)c1ccno1 WXVL_AK6536SB4092 [0,2,0,0,0,0|2,0,0]=4 1368 B15R1.738 CCC(O)CC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB4092 [0,2,0,0,0,0|1,1,0]=4 1369 B15R1.738 CCC(O)CC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB4092 [0,2,0,0,0,0|1,1,0]=4 1370 B15R1.738 CC[C@@H](C)CC(=O)NC(C)c1ccno1 WXVL_AK6536SB8650 [0,2,0,0,0,0|2,0,0]=4 1371 B15R1.738 CC[C@@H](C)CC(=O)NC(C)c1ccno1 WXVL_AK6536SB8650 [0,2,0,0,0,0|2,0,0]=4 1372 B15R1.738 CC[C@@H](C)CC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB8650 [0,2,0,0,0,0|1,1,0]=4 1373 B15R1.738 CC[C@@H](C)CC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB8650 [0,2,0,0,0,0|1,1,0]=4 1374 B15R1.782 CCCC(C)C(=O)NC(C)c1ccno1 WXVL_AK6536SB0352 [0,2,0,0,0,0|2,0,0]=4 1375 B15R1.782 CCCC(C)C(=O)NC(C)c1ccno1 WXVL_AK6536SB0352 [0,2,0,0,0,0|2,0,0]=4 1376 B15R1.782 CCCC(C)C(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB0352 [0,2,0,0,0,0|1,1,0]=4 1377 B15R1.782 CCCC(C)C(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB0352 [0,2,0,0,0,0|1,1,0]=4 1378 B15R1.782 CCC[C@H](O)C(=O)NC(C)c1ccno1 WXVL_AK6536SB3627 [0,2,0,0,0,0|2,0,0]=4 1379 B15R1.782 CCC[C@H](O)C(=O)NC(C)c1ccno1 WXVL_AK6536SB3627 [0,2,0,0,0,0|2,0,0]=4 1380 B15R1.782 CCC[C@H](O)C(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB3627 [0,2,0,0,0,0|1,1,0]=4 1381 B15R1.782 CCC[C@H](O)C(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB3627 [0,2,0,0,0,0|1,1,0]=4 1382 B15R1.5912 CC(C)CCC(=O)NC(C)c1ccno1 WXVL_AK6536SB0354 [0,2,0,0,0,0|2,0,0]=4 1383 B15R1.5912 CC(C)CCC(=O)NC(C)c1ccno1 WXVL_AK6536SB0354 [0,2,0,0,0,0|2,0,0]=4 1384 B15R1.5912 CC(C)CCC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB0354 [0,2,0,0,0,0|1,1,0]=4 1385 B15R1.5912 CC(C)CCC(=O)N[C@@H](C)c1cccs1 WXVL_AK00667SB0354 [0,2,0,0,0,0|1,1,0]=4 1386 B15R1.740 CCC(C)CC(=O)NCc1cc(cs1)Br WXVL_AK00192SB0353 [0,2,0,0,0,0|1,1,0]=4 1387 B15R1.740 CCC(C)CC(=O)NCc1cc(cs1)Br WXVL_AK00192SB0353 [0,2,0,0,0,0|1,1,0]=4 1388 B15R1.740 CCC(C)CC(=O)NCc1cc(no1)Br WXVL_AK1427SB0353 [0,2,0,0,0,0|2,0,0]=4 1389 B15R1.740 CCC(C)CC(=O)NCc1cc(no1)Br WXVL_AK1427SB0353 [0,2,0,0,0,0|2,0,0]=4 1390 B15R1.740 CCC(C)CC(=O)NCc1cc(no1)C WXVL_AK1064SB0353 [0,2,0,0,0,0|2,0,0]=4 1391 B15R1.740 CCC(C)CC(=O)NCc1cc(no1)C WXVL_AK1064SB0353 [0,2,0,0,0,0|2,0,0]=4 1392 B15R1.740 CCC(C)CC(=O)NCc1ccc(s1)Br WXVL_AK2468SB0353 [0,2,0,0,0,0|1,1,0]=4 1393 B15R1.740 CCC(C)CC(=O)NCc1ccc(s1)Br WXVL_AK2468SB0353 [0,2,0,0,0,0|1,1,0]=4 1394 B15R1.740 CCC(C)CC(=O)NCc1ccc(s1)C WXVL_AK0276SB0353 [0,2,0,0,0,0|1,1,0]=4 1395 B15R1.740 CCC(C)CC(=O)NCc1ccc(s1)C WXVL_AK0276SB0353 [0,2,0,0,0,0|1,1,0]=4 1396 B15R1.740 CCC(C)CC(=O)NCc1ccc(s1)Cl WXVL_AK00166SB0353 [0,2,0,0,0,0|1,1,0]=4 1397 B15R1.740 CCC(C)CC(=O)NCc1ccc(s1)Cl WXVL_AK00166SB0353 [0,2,0,0,0,0|1,1,0]=4 1398 B15R1.740 CCC(O)CC(=O)NCc1cc(cs1)Br WXVL_AK00192SB4092 [0,2,0,0,0,0|1,1,0]=4 1399 B15R1.740 CCC(O)CC(=O)NCc1cc(cs1)Br WXVL_AK00192SB4092 [0,2,0,0,0,0|1,1,0]=4 1400 B15R1.740 CCC(O)CC(=O)NCc1cc(no1)Br WXVL_AK1427SB4092 [0,2,0,0,0,0|2,0,0]=4 1401 B15R1.740 CCC(O)CC(=O)NCc1cc(no1)Br WXVL_AK1427SB4092 [0,2,0,0,0,0|2,0,0]=4 1402 B15R1.740 CCC(O)CC(=O)NCc1cc(no1)C WXVL_AK1064SB4092 [0,2,0,0,0,0|2,0,0]=4 1403 B15R1.740 CCC(O)CC(=O)NCc1cc(no1)C WXVL_AK1064SB4092 [0,2,0,0,0,0|2,0,0]=4 1404 B15R1.740 CCC(O)CC(=O)NCc1ccc(s1)Br WXVL_AK2468SB4092 [0,2,0,0,0,0|1,1,0]=4 1405 B15R1.740 CCC(O)CC(=O)NCc1ccc(s1)Br WXVL_AK2468SB4092 [0,2,0,0,0,0|1,1,0]=4 1406 B15R1.740 CCC(O)CC(=O)NCc1ccc(s1)C WXVL_AK0276SB4092 [0,2,0,0,0,0|1,1,0]=4 1407 B15R1.740 CCC(O)CC(=O)NCc1ccc(s1)C WXVL_AK0276SB4092 [0,2,0,0,0,0|1,1,0]=4 1408 B15R1.740 CCC(O)CC(=O)NCc1ccc(s1)Cl WXVL_AK00166SB4092 [0,2,0,0,0,0|1,1,0]=4 1409 B15R1.740 CCC(O)CC(=O)NCc1ccc(s1)Cl WXVL_AK00166SB4092 [0,2,0,0,0,0|1,1,0]=4 1410 B15R1.740 CC[C@@H](C)CC(=O)NCc1cc(cs1)Br WXVL_AK00192SB8650 [0,2,0,0,0,0|1,1,0]=4 1411 B15R1.740 CC[C@@H](C)CC(=O)NCc1cc(cs1)Br WXVL_AK00192SB8650 [0,2,0,0,0,0|1,1,0]=4 1412 B15R1.740 CC[C@@H](C)CC(=O)NCc1cc(no1)Br WXVL_AK1427SB8650 [0,2,0,0,0,0|2,0,0]=4 1413 B15R1.740 CC[C@@H](C)CC(=O)NCc1cc(no1)Br WXVL_AK1427SB8650 [0,2,0,0,0,0|2,0,0]=4 1414 B15R1.740 CC[C@@H](C)CC(=O)NCc1cc(no1)C WXVL_AK1064SB8650 [0,2,0,0,0,0|2,0,0]=4 1415 B15R1.740 CC[C@@H](C)CC(=O)NCc1cc(no1)C WXVL_AK1064SB8650 [0,2,0,0,0,0|2,0,0]=4 1416 B15R1.740 CC[C@@H](C)CC(=O)NCc1ccc(s1)Br WXVL_AK2468SB8650 [0,2,0,0,0,0|1,1,0]=4 1417 B15R1.740 CC[C@@H](C)CC(=O)NCc1ccc(s1)Br WXVL_AK2468SB8650 [0,2,0,0,0,0|1,1,0]=4 1418 B15R1.740 CC[C@@H](C)CC(=O)NCc1ccc(s1)C WXVL_AK0276SB8650 [0,2,0,0,0,0|1,1,0]=4 1419 B15R1.740 CC[C@@H](C)CC(=O)NCc1ccc(s1)C WXVL_AK0276SB8650 [0,2,0,0,0,0|1,1,0]=4 1420 B15R1.740 