0 B12R2.44 CNc1cc2ncnn2cn1 WXDL_LN01985689_AN4223_LP3351 [0,1,0,0,0,0|3,0,0]=4 1 B12R2.44 CNc1cc2ncnn2cn1 WXDL_WXCD00610088_AN4223_LP3351 [0,1,0,0,0,0|3,0,0]=4 2 B12R2.44 CNc1cc2ncnn2cn1 WXDL_WXCD00611001_AN4223_LP3351 [0,1,0,0,0,0|3,0,0]=4 3 B12R2.44 CNc1cc2ncnn2cn1 WXDL_WXCD00611199_AN4223_LP3351 [0,1,0,0,0,0|3,0,0]=4 4 B12R2.44 CNc1cc2ncnn2cn1 WXDL_WXCD00611670_AN4223_LP3351 [0,1,0,0,0,0|3,0,0]=4 5 B12R2.44 CNc1cc2ncnn2cn1 WXDL_WXCD00611671_AN4223_LP3351 [0,1,0,0,0,0|3,0,0]=4 6 B12R2.44 CNc1cc2ncnn2cn1 WXDL_WXCD00905463_AN4223_LP3351 [0,1,0,0,0,0|3,0,0]=4 7 B12R2.44 CNc1cc2ncnn2cn1 WXDL_WXCD01004270_AN4223_LP3351 [0,1,0,0,0,0|3,0,0]=4 8 B12R2.44 CNc1cc2ncnn2cn1 WXDL_WXCD02002292_AN4223_LP3351 [0,1,0,0,0,0|3,0,0]=4 9 B12R2.44 CNc1ccn2nccc2n1 WXDL_LN01985689_AN4223_LP3345 [0,1,0,0,0,0|3,0,0]=4 10 B12R2.44 CNc1ccn2nccc2n1 WXDL_WXCD00610088_AN4223_LP3345 [0,1,0,0,0,0|3,0,0]=4 11 B12R2.44 CNc1ccn2nccc2n1 WXDL_WXCD00611001_AN4223_LP3345 [0,1,0,0,0,0|3,0,0]=4 12 B12R2.44 CNc1ccn2nccc2n1 WXDL_WXCD00611199_AN4223_LP3345 [0,1,0,0,0,0|3,0,0]=4 13 B12R2.44 CNc1ccn2nccc2n1 WXDL_WXCD00611670_AN4223_LP3345 [0,1,0,0,0,0|3,0,0]=4 14 B12R2.44 CNc1ccn2nccc2n1 WXDL_WXCD00611671_AN4223_LP3345 [0,1,0,0,0,0|3,0,0]=4 15 B12R2.44 CNc1ccn2nccc2n1 WXDL_WXCD00905463_AN4223_LP3345 [0,1,0,0,0,0|3,0,0]=4 16 B12R2.44 CNc1ccn2nccc2n1 WXDL_WXCD01004270_AN4223_LP3345 [0,1,0,0,0,0|3,0,0]=4 17 B12R2.44 CNc1ccn2nccc2n1 WXDL_WXCD02002292_AN4223_LP3345 [0,1,0,0,0,0|3,0,0]=4 18 B12R2.44 CNc1ncc2[nH]ccc2n1 WXDL_LN01985689_AN4223_LP0228 [0,1,0,0,0,0|1,0,1]=3 19 B12R2.44 CNc1ncc2[nH]ccc2n1 WXDL_WXCD00610088_AN4223_LP0228 [0,1,0,0,0,0|1,0,1]=3 20 B12R2.44 CNc1ncc2[nH]ccc2n1 WXDL_WXCD00611001_AN4223_LP0228 [0,1,0,0,0,0|1,0,1]=3 21 B12R2.44 CNc1ncc2[nH]ccc2n1 WXDL_WXCD00611199_AN4223_LP0228 [0,1,0,0,0,0|1,0,1]=3 22 B12R2.44 CNc1ncc2[nH]ccc2n1 WXDL_WXCD00611670_AN4223_LP0228 [0,1,0,0,0,0|1,0,1]=3 23 B12R2.44 CNc1ncc2[nH]ccc2n1 WXDL_WXCD00611671_AN4223_LP0228 [0,1,0,0,0,0|1,0,1]=3 24 B12R2.44 CNc1ncc2[nH]ccc2n1 WXDL_WXCD00905463_AN4223_LP0228 [0,1,0,0,0,0|1,0,1]=3 25 B12R2.44 CNc1ncc2[nH]ccc2n1 WXDL_WXCD01004270_AN4223_LP0228 [0,1,0,0,0,0|1,0,1]=3 26 B12R2.44 CNc1ncc2[nH]ccc2n1 WXDL_WXCD02002292_AN4223_LP0228 [0,1,0,0,0,0|1,0,1]=3 27 B12R2.44 CNc1ncc2[nH]ncc2n1 WXDL_LN01985689_AN4223_PY0749 [0,1,0,0,0,0|2,0,1]=4 28 B12R2.44 CNc1ncc2[nH]ncc2n1 WXDL_WXCD00610088_AN4223_PY0749 [0,1,0,0,0,0|2,0,1]=4 29 B12R2.44 CNc1ncc2[nH]ncc2n1 WXDL_WXCD00611001_AN4223_PY0749 [0,1,0,0,0,0|2,0,1]=4 30 B12R2.44 CNc1ncc2[nH]ncc2n1 WXDL_WXCD00611199_AN4223_PY0749 [0,1,0,0,0,0|2,0,1]=4 31 B12R2.44 CNc1ncc2[nH]ncc2n1 WXDL_WXCD00611670_AN4223_PY0749 [0,1,0,0,0,0|2,0,1]=4 32 B12R2.44 CNc1ncc2[nH]ncc2n1 WXDL_WXCD00611671_AN4223_PY0749 [0,1,0,0,0,0|2,0,1]=4 33 B12R2.44 CNc1ncc2[nH]ncc2n1 WXDL_WXCD00905463_AN4223_PY0749 [0,1,0,0,0,0|2,0,1]=4 34 B12R2.44 CNc1ncc2[nH]ncc2n1 WXDL_WXCD01004270_AN4223_PY0749 [0,1,0,0,0,0|2,0,1]=4 35 B12R2.44 CNc1ncc2[nH]ncc2n1 WXDL_WXCD02002292_AN4223_PY0749 [0,1,0,0,0,0|2,0,1]=4 36 B12R2.44 CNc1ncc2ccsc2n1 WXDL_LN01985689_AN4223_LP0600 [0,1,0,0,0,0|3,0,0]=4 37 B12R2.44 CNc1ncc2ccsc2n1 WXDL_WXCD00610088_AN4223_LP0600 [0,1,0,0,0,0|3,0,0]=4 38 B12R2.44 CNc1ncc2ccsc2n1 WXDL_WXCD00611001_AN4223_LP0600 [0,1,0,0,0,0|3,0,0]=4 39 B12R2.44 CNc1ncc2ccsc2n1 WXDL_WXCD00611199_AN4223_LP0600 [0,1,0,0,0,0|3,0,0]=4 40 B12R2.44 CNc1ncc2ccsc2n1 WXDL_WXCD00611670_AN4223_LP0600 [0,1,0,0,0,0|3,0,0]=4 41 B12R2.44 CNc1ncc2ccsc2n1 WXDL_WXCD00611671_AN4223_LP0600 [0,1,0,0,0,0|3,0,0]=4 42 B12R2.44 CNc1ncc2ccsc2n1 WXDL_WXCD00905463_AN4223_LP0600 [0,1,0,0,0,0|3,0,0]=4 43 B12R2.44 CNc1ncc2ccsc2n1 WXDL_WXCD01004270_AN4223_LP0600 [0,1,0,0,0,0|3,0,0]=4 44 B12R2.44 CNc1ncc2ccsc2n1 WXDL_WXCD02002292_AN4223_LP0600 [0,1,0,0,0,0|3,0,0]=4 45 B12R2.44 CNc1ncc2sccc2n1 WXDL_LN01985689_AN4223_LP0123 [0,1,0,0,0,0|2,0,0]=3 46 B12R2.44 CNc1ncc2sccc2n1 WXDL_WXCD00610088_AN4223_LP0123 [0,1,0,0,0,0|2,0,0]=3 47 