0 B8R1.8 CNCc1cc[nH]c1 WXDL_LN01985689_AN4223_QS1121 [0,0,0,0,0,0|3,0,1]=4 1 B8R1.8 CNCc1cc[nH]c1 WXDL_WXCD00610088_AN4223_QS1121 [0,0,0,0,0,0|3,0,1]=4 2 B8R1.8 CNCc1cc[nH]c1 WXDL_WXCD00611001_AN4223_QS1121 [0,0,0,0,0,0|3,0,1]=4 3 B8R1.8 CNCc1cc[nH]c1 WXDL_WXCD00611199_AN4223_QS1121 [0,0,0,0,0,0|3,0,1]=4 4 B8R1.8 CNCc1cc[nH]c1 WXDL_WXCD00611670_AN4223_QS1121 [0,0,0,0,0,0|3,0,1]=4 5 B8R1.8 CNCc1cc[nH]c1 WXDL_WXCD00611671_AN4223_QS1121 [0,0,0,0,0,0|3,0,1]=4 6 B8R1.8 CNCc1cc[nH]c1 WXDL_WXCD00905463_AN4223_QS1121 [0,0,0,0,0,0|3,0,1]=4 7 B8R1.8 CNCc1cc[nH]c1 WXDL_WXCD01004270_AN4223_QS1121 [0,0,0,0,0,0|3,0,1]=4 8 B8R1.8 CNCc1cc[nH]c1 WXDL_WXCD02002292_AN4223_QS1121 [0,0,0,0,0,0|3,0,1]=4 9 B8R1.8 CNCc1ccc[nH]1 WXDL_LN01985689_AN4223_QS0096 [0,0,0,0,0,0|3,0,0]=3 10 B8R1.8 CNCc1ccc[nH]1 WXDL_WXCD00610088_AN4223_QS0096 [0,0,0,0,0,0|3,0,0]=3 11 B8R1.8 CNCc1ccc[nH]1 WXDL_WXCD00611001_AN4223_QS0096 [0,0,0,0,0,0|3,0,0]=3 12 B8R1.8 CNCc1ccc[nH]1 WXDL_WXCD00611199_AN4223_QS0096 [0,0,0,0,0,0|3,0,0]=3 13 B8R1.8 CNCc1ccc[nH]1 WXDL_WXCD00611670_AN4223_QS0096 [0,0,0,0,0,0|3,0,0]=3 14 B8R1.8 CNCc1ccc[nH]1 WXDL_WXCD00611671_AN4223_QS0096 [0,0,0,0,0,0|3,0,0]=3 15 B8R1.8 CNCc1ccc[nH]1 WXDL_WXCD00905463_AN4223_QS0096 [0,0,0,0,0,0|3,0,0]=3 16 B8R1.8 CNCc1ccc[nH]1 WXDL_WXCD01004270_AN4223_QS0096 [0,0,0,0,0,0|3,0,0]=3 17 B8R1.8 CNCc1ccc[nH]1 WXDL_WXCD02002292_AN4223_QS0096 [0,0,0,0,0,0|3,0,0]=3 18 B8R1.8 CNCc1cccs1 WXDL_LN01985689_AN4223_QS0097 [0,0,0,0,0,0|4,0,0]=4 19 B8R1.8 CNCc1cccs1 WXDL_WXCD00610088_AN4223_QS0097 [0,0,0,0,0,0|4,0,0]=4 20 B8R1.8 CNCc1cccs1 WXDL_WXCD00611001_AN4223_QS0097 [0,0,0,0,0,0|4,0,0]=4 21 B8R1.8 CNCc1cccs1 WXDL_WXCD00611199_AN4223_QS0097 [0,0,0,0,0,0|4,0,0]=4 22 B8R1.8 CNCc1cccs1 WXDL_WXCD00611670_AN4223_QS0097 [0,0,0,0,0,0|4,0,0]=4 23 B8R1.8 CNCc1cccs1 WXDL_WXCD00611671_AN4223_QS0097 [0,0,0,0,0,0|4,0,0]=4 24 B8R1.8 CNCc1cccs1 WXDL_WXCD00905463_AN4223_QS0097 [0,0,0,0,0,0|4,0,0]=4 25 B8R1.8 CNCc1cccs1 WXDL_WXCD01004270_AN4223_QS0097 [0,0,0,0,0,0|4,0,0]=4 26 B8R1.8 CNCc1cccs1 WXDL_WXCD02002292_AN4223_QS0097 [0,0,0,0,0,0|4,0,0]=4 27 B8R1.8 CNCc1ccn[nH]1 WXDL_LN01985689_AN4223_QS0363 [0,0,0,0,0,0|4,0,0]=4 28 B8R1.8 CNCc1ccn[nH]1 WXDL_WXCD00610088_AN4223_QS0363 [0,0,0,0,0,0|4,0,0]=4 29 B8R1.8 CNCc1ccn[nH]1 WXDL_WXCD00611001_AN4223_QS0363 [0,0,0,0,0,0|4,0,0]=4 30 B8R1.8 CNCc1ccn[nH]1 WXDL_WXCD00611199_AN4223_QS0363 [0,0,0,0,0,0|4,0,0]=4 31 B8R1.8 CNCc1ccn[nH]1 WXDL_WXCD00611670_AN4223_QS0363 [0,0,0,0,0,0|4,0,0]=4 32 B8R1.8 CNCc1ccn[nH]1 WXDL_WXCD00611671_AN4223_QS0363 [0,0,0,0,0,0|4,0,0]=4 33 B8R1.8 CNCc1ccn[nH]1 WXDL_WXCD00905463_AN4223_QS0363 [0,0,0,0,0,0|4,0,0]=4 34 B8R1.8 CNCc1ccn[nH]1 