CC[C@@H](C)CC(=O)NCc1ccc(s1)Cl WXVL_AK00166SB8650 [0,2,0,0,0,0|1,1,0]=4 1421 B15R1.740 CC[C@@H](C)CC(=O)NCc1ccc(s1)Cl WXVL_AK00166SB8650 [0,2,0,0,0,0|1,1,0]=4 1422 B15R1.825 CCCC(C)C(=O)NCc1cc(cs1)Br WXVL_AK00192SB0352 [0,2,0,0,0,0|1,1,0]=4 1423 B15R1.825 CCCC(C)C(=O)NCc1cc(cs1)Br WXVL_AK00192SB0352 [0,2,0,0,0,0|1,1,0]=4 1424 B15R1.825 CCCC(C)C(=O)NCc1cc(no1)Br WXVL_AK1427SB0352 [0,2,0,0,0,0|2,0,0]=4 1425 B15R1.825 CCCC(C)C(=O)NCc1cc(no1)Br WXVL_AK1427SB0352 [0,2,0,0,0,0|2,0,0]=4 1426 B15R1.825 CCCC(C)C(=O)NCc1cc(no1)C WXVL_AK1064SB0352 [0,2,0,0,0,0|2,0,0]=4 1427 B15R1.825 CCCC(C)C(=O)NCc1cc(no1)C WXVL_AK1064SB0352 [0,2,0,0,0,0|2,0,0]=4 1428 B15R1.825 CCCC(C)C(=O)NCc1ccc(s1)Br WXVL_AK2468SB0352 [0,2,0,0,0,0|1,1,0]=4 1429 B15R1.825 CCCC(C)C(=O)NCc1ccc(s1)Br WXVL_AK2468SB0352 [0,2,0,0,0,0|1,1,0]=4 1430 B15R1.825 CCCC(C)C(=O)NCc1ccc(s1)C WXVL_AK0276SB0352 [0,2,0,0,0,0|1,1,0]=4 1431 B15R1.825 CCCC(C)C(=O)NCc1ccc(s1)C WXVL_AK0276SB0352 [0,2,0,0,0,0|1,1,0]=4 1432 B15R1.825 CCCC(C)C(=O)NCc1ccc(s1)Cl WXVL_AK00166SB0352 [0,2,0,0,0,0|1,1,0]=4 1433 B15R1.825 CCCC(C)C(=O)NCc1ccc(s1)Cl WXVL_AK00166SB0352 [0,2,0,0,0,0|1,1,0]=4 1434 B15R1.825 CCC[C@H](O)C(=O)NCc1cc(cs1)Br WXVL_AK00192SB3627 [0,2,0,0,0,0|1,1,0]=4 1435 B15R1.825 CCC[C@H](O)C(=O)NCc1cc(cs1)Br WXVL_AK00192SB3627 [0,2,0,0,0,0|1,1,0]=4 1436 B15R1.825 CCC[C@H](O)C(=O)NCc1cc(no1)Br WXVL_AK1427SB3627 [0,2,0,0,0,0|2,0,0]=4 1437 B15R1.825 CCC[C@H](O)C(=O)NCc1cc(no1)Br WXVL_AK1427SB3627 [0,2,0,0,0,0|2,0,0]=4 1438 B15R1.825 CCC[C@H](O)C(=O)NCc1cc(no1)C WXVL_AK1064SB3627 [0,2,0,0,0,0|2,0,0]=4 1439 B15R1.825 CCC[C@H](O)C(=O)NCc1cc(no1)C WXVL_AK1064SB3627 [0,2,0,0,0,0|2,0,0]=4 1440 B15R1.825 CCC[C@H](O)C(=O)NCc1ccc(s1)Br WXVL_AK2468SB3627 [0,2,0,0,0,0|1,1,0]=4 1441 B15R1.825 CCC[C@H](O)C(=O)NCc1ccc(s1)Br WXVL_AK2468SB3627 [0,2,0,0,0,0|1,1,0]=4 1442 B15R1.825 CCC[C@H](O)C(=O)NCc1ccc(s1)C WXVL_AK0276SB3627 [0,2,0,0,0,0|1,1,0]=4 1443 B15R1.825 CCC[C@H](O)C(=O)NCc1ccc(s1)C WXVL_AK0276SB3627 [0,2,0,0,0,0|1,1,0]=4 1444 B15R1.825 CCC[C@H](O)C(=O)NCc1ccc(s1)Cl WXVL_AK00166SB3627 [0,2,0,0,0,0|1,1,0]=4 1445 B15R1.825 CCC[C@H](O)C(=O)NCc1ccc(s1)Cl WXVL_AK00166SB3627 [0,2,0,0,0,0|1,1,0]=4 1446 B15R1.5464 CC(C)CCC(=O)NCc1cc(cs1)Br WXVL_AK00192SB0354 [0,2,0,0,0,0|1,1,0]=4 1447 B15R1.5464 CC(C)CCC(=O)NCc1cc(cs1)Br WXVL_AK00192SB0354 [0,2,0,0,0,0|1,1,0]=4 1448 B15R1.5464 CC(C)CCC(=O)NCc1cc(no1)Br WXVL_AK1427SB0354 [0,2,0,0,0,0|2,0,0]=4 1449 B15R1.5464 CC(C)CCC(=O)NCc1cc(no1)Br WXVL_AK1427SB0354 [0,2,0,0,0,0|2,0,0]=4 1450 B15R1.5464 CC(C)CCC(=O)NCc1ccc(s1)Br WXVL_AK2468SB0354 [0,2,0,0,0,0|1,1,0]=4 1451 B15R1.5464 CC(C)CCC(=O)NCc1ccc(s1)Br WXVL_AK2468SB0354 [0,2,0,0,0,0|1,1,0]=4 1452 B15R1.5464 CC(C)CCC(=O)NCc1ccc(s1)Cl WXVL_AK00166SB0354 [0,2,0,0,0,0|1,1,0]=4 1453 B15R1.5464 CC(C)CCC(=O)NCc1ccc(s1)Cl WXVL_AK00166SB0354 [0,2,0,0,0,0|1,1,0]=4 1454 B15R1.5464 Cc1cc(on1)CNC(=O)CCC(C)C WXVL_AK1064SB0354 [0,2,0,0,0,0|2,0,0]=4 1455 B15R1.5464 Cc1cc(on1)CNC(=O)CCC(C)C WXVL_AK1064SB0354 [0,2,0,0,0,0|2,0,0]=4 1456 B15R1.5464 Cc1ccc(s1)CNC(=O)CCC(C)C WXVL_AK0276SB0354 [0,2,0,0,0,0|1,1,0]=4 1457 B15R1.5464 Cc1ccc(s1)CNC(=O)CCC(C)C WXVL_AK0276SB0354 [0,2,0,0,0,0|1,1,0]=4 1458 B15R1.948 CC[C@H](C)NC(=O)C(C)Cc1ccco1 WXVL_AK00678SA2637 [0,2,0,0,0,0|2,0,0]=4 1459 B15R1.948 CC[C@H](C)NC(=O)C(C)Cc1ccco1 WXVL_AK00678SA2637 [0,2,0,0,0,0|2,0,0]=4 1460 B15R1.1077 CC(C)CNC(=O)C(C)Cc1ccco1 WXVL_AK00544SA2637 [0,2,0,0,0,0|2,0,0]=4 1461 B15R1.1077 CC(C)CNC(=O)C(C)Cc1ccco1 WXVL_AK00544SA2637 [0,2,0,0,0,0|2,0,0]=4 1462 B15R1.1077 CC(Cc1ccco1)C(=O)NC[C@H](C)O WXVL_AK0113SA2637 [0,2,0,0,0,0|2,0,0]=4 1463 B15R1.1077 CC(Cc1ccco1)C(=O)NC[C@H](C)O WXVL_AK0113SA2637 [0,2,0,0,0,0|2,0,0]=4 1464 B15R1.1077 CC(O)CNC(=O)C(C)Cc1ccco1 WXVL_AK0052SA2637 [0,2,0,0,0,0|2,0,0]=4 1465 B15R1.1077 CC(O)CNC(=O)C(C)Cc1ccco1 WXVL_AK0052SA2637 [0,2,0,0,0,0|2,0,0]=4 1466 B15R1.742 CCC(C)CC(=O)NCc1cccn1C WXVL_AK0499SB0353 [0,2,0,0,0,0|2,0,0]=4 1467 B15R1.742 CCC(C)CC(=O)NCc1cccn1C WXVL_AK0499SB0353 [0,2,0,0,0,0|2,0,0]=4 1468 B15R1.742 CCC(C)CC(=O)NCc1sccc1Cl WXVL_AK4332SB0353 [0,2,0,0,0,0|1,1,0]=4 1469 B15R1.742 CCC(C)CC(=O)NCc1sccc1Cl WXVL_AK4332SB0353 [0,2,0,0,0,0|1,1,0]=4 1470 B15R1.742 CCC(O)CC(=O)NCc1cccn1C WXVL_AK0499SB4092 [0,2,0,0,0,0|2,0,0]=4 1471 B15R1.742 CCC(O)CC(=O)NCc1cccn1C WXVL_AK0499SB4092 [0,2,0,0,0,0|2,0,0]=4 1472 B15R1.742 CCC(O)CC(=O)NCc1sccc1Cl WXVL_AK4332SB4092 [0,2,0,0,0,0|1,1,0]=4 1473 B15R1.742 CCC(O)CC(=O)NCc1sccc1Cl WXVL_AK4332SB4092 [0,2,0,0,0,0|1,1,0]=4 1474 B15R1.742 CC[C@@H](C)CC(=O)NCc1cccn1C WXVL_AK0499SB8650 [0,2,0,0,0,0|2,0,0]=4 1475 B15R1.742 CC[C@@H](C)CC(=O)NCc1cccn1C WXVL_AK0499SB8650 [0,2,0,0,0,0|2,0,0]=4 