B12R2.44 CNc1ncc2sccc2n1 WXDL_WXCD00611001_AN4223_LP0123 [0,1,0,0,0,0|2,0,0]=3 48 B12R2.44 CNc1ncc2sccc2n1 WXDL_WXCD00611199_AN4223_LP0123 [0,1,0,0,0,0|2,0,0]=3 49 B12R2.44 CNc1ncc2sccc2n1 WXDL_WXCD00611670_AN4223_LP0123 [0,1,0,0,0,0|2,0,0]=3 50 B12R2.44 CNc1ncc2sccc2n1 WXDL_WXCD00611671_AN4223_LP0123 [0,1,0,0,0,0|2,0,0]=3 51 B12R2.44 CNc1ncc2sccc2n1 WXDL_WXCD00905463_AN4223_LP0123 [0,1,0,0,0,0|2,0,0]=3 52 B12R2.44 CNc1ncc2sccc2n1 WXDL_WXCD01004270_AN4223_LP0123 [0,1,0,0,0,0|2,0,0]=3 53 B12R2.44 CNc1ncc2sccc2n1 WXDL_WXCD02002292_AN4223_LP0123 [0,1,0,0,0,0|2,0,0]=3 54 B13R2.57 CNc1ncc2ccccc2n1 WXDL_LN01985689_AN4223_LP0064 [0,1,0,0,0,1|2,0,0]=4 55 B13R2.57 CNc1ncc2ccccc2n1 WXDL_WXCD00610088_AN4223_LP0064 [0,1,0,0,0,1|2,0,0]=4 56 B13R2.57 CNc1ncc2ccccc2n1 WXDL_WXCD00611001_AN4223_LP0064 [0,1,0,0,0,1|2,0,0]=4 57 B13R2.57 CNc1ncc2ccccc2n1 WXDL_WXCD00611199_AN4223_LP0064 [0,1,0,0,0,1|2,0,0]=4 58 B13R2.57 CNc1ncc2ccccc2n1 WXDL_WXCD00611670_AN4223_LP0064 [0,1,0,0,0,1|2,0,0]=4 59 B13R2.57 CNc1ncc2ccccc2n1 WXDL_WXCD00611671_AN4223_LP0064 [0,1,0,0,0,1|2,0,0]=4 60 B13R2.57 CNc1ncc2ccccc2n1 WXDL_WXCD00905463_AN4223_LP0064 [0,1,0,0,0,1|2,0,0]=4 61 B13R2.57 CNc1ncc2ccccc2n1 WXDL_WXCD01004270_AN4223_LP0064 [0,1,0,0,0,1|2,0,0]=4 62 B13R2.57 CNc1ncc2ccccc2n1 WXDL_WXCD02002292_AN4223_LP0064 [0,1,0,0,0,1|2,0,0]=4 63 B13R2.449 CNCc1cc2cc[nH]c2cn1 WXDL_LN01985689_AN4223_QS1599 [0,2,0,0,0,0|1,0,1]=4 64 B13R2.449 CNCc1cc2cc[nH]c2cn1 WXDL_WXCD00610088_AN4223_QS1599 [0,2,0,0,0,0|1,0,1]=4 65 B13R2.449 CNCc1cc2cc[nH]c2cn1 WXDL_WXCD00611001_AN4223_QS1599 [0,2,0,0,0,0|1,0,1]=4 66 B13R2.449 CNCc1cc2cc[nH]c2cn1 WXDL_WXCD00611199_AN4223_QS1599 [0,2,0,0,0,0|1,0,1]=4 67 B13R2.449 CNCc1cc2cc[nH]c2cn1 WXDL_WXCD00611670_AN4223_QS1599 [0,2,0,0,0,0|1,0,1]=4 68 B13R2.449 CNCc1cc2cc[nH]c2cn1 WXDL_WXCD00611671_AN4223_QS1599 [0,2,0,0,0,0|1,0,1]=4 69 B13R2.449 CNCc1cc2cc[nH]c2cn1 WXDL_WXCD00905463_AN4223_QS1599 [0,2,0,0,0,0|1,0,1]=4 70 B13R2.449 CNCc1cc2cc[nH]c2cn1 