WXDL_WXCD01004270_AN4223_QS0363 [0,0,0,0,0,0|4,0,0]=4 35 B8R1.8 CNCc1ccn[nH]1 WXDL_WXCD02002292_AN4223_QS0363 [0,0,0,0,0,0|4,0,0]=4 36 B8R1.8 CNCc1ccsc1 WXDL_LN01985689_AN4223_QS0101 [0,0,0,0,0,0|4,0,0]=4 37 B8R1.8 CNCc1ccsc1 WXDL_WXCD00610088_AN4223_QS0101 [0,0,0,0,0,0|4,0,0]=4 38 B8R1.8 CNCc1ccsc1 WXDL_WXCD00611001_AN4223_QS0101 [0,0,0,0,0,0|4,0,0]=4 39 B8R1.8 CNCc1ccsc1 WXDL_WXCD00611199_AN4223_QS0101 [0,0,0,0,0,0|4,0,0]=4 40 B8R1.8 CNCc1ccsc1 WXDL_WXCD00611670_AN4223_QS0101 [0,0,0,0,0,0|4,0,0]=4 41 B8R1.8 CNCc1ccsc1 WXDL_WXCD00611671_AN4223_QS0101 [0,0,0,0,0,0|4,0,0]=4 42 B8R1.8 CNCc1ccsc1 WXDL_WXCD00905463_AN4223_QS0101 [0,0,0,0,0,0|4,0,0]=4 43 B8R1.8 CNCc1ccsc1 WXDL_WXCD01004270_AN4223_QS0101 [0,0,0,0,0,0|4,0,0]=4 44 B8R1.8 CNCc1ccsc1 WXDL_WXCD02002292_AN4223_QS0101 [0,0,0,0,0,0|4,0,0]=4 45 B8R1.8 CNCc1cn[nH]c1 WXDL_LN01985689_AN4223_QS0005 [0,0,0,0,0,0|4,0,0]=4 46 B8R1.8 CNCc1cn[nH]c1 WXDL_WXCD00610088_AN4223_QS0005 [0,0,0,0,0,0|4,0,0]=4 47 B8R1.8 CNCc1cn[nH]c1 WXDL_WXCD00611001_AN4223_QS0005 [0,0,0,0,0,0|4,0,0]=4 48 B8R1.8 CNCc1cn[nH]c1 WXDL_WXCD00611199_AN4223_QS0005 [0,0,0,0,0,0|4,0,0]=4 49 B8R1.8 CNCc1cn[nH]c1 WXDL_WXCD00611670_AN4223_QS0005 [0,0,0,0,0,0|4,0,0]=4 50 B8R1.8 CNCc1cn[nH]c1 WXDL_WXCD00611671_AN4223_QS0005 [0,0,0,0,0,0|4,0,0]=4 51 B8R1.8 CNCc1cn[nH]c1 WXDL_WXCD00905463_AN4223_QS0005 [0,0,0,0,0,0|4,0,0]=4 52 B8R1.8 CNCc1cn[nH]c1 WXDL_WXCD01004270_AN4223_QS0005 [0,0,0,0,0,0|4,0,0]=4 53 B8R1.8 CNCc1cn[nH]c1 WXDL_WXCD02002292_AN4223_QS0005 [0,0,0,0,0,0|4,0,0]=4 54 B8R1.8 CNCc1cnc[nH]1 WXDL_LN01985689_AN4223_QS0332 [0,0,0,0,0,0|2,0,0]=2 55 B8R1.8 CNCc1cnc[nH]1 WXDL_WXCD00610088_AN4223_QS0332 [0,0,0,0,0,0|2,0,0]=2 56 B8R1.8 CNCc1cnc[nH]1 WXDL_WXCD00611001_AN4223_QS0332 [0,0,0,0,0,0|2,0,0]=2 57 B8R1.8 CNCc1cnc[nH]1 WXDL_WXCD00611199_AN4223_QS0332 [0,0,0,0,0,0|2,0,0]=2 58 B8R1.8 CNCc1cnc[nH]1 WXDL_WXCD00611670_AN4223_QS0332 [0,0,0,0,0,0|2,0,0]=2 59 B8R1.8 CNCc1cnc[nH]1 WXDL_WXCD00611671_AN4223_QS0332 [0,0,0,0,0,0|2,0,0]=2 60 B8R1.8 CNCc1cnc[nH]1 WXDL_WXCD00905463_AN4223_QS0332 [0,0,0,0,0,0|2,0,0]=2 61 B8R1.8 CNCc1cnc[nH]1 WXDL_WXCD01004270_AN4223_QS0332 [0,0,0,0,0,0|2,0,0]=2 62 B8R1.8 CNCc1cnc[nH]1 WXDL_WXCD02002292_AN4223_QS0332 [0,0,0,0,0,0|2,0,0]=2 63 B8R1.8 CNCc1cnco1 WXDL_LN01985689_AN4223_QS1170 [0,0,0,0,0,0|3,0,0]=3 64 B8R1.8 CNCc1cnco1 WXDL_WXCD00610088_AN4223_QS1170 [0,0,0,0,0,0|3,0,0]=3 65 B8R1.8 CNCc1cnco1 WXDL_WXCD00611001_AN4223_QS1170 [0,0,0,0,0,0|3,0,0]=3 66 B8R1.8 CNCc1cnco1 WXDL_WXCD00611199_AN4223_QS1170 [0,0,0,0,0,0|3,0,0]=3 67 B8R1.8 CNCc1cnco1 WXDL_WXCD00611670_AN4223_QS1170 [0,0,0,0,0,0|3,0,0]=3 68 B8R1.8 CNCc1cnco1 WXDL_WXCD00611671_AN4223_QS1170 [0,0,0,0,0,0|3,0,0]=3 