1476 B15R1.742 CC[C@@H](C)CC(=O)NCc1sccc1Cl WXVL_AK4332SB8650 [0,2,0,0,0,0|1,1,0]=4 1477 B15R1.742 CC[C@@H](C)CC(=O)NCc1sccc1Cl WXVL_AK4332SB8650 [0,2,0,0,0,0|1,1,0]=4 1478 B15R1.3662 CC(C)N(C)CC(=O)NCc1ccco1 WXVL_AK0010SB0019 [0,2,0,0,0,0|2,0,0]=4 1479 B15R1.3662 CC(C)N(C)CC(=O)NCc1ccco1 WXVL_AK0010SB0019 [0,2,0,0,0,0|2,0,0]=4 1480 B15R1.5726 CC[C@H](CO)NC(=O)CCc1ccco1 WXVL_AK0111SA0167 [0,2,0,0,0,0|2,0,0]=4 1481 B15R1.5726 CC[C@H](CO)NC(=O)CCc1ccco1 WXVL_AK0111SA0167 [0,2,0,0,0,0|2,0,0]=4 1482 B15R1.7712 CCS(=O)(=O)CC(=O)NCc1ccco1 WXVL_AK0010SBD438 [0,2,0,0,0,0|2,0,0]=4 1483 B15R1.7712 CCS(=O)(=O)CC(=O)NCc1ccco1 WXVL_AK0010SBD438 [0,2,0,0,0,0|2,0,0]=4 1484 B15R1.3607 CCCC(C)(C)C(=O)NCc1ccc[nH]1 WXVL_AK00759SB0372 [0,2,0,0,0,0|2,0,0]=4 1485 B15R1.3607 CCCC(C)(C)C(=O)NCc1ccc[nH]1 WXVL_AK00759SB0372 [0,2,0,0,0,0|2,0,0]=4 1486 B15R1.3607 CCCC(C)(C)C(=O)NCc1ccco1 WXVL_AK0010SB0372 [0,2,0,0,0,0|1,0,0]=3 1487 B15R1.3607 CCCC(C)(C)C(=O)NCc1ccco1 WXVL_AK0010SB0372 [0,2,0,0,0,0|1,0,0]=3 1488 B15R1.3607 CCCC(C)(C)C(=O)NCc1cccs1 WXVL_AK0014SB0372 [0,2,0,0,0,0|1,1,0]=4 1489 B15R1.3607 CCCC(C)(C)C(=O)NCc1cccs1 WXVL_AK0014SB0372 [0,2,0,0,0,0|1,1,0]=4 1490 B15R1.3607 CCCC(C)(C)C(=O)NCc1cnco1 WXVL_AK1437SB0372 [0,2,0,0,0,0|2,0,0]=4 1491 B15R1.3607 CCCC(C)(C)C(=O)NCc1cnco1 WXVL_AK1437SB0372 [0,2,0,0,0,0|2,0,0]=4 1492 B15R1.3607 CSCC(C)(C)C(=O)NCc1ccco1 WXVL_AK0010SBF473 [0,2,0,0,0,0|2,0,0]=4 1493 B15R1.3607 CSCC(C)(C)C(=O)NCc1ccco1 WXVL_AK0010SBF473 [0,2,0,0,0,0|2,0,0]=4 1494 B15R1.3935 CCCC(C)C(=O)NCc1cccn1C WXVL_AK0499SB0352 [0,2,0,0,0,0|2,0,0]=4 1495 B15R1.3935 CCCC(C)C(=O)NCc1cccn1C WXVL_AK0499SB0352 [0,2,0,0,0,0|2,0,0]=4 1496 B15R1.3935 CCCC(C)C(=O)NCc1sccc1Cl WXVL_AK4332SB0352 [0,2,0,0,0,0|1,1,0]=4 1497 B15R1.3935 CCCC(C)C(=O)NCc1sccc1Cl WXVL_AK4332SB0352 [0,2,0,0,0,0|1,1,0]=4 1498 B15R1.3935 CCC[C@H](O)C(=O)NCc1cccn1C WXVL_AK0499SB3627 [0,2,0,0,0,0|2,0,0]=4 1499 B15R1.3935 CCC[C@H](O)C(=O)NCc1cccn1C WXVL_AK0499SB3627 [0,2,0,0,0,0|2,0,0]=4 1500 B15R1.3935 CCC[C@H](O)C(=O)NCc1sccc1Cl WXVL_AK4332SB3627 [0,2,0,0,0,0|1,1,0]=4 1501 B15R1.3935 CCC[C@H](O)C(=O)NCc1sccc1Cl WXVL_AK4332SB3627 [0,2,0,0,0,0|1,1,0]=4 1502 B15R1.5512 CC(C)CC(O)C(=O)NCc1ccc[nH]1 WXVL_AK00759SB4281 [0,2,0,0,0,0|2,0,0]=4 1503 B15R1.5512 CC(C)CC(O)C(=O)NCc1ccc[nH]1 WXVL_AK00759SB4281 [0,2,0,0,0,0|2,0,0]=4 1504 B15R1.5512 CC(C)CC(O)C(=O)NCc1ccco1 WXVL_AK0010SB4281 [0,2,0,0,0,0|1,0,0]=3 1505 B15R1.5512 CC(C)CC(O)C(=O)NCc1ccco1 WXVL_AK0010SB4281 [0,2,0,0,0,0|1,0,0]=3 1506 B15R1.5512 CC(C)CC(O)C(=O)NCc1cccs1 WXVL_AK0014SB4281 [0,2,0,0,0,0|1,1,0]=4 1507 B15R1.5512 CC(C)CC(O)C(=O)NCc1cccs1 WXVL_AK0014SB4281 [0,2,0,0,0,0|1,1,0]=4 1508 B15R1.5512 CC(C)CC(O)C(=O)NCc1cnco1 WXVL_AK1437SB4281 [0,2,0,0,0,0|2,0,0]=4 1509 B15R1.5512 CC(C)CC(O)C(=O)NCc1cnco1 WXVL_AK1437SB4281 [0,2,0,0,0,0|2,0,0]=4 1510 B15R1.355 CC(C)CCC(=O)NCc1cccn1C WXVL_AK0499SB0354 [0,2,0,0,0,0|2,0,0]=4 1511 B15R1.355 CC(C)CCC(=O)NCc1cccn1C WXVL_AK0499SB0354 [0,2,0,0,0,0|2,0,0]=4 1512 B15R1.355 CC(C)CCC(=O)NCc1sccc1Cl WXVL_AK4332SB0354 [0,2,0,0,0,0|1,1,0]=4 1513 B15R1.355 CC(C)CCC(=O)NCc1sccc1Cl WXVL_AK4332SB0354 [0,2,0,0,0,0|1,1,0]=4 1514 B15R1.14834 CC(C)(C)CNC(=O)CCc1ccco1 WXVL_AK00655SA0167 [0,2,0,0,0,0|2,0,0]=4 1515 B15R1.14834 CC(C)(C)CNC(=O)CCc1ccco1 WXVL_AK00655SA0167 [0,2,0,0,0,0|2,0,0]=4 1516 B15R1.14834 CC(C)(C)OCC(=O)NCc1ccco1 WXVL_AK0010SB1440 [0,2,0,0,0,0|2,0,0]=4 1517 B15R1.14834 CC(C)(C)OCC(=O)NCc1ccco1 WXVL_AK0010SB1440 [0,2,0,0,0,0|2,0,0]=4 1518 B15R1.14834 CC(C)(F)CNC(=O)CCc1ccco1 WXVL_AK00660SA0167 [0,2,0,0,0,0|2,0,0]=4 1519 B15R1.14834 CC(C)(F)CNC(=O)CCc1ccco1 WXVL_AK00660SA0167 [0,2,0,0,0,0|2,0,0]=4 1520 B15R1.14834 CC(C)(O)CNC(=O)CCc1ccco1 WXVL_AK0490SA0167 [0,2,0,0,0,0|2,0,0]=4 1521 B15R1.14834 CC(C)(O)CNC(=O)CCc1ccco1 WXVL_AK0490SA0167 [0,2,0,0,0,0|2,0,0]=4 1522 B15R1.14834 CC(F)(F)CNC(=O)CCc1ccco1 WXVL_AK0308SA0167 [0,2,0,0,0,0|2,0,0]=4 1523 B15R1.14834 CC(F)(F)CNC(=O)CCc1ccco1 WXVL_AK0308SA0167 [0,2,0,0,0,0|2,0,0]=4 1524 B15R1.14834 CS(=O)(=O)CCC(=O)NCc1ccco1 WXVL_AK0010SB0009 [0,2,0,0,0,0|2,0,0]=4 1525 B15R1.14834 CS(=O)(=O)CCC(=O)NCc1ccco1 WXVL_AK0010SB0009 [0,2,0,0,0,0|2,0,0]=4 1526 B15R1.14834 O=C(CCC(F)(F)F)NCc1ccco1 WXVL_AK0010SB0174 [0,2,0,0,0,0|2,0,0]=4 1527 B15R1.14834 O=C(CCC(F)(F)F)NCc1ccco1 WXVL_AK0010SB0174 [0,2,0,0,0,0|2,0,0]=4 1528 B13R2.6970 O=C(NCc1ccc[nH]1)C2CC2 WXVL_AK00759SB0038 [1,0,0,1,0,0|2,0,0]=4 1529 B13R2.6970 O=C(NCc1ccc[nH]1)C2CC2 WXVL_AK00759SB0038 [1,0,0,1,0,0|2,0,0]=4 1530 B13R2.6970 O=C(NCc1ccco1)C2CC2 WXVL_AK0010SB0038 [1,0,0,1,0,0|1,0,0]=3 1531 B13R2.6970 O=C(NCc1ccco1)C2CC2 WXVL_AK0010SB0038 [1,0,0,1,0,0|1,0,0]=3 1532 B13R2.6970 O=C(NCc1cccs1)C2CC2 WXVL_AK0014SB0038 [1,0,0,1,0,0|1,1,0]=4 1533 B13R2.6970 O=C(NCc1cccs1)C2CC2 WXVL_AK0014SB0038 [1,0,0,1,0,0|1,1,0]=4 1534 B13R2.6970 O=C(NCc1cnco1)C2CC2 WXVL_AK1437SB0038 [1,0,0,1,0,0|2,0,0]=4 1535 B13R2.6970 O=C(NCc1cnco1)C2CC2 WXVL_AK1437SB0038 [1,0,0,1,0,0|2,0,0]=4 1536 B13R2.201 CC1CC1C(=O)Nc2ccno2 WXVL_AF0588SB0041 [0,0,0,1,1,0|2,0,0]=4 1537 B13R2.201 CC1CC1C(=O)Nc2ccno2 WXVL_AF0588SB0041 [0,0,0,1,1,0|2,0,0]=4 1538 B13R2.201 CC1CC1C(=O)Nc2ncco2 WXVL_AF0235SB0041 [0,0,0,1,1,0|2,0,0]=4 1539 B13R2.201 CC1CC1C(=O)Nc2ncco2 WXVL_AF0235SB0041 [0,0,0,1,1,0|2,0,0]=4 1540 B13R2.696 O=C(CC1CC1)Nc2ccno2 WXVL_AF0588SB0155 [0,0,0,1,1,0|2,0,0]=4 1541 B13R2.696 O=C(CC1CC1)Nc2ccno2 WXVL_AF0588SB0155 [0,0,0,1,1,0|2,0,0]=4 1542 B13R2.696 O=C(CC1CC1)Nc2ncco2 WXVL_AF0235SB0155 [0,0,0,1,1,0|2,0,0]=4 1543 B13R2.696 O=C(CC1CC1)Nc2ncco2 WXVL_AF0235SB0155 [0,0,0,1,1,0|2,0,0]=4 1544 B13R2.696 O=C(Cc1cccs1)NC2CC2 WXVL_AK0001SA0018 [0,0,0,1,1,0|1,1,0]=4 1545 B13R2.696 O=C(Cc1cccs1)NC2CC2 WXVL_AK0001SA0018 [0,0,0,1,1,0|1,1,0]=4 1546 B13R2.14233 O=C(Nc1ccno1)C2CCC2 WXVL_AF0588SB0042 [0,0,0,1,1,0|2,0,0]=4 1547 B13R2.14233 O=C(Nc1ccno1)C2CCC2 WXVL_AF0588SB0042 [0,0,0,1,1,0|2,0,0]=4 1548 B13R2.14233 O=C(Nc1ncco1)C2CCC2 WXVL_AF0235SB0042 [0,0,0,1,1,0|2,0,0]=4 1549 B13R2.14233 O=C(Nc1ncco1)C2CCC2 WXVL_AF0235SB0042 [0,0,0,1,1,0|2,0,0]=4 1550 B15R2.505 CC1CC1C(=O)NCc2ccccc2 WXVL_AK00502SB0041 [0,0,0,1,0,1|2,0,0]=4 1551 B15R2.505 CC1CC1C(=O)NCc2ccccc2 WXVL_AK00502SB0041 [0,0,0,1,0,1|2,0,0]=4 1552 B15R2.505 CC1CC1C(=O)NCc2ccccn2 WXVL_AK0018SB0041 [0,0,0,1,0,1|2,0,0]=4 1553 B15R2.505 CC1CC1C(=O)NCc2ccccn2 WXVL_AK0018SB0041 [0,0,0,1,0,1|2,0,0]=4 1554 B15R2.505 CC1CC1C(=O)NCc2cccnc2 WXVL_AK0020SB0041 [0,0,0,1,0,1|2,0,0]=4 1555 B15R2.505 CC1CC1C(=O)NCc2cccnc2 WXVL_AK0020SB0041 [0,0,0,1,0,1|2,0,0]=4 1556 B15R2.505 CC1CC1C(=O)NCc2ccncc2 WXVL_AK0021SB0041 [0,0,0,1,0,1|2,0,0]=4 1557 B15R2.505 CC1CC1C(=O)NCc2ccncc2 WXVL_AK0021SB0041 [0,0,0,1,0,1|2,0,0]=4 1558 B15R2.505 CC1CC1C(=O)NCc2ccncn2 WXVL_AK1356SB0041 [0,0,0,1,0,1|2,0,0]=4 1559 B15R2.505 CC1CC1C(=O)NCc2ccncn2 WXVL_AK1356SB0041 [0,0,0,1,0,1|2,0,0]=4 1560 B15R2.505 CC1CC1C(=O)NCc2cnccn2 WXVL_AK00262SB0041 [0,0,0,1,0,1|2,0,0]=4 1561 B15R2.505 CC1CC1C(=O)NCc2cnccn2 WXVL_AK00262SB0041 [0,0,0,1,0,1|2,0,0]=4 1562 B15R2.505 CC1CC1C(=O)NCc2ncccn2 WXVL_AK0279SB0041 [0,0,0,1,0,1|2,0,0]=4 1563 B15R2.505 CC1CC1C(=O)NCc2ncccn2 WXVL_AK0279SB0041 [0,0,0,1,0,1|2,0,0]=4 1564 B15R2.24490 O=C(NCc1ccccc1)C2CCC2 WXVL_AK00502SB0042 [0,0,0,1,0,1|2,0,0]=4 1565 B15R2.24490 O=C(NCc1ccccc1)C2CCC2 WXVL_AK00502SB0042 [0,0,0,1,0,1|2,0,0]=4 1566 B15R2.24490 O=C(NCc1ccccn1)C2CCC2 WXVL_AK0018SB0042 [0,0,0,1,0,1|2,0,0]=4 1567 B15R2.24490 O=C(NCc1ccccn1)C2CCC2 WXVL_AK0018SB0042 [0,0,0,1,0,1|2,0,0]=4 1568 B15R2.24490 O=C(NCc1cccnc1)C2CCC2 WXVL_AK0020SB0042 [0,0,0,1,0,1|2,0,0]=4 1569 B15R2.24490 O=C(NCc1cccnc1)C2CCC2 WXVL_AK0020SB0042 [0,0,0,1,0,1|2,0,0]=4 1570 B15R2.24490 O=C(NCc1ccncc1)C2CCC2 WXVL_AK0021SB0042 [0,0,0,1,0,1|2,0,0]=4 1571 B15R2.24490 O=C(NCc1ccncc1)C2CCC2 WXVL_AK0021SB0042 [0,0,0,1,0,1|2,0,0]=4 1572 B15R2.24490 O=C(NCc1ccncn1)C2CCC2 WXVL_AK1356SB0042 [0,0,0,1,0,1|2,0,0]=4 1573 B15R2.24490 O=C(NCc1ccncn1)C2CCC2 WXVL_AK1356SB0042 [0,0,0,1,0,1|2,0,0]=4 1574 B15R2.24490 O=C(NCc1cnccn1)C2CCC2 WXVL_AK00262SB0042 [0,0,0,1,0,1|2,0,0]=4 1575 B15R2.24490 O=C(NCc1cnccn1)C2CCC2 WXVL_AK00262SB0042 [0,0,0,1,0,1|2,0,0]=4 1576 B15R2.24490 O=C(NCc1ncccn1)C2CCC2 WXVL_AK0279SB0042 [0,0,0,1,0,1|2,0,0]=4 1577 B15R2.24490 O=C(NCc1ncccn1)C2CCC2 WXVL_AK0279SB0042 [0,0,0,1,0,1|2,0,0]=4 1578 B15R2.24494 O=C(CC1CC1)NCc2ccccc2 WXVL_AK00502SB0155 [0,0,0,1,0,1|2,0,0]=4 1579 B15R2.24494 O=C(CC1CC1)NCc2ccccc2 WXVL_AK00502SB0155 [0,0,0,1,0,1|2,0,0]=4 1580 B15R2.24494 O=C(CC1CC1)NCc2ccccn2 WXVL_AK0018SB0155 [0,0,0,1,0,1|2,0,0]=4 1581 B15R2.24494 O=C(CC1CC1)NCc2ccccn2 WXVL_AK0018SB0155 [0,0,0,1,0,1|2,0,0]=4 1582 B15R2.24494 O=C(CC1CC1)NCc2cccnc2 WXVL_AK0020SB0155 [0,0,0,1,0,1|2,0,0]=4 1583 B15R2.24494 O=C(CC1CC1)NCc2cccnc2 WXVL_AK0020SB0155 [0,0,0,1,0,1|2,0,0]=4 1584 B15R2.24494 O=C(CC1CC1)NCc2ccncc2 WXVL_AK0021SB0155 [0,0,0,1,0,1|2,0,0]=4 1585 B15R2.24494 O=C(CC1CC1)NCc2ccncc2 WXVL_AK0021SB0155 [0,0,0,1,0,1|2,0,0]=4 1586 B15R2.24494 O=C(CC1CC1)NCc2ccncn2 WXVL_AK1356SB0155 [0,0,0,1,0,1|2,0,0]=4 1587 B15R2.24494 O=C(CC1CC1)NCc2ccncn2 WXVL_AK1356SB0155 [0,0,0,1,0,1|2,0,0]=4 1588 B15R2.24494 O=C(CC1CC1)NCc2cnccn2 WXVL_AK00262SB0155 [0,0,0,1,0,1|2,0,0]=4 1589 B15R2.24494 O=C(CC1CC1)NCc2cnccn2 WXVL_AK00262SB0155 [0,0,0,1,0,1|2,0,0]=4 1590 B15R2.24494 O=C(CC1CC1)NCc2ncccn2 WXVL_AK0279SB0155 [0,0,0,1,0,1|2,0,0]=4 1591 B15R2.24494 