69 B8R1.8 CNCc1cnco1 WXDL_WXCD00905463_AN4223_QS1170 [0,0,0,0,0,0|3,0,0]=3 70 B8R1.8 CNCc1cnco1 WXDL_WXCD01004270_AN4223_QS1170 [0,0,0,0,0,0|3,0,0]=3 71 B8R1.8 CNCc1cnco1 WXDL_WXCD02002292_AN4223_QS1170 [0,0,0,0,0,0|3,0,0]=3 72 B8R1.8 CNCc1cncs1 WXDL_LN01985689_AN4223_QS0291 [0,0,0,0,0,0|3,0,0]=3 73 B8R1.8 CNCc1cncs1 WXDL_WXCD00610088_AN4223_QS0291 [0,0,0,0,0,0|3,0,0]=3 74 B8R1.8 CNCc1cncs1 WXDL_WXCD00611001_AN4223_QS0291 [0,0,0,0,0,0|3,0,0]=3 75 B8R1.8 CNCc1cncs1 WXDL_WXCD00611199_AN4223_QS0291 [0,0,0,0,0,0|3,0,0]=3 76 B8R1.8 CNCc1cncs1 WXDL_WXCD00611670_AN4223_QS0291 [0,0,0,0,0,0|3,0,0]=3 77 B8R1.8 CNCc1cncs1 WXDL_WXCD00611671_AN4223_QS0291 [0,0,0,0,0,0|3,0,0]=3 78 B8R1.8 CNCc1cncs1 WXDL_WXCD00905463_AN4223_QS0291 [0,0,0,0,0,0|3,0,0]=3 79 B8R1.8 CNCc1cncs1 WXDL_WXCD01004270_AN4223_QS0291 [0,0,0,0,0,0|3,0,0]=3 80 B8R1.8 CNCc1cncs1 WXDL_WXCD02002292_AN4223_QS0291 [0,0,0,0,0,0|3,0,0]=3 81 B8R1.8 CNCc1cocn1 WXDL_LN01985689_AN4223_QS1213 [0,0,0,0,0,0|3,0,1]=4 82 B8R1.8 CNCc1cocn1 WXDL_WXCD00610088_AN4223_QS1213 [0,0,0,0,0,0|3,0,1]=4 83 B8R1.8 CNCc1cocn1 WXDL_WXCD00611001_AN4223_QS1213 [0,0,0,0,0,0|3,0,1]=4 84 B8R1.8 CNCc1cocn1 WXDL_WXCD00611199_AN4223_QS1213 [0,0,0,0,0,0|3,0,1]=4 85 B8R1.8 CNCc1cocn1 WXDL_WXCD00611670_AN4223_QS1213 [0,0,0,0,0,0|3,0,1]=4 86 B8R1.8 CNCc1cocn1 WXDL_WXCD00611671_AN4223_QS1213 [0,0,0,0,0,0|3,0,1]=4 87 B8R1.8 CNCc1cocn1 WXDL_WXCD00905463_AN4223_QS1213 [0,0,0,0,0,0|3,0,1]=4 88 B8R1.8 CNCc1cocn1 WXDL_WXCD01004270_AN4223_QS1213 [0,0,0,0,0,0|3,0,1]=4 89 B8R1.8 CNCc1cocn1 WXDL_WXCD02002292_AN4223_QS1213 [0,0,0,0,0,0|3,0,1]=4 90 B8R1.8 CNCc1cscn1 WXDL_LN01985689_AN4223_QS0435 [0,0,0,0,0,0|3,0,1]=4 91 B8R1.8 CNCc1cscn1 WXDL_WXCD00610088_AN4223_QS0435 [0,0,0,0,0,0|3,0,1]=4 92 B8R1.8 CNCc1cscn1 WXDL_WXCD00611001_AN4223_QS0435 [0,0,0,0,0,0|3,0,1]=4 93 B8R1.8 CNCc1cscn1 WXDL_WXCD00611199_AN4223_QS0435 [0,0,0,0,0,0|3,0,1]=4 94 B8R1.8 CNCc1cscn1 WXDL_WXCD00611670_AN4223_QS0435 [0,0,0,0,0,0|3,0,1]=4 95 B8R1.8 CNCc1cscn1 WXDL_WXCD00611671_AN4223_QS0435 [0,0,0,0,0,0|3,0,1]=4 96 B8R1.8 CNCc1cscn1 WXDL_WXCD00905463_AN4223_QS0435 [0,0,0,0,0,0|3,0,1]=4 97 B8R1.8 CNCc1cscn1 WXDL_WXCD01004270_AN4223_QS0435 [0,0,0,0,0,0|3,0,1]=4 98 B8R1.8 CNCc1cscn1 WXDL_WXCD02002292_AN4223_QS0435 [0,0,0,0,0,0|3,0,1]=4 99 B8R1.8 CNCc1ncc[nH]1 WXDL_LN01985689_AN4223_QS0090 [0,0,0,0,0,0|4,0,0]=4 100 B8R1.8 CNCc1ncc[nH]1 WXDL_WXCD00610088_AN4223_QS0090 [0,0,0,0,0,0|4,0,0]=4 101 B8R1.8 CNCc1ncc[nH]1 WXDL_WXCD00611001_AN4223_QS0090 [0,0,0,0,0,0|4,0,0]=4 102 B8R1.8 CNCc1ncc[nH]1 WXDL_WXCD00611199_AN4223_QS0090 [0,0,0,0,0,0|4,0,0]=4 103 B8R1.8 CNCc1ncc[nH]1 WXDL_WXCD00611670_AN4223_QS0090 [0,0,0,0,0,0|4,0,0]=4 