O=C(CC1CC1)NCc2ncccn2 WXVL_AK0279SB0155 [0,0,0,1,0,1|2,0,0]=4 1592 B15R2.1061 CC1CC1C(=O)NCCc2ccco2 WXVL_AK0989SB0041 [0,0,0,1,0,1|1,0,0]=3 1593 B15R2.1061 CC1CC1C(=O)NCCc2ccco2 WXVL_AK0989SB0041 [0,0,0,1,0,1|1,0,0]=3 1594 B15R2.1061 CC1CC1C(=O)NCCc2cccs2 WXVL_AK0098SB0041 [0,0,0,1,0,1|1,1,0]=4 1595 B15R2.1061 CC1CC1C(=O)NCCc2cccs2 WXVL_AK0098SB0041 [0,0,0,1,0,1|1,1,0]=4 1596 B15R2.1061 O=C(NCCc1ccco1)[C@@H]2C[C@@H]2F WXVL_AK0989SB1245 [0,0,0,1,0,1|2,0,0]=4 1597 B15R2.1061 O=C(NCCc1ccco1)[C@@H]2C[C@@H]2F WXVL_AK0989SB1245 [0,0,0,1,0,1|2,0,0]=4 1598 B15R2.1061 O=C(NCCc1ccco1)[C@H]2C[C@H]2F WXVL_AK0989SB00019 [0,0,0,1,0,1|2,0,0]=4 1599 B15R2.1061 O=C(NCCc1ccco1)[C@H]2C[C@H]2F WXVL_AK0989SB00019 [0,0,0,1,0,1|2,0,0]=4 1600 B15R2.69949 O=C(CC1CC1)NCCc2ccco2 WXVL_AK0989SB0155 [0,0,0,1,0,1|1,0,0]=3 1601 B15R2.69949 O=C(CC1CC1)NCCc2ccco2 WXVL_AK0989SB0155 [0,0,0,1,0,1|1,0,0]=3 1602 B15R2.69949 O=C(CC1CC1)NCCc2cccs2 WXVL_AK0098SB0155 [0,0,0,1,0,1|1,1,0]=4 1603 B15R2.69949 O=C(CC1CC1)NCCc2cccs2 WXVL_AK0098SB0155 [0,0,0,1,0,1|1,1,0]=4 1604 B15R2.163937 O=C(NCCc1ccco1)C2CCC2 WXVL_AK0989SB0042 [0,0,0,1,0,1|1,0,0]=3 1605 B15R2.163937 O=C(NCCc1ccco1)C2CCC2 WXVL_AK0989SB0042 [0,0,0,1,0,1|1,0,0]=3 1606 B15R2.163937 O=C(NCCc1cccs1)C2CCC2 WXVL_AK0098SB0042 [0,0,0,1,0,1|1,1,0]=4 1607 B15R2.163937 O=C(NCCc1cccs1)C2CCC2 WXVL_AK0098SB0042 [0,0,0,1,0,1|1,1,0]=4 1608 B15R2.3989 O=C(/C=C/c1ccco1)N2CCCC2 WXVL_AN0008SA0180 [0,1,0,1,0,0|1,0,1]=4 1609 B15R2.3989 O=C(/C=C/c1ccco1)N2CCCC2 WXVL_AN0008SA0180 [0,1,0,1,0,0|1,0,1]=4 1610 B15R2.3989 O=C(CCc1ccc[nH]1)N2CCCC2 WXVL_AN0008SA0009 [0,1,0,1,0,0|2,0,0]=4 1611 B15R2.3989 O=C(CCc1ccc[nH]1)N2CCCC2 WXVL_AN0008SA0009 [0,1,0,1,0,0|2,0,0]=4 1612 B15R2.3989 O=C(CCc1ccco1)N2CCCC2 WXVL_AN0008SA0167 [0,1,0,1,0,0|1,0,0]=3 1613 B15R2.3989 O=C(CCc1ccco1)N2CCCC2 WXVL_AN0008SA0167 [0,1,0,1,0,0|1,0,0]=3 1614 B15R2.3989 O=C(CCc1cccs1)N2CCCC2 WXVL_AN0008SA0303 [0,1,0,1,0,0|1,1,0]=4 1615 B15R2.3989 O=C(CCc1cccs1)N2CCCC2 WXVL_AN0008SA0303 [0,1,0,1,0,0|1,1,0]=4 1616 B15R2.3989 O=C(NCc1ccc[nH]1)C2CCCC2 WXVL_AK00759SB0043 [0,1,0,1,0,0|2,0,0]=4 1617 B15R2.3989 O=C(NCc1ccc[nH]1)C2CCCC2 WXVL_AK00759SB0043 [0,1,0,1,0,0|2,0,0]=4 1618 B15R2.3989 O=C(NCc1ccc[nH]1)C2CCCO2 WXVL_AK00759SB1033 [0,1,0,1,0,0|2,0,0]=4 1619 B15R2.3989 O=C(NCc1ccc[nH]1)C2CCCO2 WXVL_AK00759SB1033 [0,1,0,1,0,0|2,0,0]=4 1620 B15R2.3989 O=C(NCc1ccc[nH]1)C2CCCS2 WXVL_AK00759SB0022 [0,1,0,1,0,0|2,0,0]=4 1621 B15R2.3989 O=C(NCc1ccc[nH]1)C2CCCS2 WXVL_AK00759SB0022 [0,1,0,1,0,0|2,0,0]=4 1622 B15R2.3989 O=C(NCc1ccc[nH]1)[C@H]2CCCO2 WXVL_AK00759SB00043 [0,1,0,1,0,0|2,0,0]=4 1623 B15R2.3989 O=C(NCc1ccc[nH]1)[C@H]2CCCO2 WXVL_AK00759SB00043 [0,1,0,1,0,0|2,0,0]=4 1624 B15R2.3989 O=C(NCc1ccco1)C2CCCC2 WXVL_AK0010SB0043 [0,1,0,1,0,0|1,0,0]=3 1625 B15R2.3989 O=C(NCc1ccco1)C2CCCC2 WXVL_AK0010SB0043 [0,1,0,1,0,0|1,0,0]=3 1626 B15R2.3989 O=C(NCc1ccco1)C2CCCO2 WXVL_AK0010SB1033 [0,1,0,1,0,0|1,0,0]=3 1627 B15R2.3989 O=C(NCc1ccco1)C2CCCO2 WXVL_AK0010SB1033 [0,1,0,1,0,0|1,0,0]=3 1628 B15R2.3989 O=C(NCc1ccco1)C2CCCS2 WXVL_AK0010SB0022 [0,1,0,1,0,0|1,0,0]=3 1629 B15R2.3989 O=C(NCc1ccco1)C2CCCS2 WXVL_AK0010SB0022 [0,1,0,1,0,0|1,0,0]=3 1630 B15R2.3989 O=C(NCc1ccco1)[C@H]2CCCO2 WXVL_AK0010SB00043 [0,1,0,1,0,0|1,0,0]=3 1631 B15R2.3989 O=C(NCc1ccco1)[C@H]2CCCO2 WXVL_AK0010SB00043 [0,1,0,1,0,0|1,0,0]=3 1632 B15R2.3989 O=C(NCc1cccs1)C2CCCC2 WXVL_AK0014SB0043 [0,1,0,1,0,0|1,1,0]=4 1633 B15R2.3989 O=C(NCc1cccs1)C2CCCC2 WXVL_AK0014SB0043 [0,1,0,1,0,0|1,1,0]=4 1634 B15R2.3989 O=C(NCc1cccs1)C2CCCO2 WXVL_AK0014SB1033 [0,1,0,1,0,0|1,1,0]=4 1635 B15R2.3989 O=C(NCc1cccs1)C2CCCO2 WXVL_AK0014SB1033 [0,1,0,1,0,0|1,1,0]=4 1636 B15R2.3989 O=C(NCc1cccs1)C2CCCS2 WXVL_AK0014SB0022 [0,1,0,1,0,0|1,1,0]=4 1637 B15R2.3989 O=C(NCc1cccs1)C2CCCS2 WXVL_AK0014SB0022 [0,1,0,1,0,0|1,1,0]=4 1638 B15R2.3989 O=C(NCc1cccs1)[C@H]2CCCO2 WXVL_AK0014SB00043 [0,1,0,1,0,0|1,1,0]=4 1639 B15R2.3989 O=C(NCc1cccs1)[C@H]2CCCO2 WXVL_AK0014SB00043 [0,1,0,1,0,0|1,1,0]=4 1640 B15R2.3989 O=C(NCc1cnco1)C2CCCC2 WXVL_AK1437SB0043 [0,1,0,1,0,0|2,0,0]=4 1641 B15R2.3989 O=C(NCc1cnco1)C2CCCC2 WXVL_AK1437SB0043 [0,1,0,1,0,0|2,0,0]=4 1642 B15R2.3989 O=C(NCc1cnco1)C2CCCO2 WXVL_AK1437SB1033 [0,1,0,1,0,0|2,0,0]=4 1643 B15R2.3989 O=C(NCc1cnco1)C2CCCO2 WXVL_AK1437SB1033 [0,1,0,1,0,0|2,0,0]=4 1644 B15R2.3989 O=C(NCc1cnco1)C2CCCS2 WXVL_AK1437SB0022 [0,1,0,1,0,0|2,0,0]=4 1645 B15R2.3989 O=C(NCc1cnco1)C2CCCS2 WXVL_AK1437SB0022 [0,1,0,1,0,0|2,0,0]=4 1646 B15R2.3989 O=C(NCc1cnco1)[C@H]2CCCO2 WXVL_AK1437SB00043 [0,1,0,1,0,0|2,0,0]=4 1647 B15R2.3989 O=C(NCc1cnco1)[C@H]2CCCO2 WXVL_AK1437SB00043 [0,1,0,1,0,0|2,0,0]=4 1648 B15R2.24499 