104 B8R1.8 CNCc1ncc[nH]1 WXDL_WXCD00611671_AN4223_QS0090 [0,0,0,0,0,0|4,0,0]=4 105 B8R1.8 CNCc1ncc[nH]1 WXDL_WXCD00905463_AN4223_QS0090 [0,0,0,0,0,0|4,0,0]=4 106 B8R1.8 CNCc1ncc[nH]1 WXDL_WXCD01004270_AN4223_QS0090 [0,0,0,0,0,0|4,0,0]=4 107 B8R1.8 CNCc1ncc[nH]1 WXDL_WXCD02002292_AN4223_QS0090 [0,0,0,0,0,0|4,0,0]=4 108 B9R1.7 CNCc1cc(c[nH]1)Br WXDL_LN01985689_AN4223_QS1573 [0,1,0,0,0,0|3,0,0]=4 109 B9R1.7 CNCc1cc(c[nH]1)Br WXDL_WXCD00610088_AN4223_QS1573 [0,1,0,0,0,0|3,0,0]=4 110 B9R1.7 CNCc1cc(c[nH]1)Br WXDL_WXCD00611001_AN4223_QS1573 [0,1,0,0,0,0|3,0,0]=4 111 B9R1.7 CNCc1cc(c[nH]1)Br WXDL_WXCD00611199_AN4223_QS1573 [0,1,0,0,0,0|3,0,0]=4 112 B9R1.7 CNCc1cc(c[nH]1)Br WXDL_WXCD00611670_AN4223_QS1573 [0,1,0,0,0,0|3,0,0]=4 113 B9R1.7 CNCc1cc(c[nH]1)Br WXDL_WXCD00611671_AN4223_QS1573 [0,1,0,0,0,0|3,0,0]=4 114 B9R1.7 CNCc1cc(c[nH]1)Br WXDL_WXCD00905463_AN4223_QS1573 [0,1,0,0,0,0|3,0,0]=4 115 B9R1.7 CNCc1cc(c[nH]1)Br WXDL_WXCD01004270_AN4223_QS1573 [0,1,0,0,0,0|3,0,0]=4 116 B9R1.7 CNCc1cc(c[nH]1)Br WXDL_WXCD02002292_AN4223_QS1573 [0,1,0,0,0,0|3,0,0]=4 117 B9R1.7 CNCc1cc(c[nH]1)I WXDL_LN01985689_AN4223_QS1506 [0,1,0,0,0,0|3,0,0]=4 118 B9R1.7 CNCc1cc(c[nH]1)I WXDL_WXCD00610088_AN4223_QS1506 [0,1,0,0,0,0|3,0,0]=4 119 B9R1.7 CNCc1cc(c[nH]1)I WXDL_WXCD00611001_AN4223_QS1506 [0,1,0,0,0,0|3,0,0]=4 120 B9R1.7 CNCc1cc(c[nH]1)I WXDL_WXCD00611199_AN4223_QS1506 [0,1,0,0,0,0|3,0,0]=4 121 B9R1.7 CNCc1cc(c[nH]1)I WXDL_WXCD00611670_AN4223_QS1506 [0,1,0,0,0,0|3,0,0]=4 122 B9R1.7 CNCc1cc(c[nH]1)I WXDL_WXCD00611671_AN4223_QS1506 [0,1,0,0,0,0|3,0,0]=4 123 B9R1.7 CNCc1cc(c[nH]1)I WXDL_WXCD00905463_AN4223_QS1506 [0,1,0,0,0,0|3,0,0]=4 124 B9R1.7 CNCc1cc(c[nH]1)I WXDL_WXCD01004270_AN4223_QS1506 [0,1,0,0,0,0|3,0,0]=4 125 B9R1.7 CNCc1cc(c[nH]1)I WXDL_WXCD02002292_AN4223_QS1506 [0,1,0,0,0,0|3,0,0]=4 126 B9R1.7 CNCc1ccc([nH]1)Br WXDL_LN01985689_AN4223_QS1848 [0,1,0,0,0,0|3,0,0]=4 127 B9R1.7 CNCc1ccc([nH]1)Br WXDL_WXCD00610088_AN4223_QS1848 [0,1,0,0,0,0|3,0,0]=4 128 B9R1.7 CNCc1ccc([nH]1)Br WXDL_WXCD00611001_AN4223_QS1848 [0,1,0,0,0,0|3,0,0]=4 129 B9R1.7 CNCc1ccc([nH]1)Br WXDL_WXCD00611199_AN4223_QS1848 [0,1,0,0,0,0|3,0,0]=4 130 B9R1.7 CNCc1ccc([nH]1)Br WXDL_WXCD00611670_AN4223_QS1848 [0,1,0,0,0,0|3,0,0]=4 131 B9R1.7 CNCc1ccc([nH]1)Br WXDL_WXCD00611671_AN4223_QS1848 [0,1,0,0,0,0|3,0,0]=4 132 B9R1.7 CNCc1ccc([nH]1)Br WXDL_WXCD00905463_AN4223_QS1848 [0,1,0,0,0,0|3,0,0]=4 133 B9R1.7 CNCc1ccc([nH]1)Br WXDL_WXCD01004270_AN4223_QS1848 [0,1,0,0,0,0|3,0,0]=4 134 B9R1.7 CNCc1ccc([nH]1)Br WXDL_WXCD02002292_AN4223_QS1848 [0,1,0,0,0,0|3,0,0]=4 135 B9R1.7 CNCc1ccc([nH]1)C WXDL_LN01985689_AN4223_QS0294 [0,1,0,0,0,0|3,0,0]=4 136 B9R1.7 CNCc1ccc([nH]1)C WXDL_WXCD00610088_AN4223_QS0294 [0,1,0,0,0,0|3,0,0]=4 137 B9R1.7 CNCc1ccc([nH]1)C WXDL_WXCD00611001_AN4223_QS0294 [0,1,0,0,0,0|3,0,0]=4 138 B9R1.7 CNCc1ccc([nH]1)C WXDL_WXCD00611199_AN4223_QS0294 [0,1,0,0,0,0|3,0,0]=4 139 B9R1.7 CNCc1ccc([nH]1)C WXDL_WXCD00611670_AN4223_QS0294 [0,1,0,0,0,0|3,0,0]=4 140 B9R1.7 CNCc1ccc([nH]1)C WXDL_WXCD00611671_AN4223_QS0294 [0,1,0,0,0,0|3,0,0]=4 141 B9R1.7 CNCc1ccc([nH]1)C WXDL_WXCD00905463_AN4223_QS0294 [0,1,0,0,0,0|3,0,0]=4 142 B9R1.7 CNCc1ccc([nH]1)C WXDL_WXCD01004270_AN4223_QS0294 [0,1,0,0,0,0|3,0,0]=4 143 B9R1.7 CNCc1ccc([nH]1)C WXDL_WXCD02002292_AN4223_QS0294 [0,1,0,0,0,0|3,0,0]=4 144 B9R1.7 CNCc1cnc([nH]1)C WXDL_LN01985689_AN4223_QS1791 [0,1,0,0,0,0|2,0,0]=3 145 B9R1.7 CNCc1cnc([nH]1)C WXDL_WXCD00610088_AN4223_QS1791 [0,1,0,0,0,0|2,0,0]=3 146 B9R1.7 CNCc1cnc([nH]1)C WXDL_WXCD00611001_AN4223_QS1791 [0,1,0,0,0,0|2,0,0]=3 147 B9R1.7 CNCc1cnc([nH]1)C WXDL_WXCD00611199_AN4223_QS1791 [0,1,0,0,0,0|2,0,0]=3 148 B9R1.7 CNCc1cnc([nH]1)C WXDL_WXCD00611670_AN4223_QS1791 [0,1,0,0,0,0|2,0,0]=3 149 B9R1.7 CNCc1cnc([nH]1)C WXDL_WXCD00611671_AN4223_QS1791 [0,1,0,0,0,0|2,0,0]=3 150 B9R1.7 CNCc1cnc([nH]1)C WXDL_WXCD00905463_AN4223_QS1791 [0,1,0,0,0,0|2,0,0]=3 151 B9R1.7 CNCc1cnc([nH]1)C WXDL_WXCD01004270_AN4223_QS1791 [0,1,0,0,0,0|2,0,0]=3 152 B9R1.7 CNCc1cnc([nH]1)C WXDL_WXCD02002292_AN4223_QS1791 [0,1,0,0,0,0|2,0,0]=3 153 B9R1.7 CNCc1cnc(s1)Br WXDL_LN01985689_AN4223_QS0934 [0,1,0,0,0,0|3,0,0]=4 154 B9R1.7 CNCc1cnc(s1)Br WXDL_WXCD00610088_AN4223_QS0934 [0,1,0,0,0,0|3,0,0]=4 155 B9R1.7 CNCc1cnc(s1)Br WXDL_WXCD00611001_AN4223_QS0934 [0,1,0,0,0,0|3,0,0]=4 156 B9R1.7 CNCc1cnc(s1)Br WXDL_WXCD00611199_AN4223_QS0934 [0,1,0,0,0,0|3,0,0]=4 157 B9R1.7 CNCc1cnc(s1)Br WXDL_WXCD00611670_AN4223_QS0934 [0,1,0,0,0,0|3,0,0]=4 158 B9R1.7 CNCc1cnc(s1)Br WXDL_WXCD00611671_AN4223_QS0934 [0,1,0,0,0,0|3,0,0]=4 159 B9R1.7 CNCc1cnc(s1)Br WXDL_WXCD00905463_AN4223_QS0934 [0,1,0,0,0,0|3,0,0]=4 160 B9R1.7 CNCc1cnc(s1)Br WXDL_WXCD01004270_AN4223_QS0934 [0,1,0,0,0,0|3,0,0]=4 161 B9R1.7 CNCc1cnc(s1)Br WXDL_WXCD02002292_AN4223_QS0934 [0,1,0,0,0,0|3,0,0]=4 162 B9R1.7 CNCc1cnc(s1)C WXDL_LN01985689_AN4223_QS0259 [0,1,0,0,0,0|3,0,0]=4 163 B9R1.7 CNCc1cnc(s1)C WXDL_WXCD00610088_AN4223_QS0259 [0,1,0,0,0,0|3,0,0]=4 164 B9R1.7 CNCc1cnc(s1)C WXDL_WXCD00611001_AN4223_QS0259 [0,1,0,0,0,0|3,0,0]=4 165 B9R1.7 CNCc1cnc(s1)C WXDL_WXCD00611199_AN4223_QS0259 [0,1,0,0,0,0|3,0,0]=4 166 B9R1.7 CNCc1cnc(s1)C WXDL_WXCD00611670_AN4223_QS0259 [0,1,0,0,0,0|3,0,0]=4 167 B9R1.7 CNCc1cnc(s1)C WXDL_WXCD00611671_AN4223_QS0259 [0,1,0,0,0,0|3,0,0]=4 168 B9R1.7 CNCc1cnc(s1)C WXDL_WXCD00905463_AN4223_QS0259 [0,1,0,0,0,0|3,0,0]=4 