O=C(C=CC1CC1)NCc2ccco2 WXVL_AK0010SB4216 [0,1,0,1,0,0|1,0,1]=4 1649 B15R2.24499 O=C(C=CC1CC1)NCc2ccco2 WXVL_AK0010SB4216 [0,1,0,1,0,0|1,0,1]=4 1650 B15R2.24499 O=C(CCC1CC1)NCc2ccc[nH]2 WXVL_AK00759SB5360 [0,1,0,1,0,0|2,0,0]=4 1651 B15R2.24499 O=C(CCC1CC1)NCc2ccc[nH]2 WXVL_AK00759SB5360 [0,1,0,1,0,0|2,0,0]=4 1652 B15R2.24499 O=C(CCC1CC1)NCc2ccco2 WXVL_AK0010SB5360 [0,1,0,1,0,0|1,0,0]=3 1653 B15R2.24499 O=C(CCC1CC1)NCc2ccco2 WXVL_AK0010SB5360 [0,1,0,1,0,0|1,0,0]=3 1654 B15R2.24499 O=C(CCC1CC1)NCc2cccs2 WXVL_AK0014SB5360 [0,1,0,1,0,0|1,1,0]=4 1655 B15R2.24499 O=C(CCC1CC1)NCc2cccs2 WXVL_AK0014SB5360 [0,1,0,1,0,0|1,1,0]=4 1656 B15R2.24499 O=C(CCC1CC1)NCc2cnco2 WXVL_AK1437SB5360 [0,1,0,1,0,0|2,0,0]=4 1657 B15R2.24499 O=C(CCC1CC1)NCc2cnco2 WXVL_AK1437SB5360 [0,1,0,1,0,0|2,0,0]=4 1658 B15R2.95187 O=C(CC1CCC1)NCc2ccc[nH]2 WXVL_AK00759SB2207 [0,1,0,1,0,0|2,0,0]=4 1659 B15R2.95187 O=C(CC1CCC1)NCc2ccc[nH]2 WXVL_AK00759SB2207 [0,1,0,1,0,0|2,0,0]=4 1660 B15R2.95187 O=C(CC1CCC1)NCc2ccco2 WXVL_AK0010SB2207 [0,1,0,1,0,0|1,0,0]=3 1661 B15R2.95187 O=C(CC1CCC1)NCc2ccco2 WXVL_AK0010SB2207 [0,1,0,1,0,0|1,0,0]=3 1662 B15R2.95187 O=C(CC1CCC1)NCc2cccs2 WXVL_AK0014SB2207 [0,1,0,1,0,0|1,1,0]=4 1663 B15R2.95187 O=C(CC1CCC1)NCc2cccs2 WXVL_AK0014SB2207 [0,1,0,1,0,0|1,1,0]=4 1664 B15R2.95187 O=C(CC1CCC1)NCc2cnco2 WXVL_AK1437SB2207 [0,1,0,1,0,0|2,0,0]=4 1665 B15R2.95187 O=C(CC1CCC1)NCc2cnco2 WXVL_AK1437SB2207 [0,1,0,1,0,0|2,0,0]=4 1666 B15R2.95187 O=C(CCc1ccco1)NC2CNC2 WXVL_AK1291SA0167 [0,1,0,1,0,0|2,0,0]=4 1667 B15R2.95187 O=C(CCc1ccco1)NC2CNC2 WXVL_AK1291SA0167 [0,1,0,1,0,0|2,0,0]=4 1668 B15R2.95187 O=C(CCc1ccco1)NC2CSC2 WXVL_AK2089SA0167 [0,1,0,1,0,0|2,0,0]=4 1669 B15R2.95187 O=C(CCc1ccco1)NC2CSC2 WXVL_AK2089SA0167 [0,1,0,1,0,0|2,0,0]=4 1670 B15R2.1060 CC(NC(=O)C1CC1C)c2ccno2 WXVL_AK6536SB0041 [0,1,0,1,0,0|2,0,0]=4 1671 B15R2.1060 CC(NC(=O)C1CC1C)c2ccno2 WXVL_AK6536SB0041 [0,1,0,1,0,0|2,0,0]=4 1672 B15R2.1060 CC1CC1C(=O)N[C@@H](C)c2cccs2 WXVL_AK00667SB0041 [0,1,0,1,0,0|1,1,0]=4 1673 B15R2.1060 CC1CC1C(=O)N[C@@H](C)c2cccs2 WXVL_AK00667SB0041 [0,1,0,1,0,0|1,1,0]=4 1674 B15R2.6857 CC(NC(=O)C1CCC1)c2ccno2 WXVL_AK6536SB0042 [0,1,0,1,0,0|2,0,0]=4 1675 B15R2.6857 CC(NC(=O)C1CCC1)c2ccno2 WXVL_AK6536SB0042 [0,1,0,1,0,0|2,0,0]=4 1676 B15R2.6857 C[C@H](NC(=O)C1CCC1)c2cccs2 WXVL_AK00667SB0042 [0,1,0,1,0,0|1,1,0]=4 1677 B15R2.6857 C[C@H](NC(=O)C1CCC1)c2cccs2 WXVL_AK00667SB0042 [0,1,0,1,0,0|1,1,0]=4 1678 B15R2.16434 CC(NC(=O)CC1CC1)c2ccno2 WXVL_AK6536SB0155 [0,1,0,1,0,0|2,0,0]=4 1679 B15R2.16434 CC(NC(=O)CC1CC1)c2ccno2 WXVL_AK6536SB0155 [0,1,0,1,0,0|2,0,0]=4 1680 B15R2.16434 C[C@H](NC(=O)CC1CC1)c2cccs2 WXVL_AK00667SB0155 [0,1,0,1,0,0|1,1,0]=4 1681 B15R2.16434 C[C@H](NC(=O)CC1CC1)c2cccs2 WXVL_AK00667SB0155 [0,1,0,1,0,0|1,1,0]=4 1682 B15R2.6920 CC1CC1C(=O)NCc2cc(cs2)Br WXVL_AK00192SB0041 [0,1,0,1,0,0|1,1,0]=4 1683 B15R2.6920 CC1CC1C(=O)NCc2cc(cs2)Br WXVL_AK00192SB0041 [0,1,0,1,0,0|1,1,0]=4 1684 B15R2.6920 CC1CC1C(=O)NCc2cc(no2)Br WXVL_AK1427SB0041 [0,1,0,1,0,0|2,0,0]=4 1685 B15R2.6920 CC1CC1C(=O)NCc2cc(no2)Br WXVL_AK1427SB0041 [0,1,0,1,0,0|2,0,0]=4 1686 B15R2.6920 CC1CC1C(=O)NCc2ccc(s2)Br WXVL_AK2468SB0041 [0,1,0,1,0,0|1,1,0]=4 1687 B15R2.6920 CC1CC1C(=O)NCc2ccc(s2)Br WXVL_AK2468SB0041 [0,1,0,1,0,0|1,1,0]=4 1688 B15R2.6920 CC1CC1C(=O)NCc2ccc(s2)Cl WXVL_AK00166SB0041 [0,1,0,1,0,0|1,1,0]=4 1689 B15R2.6920 CC1CC1C(=O)NCc2ccc(s2)Cl WXVL_AK00166SB0041 [0,1,0,1,0,0|1,1,0]=4 1690 B15R2.6920 Cc1cc(on1)CNC(=O)C2CC2C WXVL_AK1064SB0041 [0,1,0,1,0,0|2,0,0]=4 1691 B15R2.6920 Cc1cc(on1)CNC(=O)C2CC2C WXVL_AK1064SB0041 [0,1,0,1,0,0|2,0,0]=4 1692 B15R2.6920 Cc1ccc(s1)CNC(=O)C2CC2C WXVL_AK0276SB0041 [0,1,0,1,0,0|1,1,0]=4 1693 B15R2.6920 Cc1ccc(s1)CNC(=O)C2CC2C WXVL_AK0276SB0041 [0,1,0,1,0,0|1,1,0]=4 1694 B15R2.6948 Cc1cc(on1)CNC(=O)CC2CC2 WXVL_AK1064SB0155 [0,1,0,1,0,0|2,0,0]=4 1695 B15R2.6948 Cc1cc(on1)CNC(=O)CC2CC2 WXVL_AK1064SB0155 [0,1,0,1,0,0|2,0,0]=4 1696 B15R2.6948 Cc1ccc(s1)CNC(=O)CC2CC2 WXVL_AK0276SB0155 [0,1,0,1,0,0|1,1,0]=4 1697 B15R2.6948 Cc1ccc(s1)CNC(=O)CC2CC2 WXVL_AK0276SB0155 [0,1,0,1,0,0|1,1,0]=4 1698 B15R2.6948 O=C(CC1CC1)NCc2cc(cs2)Br WXVL_AK00192SB0155 [0,1,0,1,0,0|1,1,0]=4 1699 B15R2.6948 O=C(CC1CC1)NCc2cc(cs2)Br WXVL_AK00192SB0155 [0,1,0,1,0,0|1,1,0]=4 1700 B15R2.6948 O=C(CC1CC1)NCc2cc(no2)Br WXVL_AK1427SB0155 [0,1,0,1,0,0|2,0,0]=4 1701 B15R2.6948 O=C(CC1CC1)NCc2cc(no2)Br WXVL_AK1427SB0155 [0,1,0,1,0,0|2,0,0]=4 1702 B15R2.6948 O=C(CC1CC1)NCc2ccc(s2)Br WXVL_AK2468SB0155 [0,1,0,1,0,0|1,1,0]=4 1703 B15R2.6948 O=C(CC1CC1)NCc2ccc(s2)Br WXVL_AK2468SB0155 [0,1,0,1,0,0|1,1,0]=4 1704 B15R2.6948 O=C(CC1CC1)NCc2ccc(s2)Cl WXVL_AK00166SB0155 [0,1,0,1,0,0|1,1,0]=4 1705 B15R2.6948 O=C(CC1CC1)NCc2ccc(s2)Cl WXVL_AK00166SB0155 [0,1,0,1,0,0|1,1,0]=4 1706 B15R2.41332 Cc1cc(on1)CNC(=O)C2CCC2 WXVL_AK1064SB0042 [0,1,0,1,0,0|2,0,0]=4 1707 B15R2.41332 Cc1cc(on1)CNC(=O)C2CCC2 WXVL_AK1064SB0042 [0,1,0,1,0,0|2,0,0]=4 1708 B15R2.41332 Cc1ccc(s1)CNC(=O)C2CCC2 WXVL_AK0276SB0042 [0,1,0,1,0,0|1,1,0]=4 1709 B15R2.41332 Cc1ccc(s1)CNC(=O)C2CCC2 WXVL_AK0276SB0042 [0,1,0,1,0,0|1,1,0]=4 1710 B15R2.41332 O=C(NCc1cc(cs1)Br)C2CCC2 WXVL_AK00192SB0042 [0,1,0,1,0,0|1,1,0]=4 1711 B15R2.41332 O=C(NCc1cc(cs1)Br)C2CCC2 WXVL_AK00192SB0042 [0,1,0,1,0,0|1,1,0]=4 1712 B15R2.41332 O=C(NCc1cc(no1)Br)C2CCC2 WXVL_AK1427SB0042 [0,1,0,1,0,0|2,0,0]=4 1713 B15R2.41332 O=C(NCc1cc(no1)Br)C2CCC2 WXVL_AK1427SB0042 [0,1,0,1,0,0|2,0,0]=4 1714 B15R2.41332 O=C(NCc1ccc(s1)Br)C2CCC2 WXVL_AK2468SB0042 [0,1,0,1,0,0|1,1,0]=4 1715 B15R2.41332 O=C(NCc1ccc(s1)Br)C2CCC2 WXVL_AK2468SB0042 [0,1,0,1,0,0|1,1,0]=4 1716 B15R2.41332 O=C(NCc1ccc(s1)Cl)C2CCC2 WXVL_AK00166SB0042 [0,1,0,1,0,0|1,1,0]=4 1717 B15R2.41332 O=C(NCc1ccc(s1)Cl)C2CCC2 WXVL_AK00166SB0042 [0,1,0,1,0,0|1,1,0]=4 1718 B15R2.16460 CC(Cc1ccco1)C(=O)NC2CC2 WXVL_AK0001SA2637 [0,1,0,1,0,0|2,0,0]=4 1719 B15R2.16460 CC(Cc1ccco1)C(=O)NC2CC2 WXVL_AK0001SA2637 [0,1,0,1,0,0|2,0,0]=4 1720 B15R2.24491 CC1(CC1)NC(=O)CCc2ccco2 WXVL_AK0263SA0167 [0,1,0,1,0,0|2,0,0]=4 1721 B15R2.24491 CC1(CC1)NC(=O)CCc2ccco2 WXVL_AK0263SA0167 [0,1,0,1,0,0|2,0,0]=4 1722 B15R2.1095 C=C1CC(C1)C(=O)NCc2ccco2 WXVL_AK0010SB0804 [0,1,0,1,0,0|1,0,1]=4 1723 B15R2.1095 C=C1CC(C1)C(=O)NCc2ccco2 WXVL_AK0010SB0804 [0,1,0,1,0,0|1,0,1]=4 1724 B15R2.1095 CC1CN(C1)C(=O)CCc2ccco2 WXVL_AN0291SA0167 [0,1,0,1,0,0|2,0,0]=4 1725 B15R2.1095 CC1CN(C1)C(=O)CCc2ccco2 WXVL_AN0291SA0167 [0,1,0,1,0,0|2,0,0]=4 1726 B15R2.1095 CN1CC(C1)C(=O)NCc2ccco2 WXVL_AK0010SB0021 [0,1,0,1,0,0|2,0,0]=4 1727 B15R2.1095 CN1CC(C1)C(=O)NCc2ccco2 WXVL_AK0010SB0021 [0,1,0,1,0,0|2,0,0]=4 1728 B15R2.1095 O=C(CCc1ccco1)N2CC(C2)O WXVL_AN0284SA0167 [0,1,0,1,0,0|2,0,0]=4 1729 B15R2.1095 O=C(CCc1ccco1)N2CC(C2)O WXVL_AN0284SA0167 [0,1,0,1,0,0|2,0,0]=4 1730 B15R2.1095 O=C(NCc1ccc[nH]1)[C@H]2C[C@@H](C2)O WXVL_AK00759SB3648 [0,1,0,1,0,0|2,0,0]=4 1731 B15R2.1095 O=C(NCc1ccc[nH]1)[C@H]2C[C@@H](C2)O WXVL_AK00759SB3648 [0,1,0,1,0,0|2,0,0]=4 1732 B15R2.1095 O=C(NCc1ccc[nH]1)[C@H]2C[C@H](C2)O WXVL_AK00759SB0837 [0,1,0,1,0,0|2,0,0]=4 1733 B15R2.1095 O=C(NCc1ccc[nH]1)[C@H]2C[C@H](C2)O WXVL_AK00759SB0837 [0,1,0,1,0,0|2,0,0]=4 1734 B15R2.1095 O=C(NCc1ccco1)[C@H]2C[C@@H](C2)O WXVL_AK0010SB3648 [0,1,0,1,0,0|1,0,0]=3 1735 B15R2.1095 O=C(NCc1ccco1)[C@H]2C[C@@H](C2)O WXVL_AK0010SB3648 [0,1,0,1,0,0|1,0,0]=3 1736 B15R2.1095 O=C(NCc1ccco1)[C@H]2C[C@H](C2)O WXVL_AK0010SB0837 [0,1,0,1,0,0|1,0,0]=3 1737 B15R2.1095 O=C(NCc1ccco1)[C@H]2C[C@H](C2)O WXVL_AK0010SB0837 [0,1,0,1,0,0|1,0,0]=3 1738 B15R2.1095 O=C(NCc1cccs1)[C@H]2C[C@@H](C2)O WXVL_AK0014SB3648 [0,1,0,1,0,0|1,1,0]=4 1739 B15R2.1095 O=C(NCc1cccs1)[C@H]2C[C@@H](C2)O WXVL_AK0014SB3648 [0,1,0,1,0,0|1,1,0]=4 1740 B15R2.1095 O=C(NCc1cccs1)[C@H]2C[C@H](C2)O WXVL_AK0014SB0837 [0,1,0,1,0,0|1,1,0]=4 1741 B15R2.1095 O=C(NCc1cccs1)[C@H]2C[C@H](C2)O WXVL_AK0014SB0837 [0,1,0,1,0,0|1,1,0]=4 1742 B15R2.1095 O=C(NCc1cnco1)[C@H]2C[C@@H](C2)O WXVL_AK1437SB3648 [0,1,0,1,0,0|2,0,0]=4 1743 B15R2.1095 O=C(NCc1cnco1)[C@H]2C[C@@H](C2)O WXVL_AK1437SB3648 [0,1,0,1,0,0|2,0,0]=4 1744 B15R2.1095 O=C(NCc1cnco1)[C@H]2C[C@H](C2)O WXVL_AK1437SB0837 [0,1,0,1,0,0|2,0,0]=4 1745 B15R2.1095 O=C(NCc1cnco1)[C@H]2C[C@H](C2)O WXVL_AK1437SB0837 [0,1,0,1,0,0|2,0,0]=4 1746 B15R2.24497 CN(C(=O)CCc1ccco1)C2CC2 WXVL_AN0276SA0167 [0,1,0,1,0,0|2,0,0]=4 1747 B15R2.24497 CN(C(=O)CCc1ccco1)C2CC2 WXVL_AN0276SA0167 [0,1,0,1,0,0|2,0,0]=4 1748 B15R2.24497 O=C(NCc1ccco1)C(=O)C2CC2 WXVL_AK0010SB3659 [0,1,0,1,0,0|1,0,1]=4 1749 B15R2.24497 O=C(NCc1ccco1)C(=O)C2CC2 WXVL_AK0010SB3659 [0,1,0,1,0,0|1,0,1]=4 1750 B15R2.95176 CC1(CCC1)C(=O)NCc2ccc[nH]2 WXVL_AK00759SB0805 [0,1,0,1,0,0|2,0,0]=4 1751 B15R2.95176 CC1(CCC1)C(=O)NCc2ccc[nH]2 WXVL_AK00759SB0805 [0,1,0,1,0,0|2,0,0]=4 1752 B15R2.95176 CC1(CCC1)C(=O)NCc2ccco2 WXVL_AK0010SB0805 [0,1,0,1,0,0|1,0,0]=3 1753 B15R2.95176 CC1(CCC1)C(=O)NCc2ccco2 WXVL_AK0010SB0805 [0,1,0,1,0,0|1,0,0]=3 1754 B15R2.95176 CC1(CCC1)C(=O)NCc2cccs2 WXVL_AK0014SB0805 [0,1,0,1,0,0|1,1,0]=4 1755 B15R2.95176 CC1(CCC1)C(=O)NCc2cccs2 WXVL_AK0014SB0805 [0,1,0,1,0,0|1,1,0]=4 1756 B15R2.95176 CC1(CCC1)C(=O)NCc2cnco2 WXVL_AK1437SB0805 [0,1,0,1,0,0|2,0,0]=4 1757 B15R2.95176 CC1(CCC1)C(=O)NCc2cnco2 WXVL_AK1437SB0805 [0,1,0,1,0,0|2,0,0]=4 1758 B15R2.95176 CC1(COC1)C(=O)NCc2ccco2 WXVL_AK0010SB0214 [0,1,0,1,0,0|2,0,0]=4 1759 B15R2.95176 CC1(COC1)C(=O)NCc2ccco2 