169 B9R1.7 CNCc1cnc(s1)C WXDL_WXCD01004270_AN4223_QS0259 [0,1,0,0,0,0|3,0,0]=4 170 B9R1.7 CNCc1cnc(s1)C WXDL_WXCD02002292_AN4223_QS0259 [0,1,0,0,0,0|3,0,0]=4 171 B9R1.7 CNCc1cnc(s1)Cl WXDL_LN01985689_AN4223_QS0276 [0,1,0,0,0,0|3,0,0]=4 172 B9R1.7 CNCc1cnc(s1)Cl WXDL_WXCD00610088_AN4223_QS0276 [0,1,0,0,0,0|3,0,0]=4 173 B9R1.7 CNCc1cnc(s1)Cl WXDL_WXCD00611001_AN4223_QS0276 [0,1,0,0,0,0|3,0,0]=4 174 B9R1.7 CNCc1cnc(s1)Cl WXDL_WXCD00611199_AN4223_QS0276 [0,1,0,0,0,0|3,0,0]=4 175 B9R1.7 CNCc1cnc(s1)Cl WXDL_WXCD00611670_AN4223_QS0276 [0,1,0,0,0,0|3,0,0]=4 176 B9R1.7 CNCc1cnc(s1)Cl WXDL_WXCD00611671_AN4223_QS0276 [0,1,0,0,0,0|3,0,0]=4 177 B9R1.7 CNCc1cnc(s1)Cl WXDL_WXCD00905463_AN4223_QS0276 [0,1,0,0,0,0|3,0,0]=4 178 B9R1.7 CNCc1cnc(s1)Cl WXDL_WXCD01004270_AN4223_QS0276 [0,1,0,0,0,0|3,0,0]=4 179 B9R1.7 CNCc1cnc(s1)Cl WXDL_WXCD02002292_AN4223_QS0276 [0,1,0,0,0,0|3,0,0]=4 180 B9R1.7 CNCc1nnc([nH]1)C WXDL_LN01985689_AN4223_QS5109 [0,1,0,0,0,0|3,0,0]=4 181 B9R1.7 CNCc1nnc([nH]1)C WXDL_WXCD00610088_AN4223_QS5109 [0,1,0,0,0,0|3,0,0]=4 182 B9R1.7 CNCc1nnc([nH]1)C WXDL_WXCD00611001_AN4223_QS5109 [0,1,0,0,0,0|3,0,0]=4 183 B9R1.7 CNCc1nnc([nH]1)C WXDL_WXCD00611199_AN4223_QS5109 [0,1,0,0,0,0|3,0,0]=4 184 B9R1.7 CNCc1nnc([nH]1)C WXDL_WXCD00611670_AN4223_QS5109 [0,1,0,0,0,0|3,0,0]=4 185 B9R1.7 CNCc1nnc([nH]1)C WXDL_WXCD00611671_AN4223_QS5109 [0,1,0,0,0,0|3,0,0]=4 186 B9R1.7 CNCc1nnc([nH]1)C WXDL_WXCD00905463_AN4223_QS5109 [0,1,0,0,0,0|3,0,0]=4 187 B9R1.7 CNCc1nnc([nH]1)C WXDL_WXCD01004270_AN4223_QS5109 [0,1,0,0,0,0|3,0,0]=4 188 B9R1.7 CNCc1nnc([nH]1)C WXDL_WXCD02002292_AN4223_QS5109 [0,1,0,0,0,0|3,0,0]=4 189 B9R1.33 CNCc1[nH]cnc1C WXDL_LN01985689_AN4223_QS0196 [0,1,0,0,0,0|2,0,0]=3 190 B9R1.33 CNCc1[nH]cnc1C WXDL_WXCD00610088_AN4223_QS0196 [0,1,0,0,0,0|2,0,0]=3 191 B9R1.33 CNCc1[nH]cnc1C WXDL_WXCD00611001_AN4223_QS0196 [0,1,0,0,0,0|2,0,0]=3 192 B9R1.33 CNCc1[nH]cnc1C WXDL_WXCD00611199_AN4223_QS0196 [0,1,0,0,0,0|2,0,0]=3 193 B9R1.33 CNCc1[nH]cnc1C WXDL_WXCD00611670_AN4223_QS0196 [0,1,0,0,0,0|2,0,0]=3 194 B9R1.33 CNCc1[nH]cnc1C WXDL_WXCD00611671_AN4223_QS0196 [0,1,0,0,0,0|2,0,0]=3 195 B9R1.33 CNCc1[nH]cnc1C WXDL_WXCD00905463_AN4223_QS0196 [0,1,0,0,0,0|2,0,0]=3 196 B9R1.33 CNCc1[nH]cnc1C WXDL_WXCD01004270_AN4223_QS0196 [0,1,0,0,0,0|2,0,0]=3 197 B9R1.33 CNCc1[nH]cnc1C WXDL_WXCD02002292_AN4223_QS0196 [0,1,0,0,0,0|2,0,0]=3 198 B9R1.33 CNCc1cccn1C WXDL_LN01985689_AN4223_QS0015 [0,1,0,0,0,0|3,0,0]=4 199 B9R1.33 CNCc1cccn1C WXDL_WXCD00610088_AN4223_QS0015 [0,1,0,0,0,0|3,0,0]=4 200 B9R1.33 CNCc1cccn1C WXDL_WXCD00611001_AN4223_QS0015 [0,1,0,0,0,0|3,0,0]=4 201 B9R1.33 CNCc1cccn1C WXDL_WXCD00611199_AN4223_QS0015 [0,1,0,0,0,0|3,0,0]=4 202 B9R1.33 CNCc1cccn1C WXDL_WXCD00611670_AN4223_QS0015 [0,1,0,0,0,0|3,0,0]=4 203 B9R1.33 CNCc1cccn1C WXDL_WXCD00611671_AN4223_QS0015 [0,1,0,0,0,0|3,0,0]=4 204 B9R1.33 CNCc1cccn1C WXDL_WXCD00905463_AN4223_QS0015 [0,1,0,0,0,0|3,0,0]=4 205 B9R1.33 CNCc1cccn1C WXDL_WXCD01004270_AN4223_QS0015 [0,1,0,0,0,0|3,0,0]=4 206 B9R1.33 CNCc1cccn1C WXDL_WXCD02002292_AN4223_QS0015 [0,1,0,0,0,0|3,0,0]=4 207 B9R1.33 CNCc1cncn1C WXDL_LN01985689_AN4223_QS0160 [0,1,0,0,0,0|2,0,0]=3 208 B9R1.33 CNCc1cncn1C WXDL_WXCD00610088_AN4223_QS0160 [0,1,0,0,0,0|2,0,0]=3 209 B9R1.33 CNCc1cncn1C WXDL_WXCD00611001_AN4223_QS0160 [0,1,0,0,0,0|2,0,0]=3 210 B9R1.33 CNCc1cncn1C WXDL_WXCD00611199_AN4223_QS0160 [0,1,0,0,0,0|2,0,0]=3 211 B9R1.33 CNCc1cncn1C WXDL_WXCD00611670_AN4223_QS0160 [0,1,0,0,0,0|2,0,0]=3 212 B9R1.33 CNCc1cncn1C WXDL_WXCD00611671_AN4223_QS0160 [0,1,0,0,0,0|2,0,0]=3 213 B9R1.33 CNCc1cncn1C WXDL_WXCD00905463_AN4223_QS0160 [0,1,0,0,0,0|2,0,0]=3 214 B9R1.33 CNCc1cncn1C WXDL_WXCD01004270_AN4223_QS0160 [0,1,0,0,0,0|2,0,0]=3 215 B9R1.33 CNCc1cncn1C WXDL_WXCD02002292_AN4223_QS0160 [0,1,0,0,0,0|2,0,0]=3 216 B9R1.33 CNCc1scnc1C WXDL_LN01985689_AN4223_QS0250 [0,1,0,0,0,0|3,0,0]=4 217 B9R1.33 CNCc1scnc1C WXDL_WXCD00610088_AN4223_QS0250 [0,1,0,0,0,0|3,0,0]=4 218 B9R1.33 CNCc1scnc1C WXDL_WXCD00611001_AN4223_QS0250 [0,1,0,0,0,0|3,0,0]=4 219 B9R1.33 CNCc1scnc1C WXDL_WXCD00611199_AN4223_QS0250 [0,1,0,0,0,0|3,0,0]=4 220 B9R1.33 CNCc1scnc1C WXDL_WXCD00611670_AN4223_QS0250 [0,1,0,0,0,0|3,0,0]=4 221 B9R1.33 CNCc1scnc1C WXDL_WXCD00611671_AN4223_QS0250 [0,1,0,0,0,0|3,0,0]=4 222 B9R1.33 CNCc1scnc1C WXDL_WXCD00905463_AN4223_QS0250 [0,1,0,0,0,0|3,0,0]=4 223 B9R1.33 CNCc1scnc1C WXDL_WXCD01004270_AN4223_QS0250 [0,1,0,0,0,0|3,0,0]=4 224 B9R1.33 CNCc1scnc1C WXDL_WXCD02002292_AN4223_QS0250 [0,1,0,0,0,0|3,0,0]=4 225 B9R1.33 CNCc1scnc1Cl WXDL_LN01985689_AN4223_QS0470 [0,1,0,0,0,0|3,0,0]=4 226 B9R1.33 CNCc1scnc1Cl WXDL_WXCD00610088_AN4223_QS0470 [0,1,0,0,0,0|3,0,0]=4 227 B9R1.33 CNCc1scnc1Cl WXDL_WXCD00611001_AN4223_QS0470 [0,1,0,0,0,0|3,0,0]=4 228 B9R1.33 CNCc1scnc1Cl WXDL_WXCD00611199_AN4223_QS0470 [0,1,0,0,0,0|3,0,0]=4 229 B9R1.33 CNCc1scnc1Cl WXDL_WXCD00611670_AN4223_QS0470 [0,1,0,0,0,0|3,0,0]=4 230 B9R1.33 CNCc1scnc1Cl WXDL_WXCD00611671_AN4223_QS0470 [0,1,0,0,0,0|3,0,0]=4 231 B9R1.33 CNCc1scnc1Cl WXDL_WXCD00905463_AN4223_QS0470 [0,1,0,0,0,0|3,0,0]=4 232 B9R1.33 CNCc1scnc1Cl WXDL_WXCD01004270_AN4223_QS0470 [0,1,0,0,0,0|3,0,0]=4 233 B9R1.33 CNCc1scnc1Cl WXDL_WXCD02002292_AN4223_QS0470 [0,1,0,0,0,0|3,0,0]=4 234 B9R1.8 CNCc1cccnc1 WXDL_LN01985689_AN4223_QS0106 [0,0,0,0,0,1|3,0,0]=4 235 B9R1.8 CNCc1cccnc1 WXDL_WXCD00610088_AN4223_QS0106 [0,0,0,0,0,1|3,0,0]=4 236 B9R1.8 CNCc1cccnc1 WXDL_WXCD00611001_AN4223_QS0106 [0,0,0,0,0,1|3,0,0]=4 237 B9R1.8 CNCc1cccnc1 WXDL_WXCD00611199_AN4223_QS0106 [0,0,0,0,0,1|3,0,0]=4 238 B9R1.8 CNCc1cccnc1 WXDL_WXCD00611670_AN4223_QS0106 [0,0,0,0,0,1|3,0,0]=4 239 B9R1.8 CNCc1cccnc1 WXDL_WXCD00611671_AN4223_QS0106 [0,0,0,0,0,1|3,0,0]=4 240 B9R1.8 CNCc1cccnc1 WXDL_WXCD00905463_AN4223_QS0106 [0,0,0,0,0,1|3,0,0]=4 241 B9R1.8 CNCc1cccnc1 WXDL_WXCD01004270_AN4223_QS0106 [0,0,0,0,0,1|3,0,0]=4 242 B9R1.8 CNCc1cccnc1 WXDL_WXCD02002292_AN4223_QS0106 [0,0,0,0,0,1|3,0,0]=4 243 B9R1.8 CNCc1ccncc1 WXDL_LN01985689_AN4223_QS0107 [0,0,0,0,0,1|3,0,0]=4 244 B9R1.8 CNCc1ccncc1 WXDL_WXCD00610088_AN4223_QS0107 [0,0,0,0,0,1|3,0,0]=4 245 B9R1.8 CNCc1ccncc1 WXDL_WXCD00611001_AN4223_QS0107 [0,0,0,0,0,1|3,0,0]=4 246 B9R1.8 CNCc1ccncc1 WXDL_WXCD00611199_AN4223_QS0107 [0,0,0,0,0,1|3,0,0]=4 247 B9R1.8 CNCc1ccncc1 WXDL_WXCD00611670_AN4223_QS0107 [0,0,0,0,0,1|3,0,0]=4 248 B9R1.8 CNCc1ccncc1 WXDL_WXCD00611671_AN4223_QS0107 [0,0,0,0,0,1|3,0,0]=4 249 B9R1.8 CNCc1ccncc1 WXDL_WXCD00905463_AN4223_QS0107 [0,0,0,0,0,1|3,0,0]=4 250 B9R1.8 CNCc1ccncc1 WXDL_WXCD01004270_AN4223_QS0107 [0,0,0,0,0,1|3,0,0]=4 251 B9R1.8 CNCc1ccncc1 WXDL_WXCD02002292_AN4223_QS0107 [0,0,0,0,0,1|3,0,0]=4 252 B9R1.8 CNCc1cnccn1 WXDL_LN01985689_AN4223_QS0327 [0,0,0,0,0,1|2,0,1]=4 253 B9R1.8 CNCc1cnccn1 WXDL_WXCD00610088_AN4223_QS0327 [0,0,0,0,0,1|2,0,1]=4 254 B9R1.8 CNCc1cnccn1 WXDL_WXCD00611001_AN4223_QS0327 [0,0,0,0,0,1|2,0,1]=4 255 B9R1.8 CNCc1cnccn1 WXDL_WXCD00611199_AN4223_QS0327 [0,0,0,0,0,1|2,0,1]=4 256 B9R1.8 CNCc1cnccn1 WXDL_WXCD00611670_AN4223_QS0327 [0,0,0,0,0,1|2,0,1]=4 257 B9R1.8 CNCc1cnccn1 WXDL_WXCD00611671_AN4223_QS0327 [0,0,0,0,0,1|2,0,1]=4 258 B9R1.8 CNCc1cnccn1 WXDL_WXCD00905463_AN4223_QS0327 [0,0,0,0,0,1|2,0,1]=4 259 B9R1.8 CNCc1cnccn1 WXDL_WXCD01004270_AN4223_QS0327 [0,0,0,0,0,1|2,0,1]=4 260 B9R1.8 CNCc1cnccn1 WXDL_WXCD02002292_AN4223_QS0327 [0,0,0,0,0,1|2,0,1]=4 261 B9R1.8 CNCc1cncnc1 WXDL_LN01985689_AN4223_QS0450 [0,0,0,0,0,1|2,0,1]=4 262 B9R1.8 CNCc1cncnc1 WXDL_WXCD00610088_AN4223_QS0450 [0,0,0,0,0,1|2,0,1]=4 263 B9R1.8 CNCc1cncnc1 WXDL_WXCD00611001_AN4223_QS0450 [0,0,0,0,0,1|2,0,1]=4 264 B9R1.8 CNCc1cncnc1 WXDL_WXCD00611199_AN4223_QS0450 [0,0,0,0,0,1|2,0,1]=4 265 B9R1.8 CNCc1cncnc1 WXDL_WXCD00611670_AN4223_QS0450 [0,0,0,0,0,1|2,0,1]=4 266 B9R1.8 CNCc1cncnc1 WXDL_WXCD00611671_AN4223_QS0450 [0,0,0,0,0,1|2,0,1]=4 267 B9R1.8 CNCc1cncnc1 WXDL_WXCD00905463_AN4223_QS0450 [0,0,0,0,0,1|2,0,1]=4 268 B9R1.8 CNCc1cncnc1 WXDL_WXCD01004270_AN4223_QS0450 [0,0,0,0,0,1|2,0,1]=4 269 B9R1.8 CNCc1cncnc1 WXDL_WXCD02002292_AN4223_QS0450 [0,0,0,0,0,1|2,0,1]=4