WXVL_AK0010SB0214 [0,1,0,1,0,0|2,0,0]=4 1760 B15R2.95176 O=C(NCc1ccc[nH]1)C2(CCC2)Br WXVL_AK00759SB0465 [0,1,0,1,0,0|2,0,0]=4 1761 B15R2.95176 O=C(NCc1ccc[nH]1)C2(CCC2)Br WXVL_AK00759SB0465 [0,1,0,1,0,0|2,0,0]=4 1762 B15R2.95176 O=C(NCc1ccc[nH]1)C2(CCC2)F WXVL_AK00759SB0033 [0,1,0,1,0,0|2,0,0]=4 1763 B15R2.95176 O=C(NCc1ccc[nH]1)C2(CCC2)F WXVL_AK00759SB0033 [0,1,0,1,0,0|2,0,0]=4 1764 B15R2.95176 O=C(NCc1ccco1)C2(CCC2)Br WXVL_AK0010SB0465 [0,1,0,1,0,0|1,0,0]=3 1765 B15R2.95176 O=C(NCc1ccco1)C2(CCC2)Br WXVL_AK0010SB0465 [0,1,0,1,0,0|1,0,0]=3 1766 B15R2.95176 O=C(NCc1ccco1)C2(CCC2)F WXVL_AK0010SB0033 [0,1,0,1,0,0|1,0,0]=3 1767 B15R2.95176 O=C(NCc1ccco1)C2(CCC2)F WXVL_AK0010SB0033 [0,1,0,1,0,0|1,0,0]=3 1768 B15R2.95176 O=C(NCc1cccs1)C2(CCC2)Br WXVL_AK0014SB0465 [0,1,0,1,0,0|1,1,0]=4 1769 B15R2.95176 O=C(NCc1cccs1)C2(CCC2)Br WXVL_AK0014SB0465 [0,1,0,1,0,0|1,1,0]=4 1770 B15R2.95176 O=C(NCc1cccs1)C2(CCC2)F WXVL_AK0014SB0033 [0,1,0,1,0,0|1,1,0]=4 1771 B15R2.95176 O=C(NCc1cccs1)C2(CCC2)F WXVL_AK0014SB0033 [0,1,0,1,0,0|1,1,0]=4 1772 B15R2.95176 O=C(NCc1cnco1)C2(CCC2)Br WXVL_AK1437SB0465 [0,1,0,1,0,0|2,0,0]=4 1773 B15R2.95176 O=C(NCc1cnco1)C2(CCC2)Br WXVL_AK1437SB0465 [0,1,0,1,0,0|2,0,0]=4 1774 B15R2.95176 O=C(NCc1cnco1)C2(CCC2)F WXVL_AK1437SB0033 [0,1,0,1,0,0|2,0,0]=4 1775 B15R2.95176 O=C(NCc1cnco1)C2(CCC2)F WXVL_AK1437SB0033 [0,1,0,1,0,0|2,0,0]=4 1776 B15R2.7644 CC1CC1C(=O)NCc2cccn2C WXVL_AK0499SB0041 [0,1,0,1,0,0|2,0,0]=4 1777 B15R2.7644 CC1CC1C(=O)NCc2cccn2C WXVL_AK0499SB0041 [0,1,0,1,0,0|2,0,0]=4 1778 B15R2.7644 CC1CC1C(=O)NCc2sccc2Cl WXVL_AK4332SB0041 [0,1,0,1,0,0|1,1,0]=4 1779 B15R2.7644 CC1CC1C(=O)NCc2sccc2Cl WXVL_AK4332SB0041 [0,1,0,1,0,0|1,1,0]=4 1780 B15R2.8487 Cn1cccc1CNC(=O)CC2CC2 WXVL_AK0499SB0155 [0,1,0,1,0,0|2,0,0]=4 1781 B15R2.8487 Cn1cccc1CNC(=O)CC2CC2 WXVL_AK0499SB0155 [0,1,0,1,0,0|2,0,0]=4 1782 B15R2.8487 O=C(CC1CC1)NCc2sccc2Cl WXVL_AK4332SB0155 [0,1,0,1,0,0|1,1,0]=4 1783 B15R2.8487 O=C(CC1CC1)NCc2sccc2Cl WXVL_AK4332SB0155 [0,1,0,1,0,0|1,1,0]=4 1784 B15R2.44125 Cn1cccc1CNC(=O)C2CCC2 WXVL_AK0499SB0042 [0,1,0,1,0,0|2,0,0]=4 1785 B15R2.44125 Cn1cccc1CNC(=O)C2CCC2 WXVL_AK0499SB0042 [0,1,0,1,0,0|2,0,0]=4 1786 B15R2.44125 O=C(NCc1sccc1Cl)C2CCC2 WXVL_AK4332SB0042 [0,1,0,1,0,0|1,1,0]=4 1787 B15R2.44125 O=C(NCc1sccc1Cl)C2CCC2 WXVL_AK4332SB0042 [0,1,0,1,0,0|1,1,0]=4 1788 B15R2.95177 CC1(CC1C(=O)NCc2ccc[nH]2)C WXVL_AK00759SB0012 [0,1,0,1,0,0|2,0,0]=4 1789 B15R2.95177 CC1(CC1C(=O)NCc2ccc[nH]2)C WXVL_AK00759SB0012 [0,1,0,1,0,0|2,0,0]=4 1790 B15R2.95177 CC1(CC1C(=O)NCc2ccco2)C WXVL_AK0010SB0012 [0,1,0,1,0,0|1,0,0]=3 1791 B15R2.95177 CC1(CC1C(=O)NCc2ccco2)C WXVL_AK0010SB0012 [0,1,0,1,0,0|1,0,0]=3 1792 B15R2.95177 CC1(CC1C(=O)NCc2cccs2)C WXVL_AK0014SB0012 [0,1,0,1,0,0|1,1,0]=4 1793 B15R2.95177 CC1(CC1C(=O)NCc2cccs2)C WXVL_AK0014SB0012 [0,1,0,1,0,0|1,1,0]=4 1794 B15R2.95177 CC1(CC1C(=O)NCc2cnco2)C WXVL_AK1437SB0012 [0,1,0,1,0,0|2,0,0]=4 1795 B15R2.95177 CC1(CC1C(=O)NCc2cnco2)C WXVL_AK1437SB0012 [0,1,0,1,0,0|2,0,0]=4 1796 B15R2.95177 O=C(NCc1ccco1)C2CC2(F)F WXVL_AK0010SB0843 [0,1,0,1,0,0|2,0,0]=4 1797 B15R2.95177 O=C(NCc1ccco1)C2CC2(F)F WXVL_AK0010SB0843 [0,1,0,1,0,0|2,0,0]=4 1798 B15R2.135144 O=S(=O)(CC1CC1)NCc2ccco2 WXVL_AK0010HU0351 [0,1,0,1,0,0|2,0,0]=4 1799 B15R2.135144 O=S(=O)(CC1CC1)NCc2ccco2 WXVL_AK0010HU0351 [0,1,0,1,0,0|2,0,0]=4 1800 B11R1.30 CCCC(=O)Nc1ccno1 WXVL_AF0588SB0073 [1,0,0,0,1,0|2,0,0]=4 1801 B11R1.30 CCCC(=O)Nc1ccno1 WXVL_AF0588SB0073 [1,0,0,0,1,0|2,0,0]=4 1802 B11R1.30 CCCC(=O)Nc1ncco1 WXVL_AF0235SB0073 [1,0,0,0,1,0|2,0,0]=4 1803 B11R1.30 CCCC(=O)Nc1ncco1 WXVL_AF0235SB0073 [1,0,0,0,1,0|2,0,0]=4 1804 B11R1.30 CCNC(=O)Cc1cccs1 WXVL_AK00476SA0018 [1,0,0,0,1,0|1,1,0]=4 1805 B11R1.30 CCNC(=O)Cc1cccs1 WXVL_AK00476SA0018 [1,0,0,0,1,0|1,1,0]=4 1806 B11R1.29 CCCNC(=O)c1ccco1 WXVL_AK00504SC0049 [0,0,0,0,2,0|1,0,0]=3 1807 B11R1.29 CCCNC(=O)c1ccco1 WXVL_AK00504SC0049 [0,0,0,0,2,0|1,0,0]=3 1808 B11R1.29 CCCNC(=O)c1cccs1 WXVL_AK00504SC0051 [0,0,0,0,2,0|1,1,0]=4 1809 B11R1.29 CCCNC(=O)c1cccs1 WXVL_AK00504SC0051 [0,0,0,0,2,0|1,1,0]=4 1810 B11R1.29 CCCNC(=O)c1ccno1 WXVL_AK00504SC0080 [0,0,0,0,2,0|2,0,0]=4 1811 B11R1.29 CCCNC(=O)c1ccno1 WXVL_AK00504SC0080 [0,0,0,0,2,0|2,0,0]=4 1812 B11R1.29 CCCNC(=O)c1cnco1 WXVL_AK00504SC0018 [0,0,0,0,2,0|2,0,0]=4 1813 B11R1.29 CCCNC(=O)c1cnco1 WXVL_AK00504SC0018 [0,0,0,0,2,0|2,0,0]=4 1814 B11R1.29 O=C(NCCF)c1ccco1 WXVL_AK00466SC0049 [0,0,0,0,2,0|2,0,0]=4 1815 B11R1.29 O=C(NCCF)c1ccco1 WXVL_AK00466SC0049 [0,0,0,0,2,0|2,0,0]=4 1816 B15R1.157 CCCNC(=O)COCc1ccccc1 WXVL_AK00504SB0185 [0,0,0,0,0,2|2,0,0]=4 1817 B15R1.157 CCCNC(=O)COCc1ccccc1 WXVL_AK00504SB0185 [0,0,0,0,0,2|2,0,0]=4