WXDL_WXCD01004270_AN4223_QS1599 [0,2,0,0,0,0|1,0,1]=4 71 B13R2.449 CNCc1cc2cc[nH]c2cn1 WXDL_WXCD02002292_AN4223_QS1599 [0,2,0,0,0,0|1,0,1]=4 72 B13R2.449 CNCc1cc2ccoc2cn1 WXDL_LN01985689_AN4223_QS1813 [0,2,0,0,0,0|2,0,0]=4 73 B13R2.449 CNCc1cc2ccoc2cn1 WXDL_WXCD00610088_AN4223_QS1813 [0,2,0,0,0,0|2,0,0]=4 74 B13R2.449 CNCc1cc2ccoc2cn1 WXDL_WXCD00611001_AN4223_QS1813 [0,2,0,0,0,0|2,0,0]=4 75 B13R2.449 CNCc1cc2ccoc2cn1 WXDL_WXCD00611199_AN4223_QS1813 [0,2,0,0,0,0|2,0,0]=4 76 B13R2.449 CNCc1cc2ccoc2cn1 WXDL_WXCD00611670_AN4223_QS1813 [0,2,0,0,0,0|2,0,0]=4 77 B13R2.449 CNCc1cc2ccoc2cn1 WXDL_WXCD00611671_AN4223_QS1813 [0,2,0,0,0,0|2,0,0]=4 78 B13R2.449 CNCc1cc2ccoc2cn1 WXDL_WXCD00905463_AN4223_QS1813 [0,2,0,0,0,0|2,0,0]=4 79 B13R2.449 CNCc1cc2ccoc2cn1 WXDL_WXCD01004270_AN4223_QS1813 [0,2,0,0,0,0|2,0,0]=4 80 B13R2.449 CNCc1cc2ccoc2cn1 WXDL_WXCD02002292_AN4223_QS1813 [0,2,0,0,0,0|2,0,0]=4 81 B13R2.669 CNc1ncc2[nH]cc(c2n1)I WXDL_LN01985689_AN4223_LR0017 [0,2,0,0,0,0|1,0,1]=4 82 B13R2.669 CNc1ncc2[nH]cc(c2n1)I WXDL_WXCD00610088_AN4223_LR0017 [0,2,0,0,0,0|1,0,1]=4 83 B13R2.669 CNc1ncc2[nH]cc(c2n1)I WXDL_WXCD00611001_AN4223_LR0017 [0,2,0,0,0,0|1,0,1]=4 84 B13R2.669 CNc1ncc2[nH]cc(c2n1)I WXDL_WXCD00611199_AN4223_LR0017 [0,2,0,0,0,0|1,0,1]=4 85 B13R2.669 CNc1ncc2[nH]cc(c2n1)I WXDL_WXCD00611670_AN4223_LR0017 [0,2,0,0,0,0|1,0,1]=4 86 B13R2.669 CNc1ncc2[nH]cc(c2n1)I WXDL_WXCD00611671_AN4223_LR0017 [0,2,0,0,0,0|1,0,1]=4 87 B13R2.669 CNc1ncc2[nH]cc(c2n1)I WXDL_WXCD00905463_AN4223_LR0017 [0,2,0,0,0,0|1,0,1]=4 88 B13R2.669 CNc1ncc2[nH]cc(c2n1)I WXDL_WXCD01004270_AN4223_LR0017 [0,2,0,0,0,0|1,0,1]=4 89 B13R2.669 CNc1ncc2[nH]cc(c2n1)I WXDL_WXCD02002292_AN4223_LR0017 [0,2,0,0,0,0|1,0,1]=4 90 B13R2.2130 CNc1ncc2c(n1)ccn2C WXDL_LN01985689_AN4223_LP1483 [0,2,0,0,0,0|1,0,1]=4 91 B13R2.2130 CNc1ncc2c(n1)ccn2C WXDL_WXCD00610088_AN4223_LP1483 [0,2,0,0,0,0|1,0,1]=4 92 B13R2.2130 CNc1ncc2c(n1)ccn2C WXDL_WXCD00611001_AN4223_LP1483 [0,2,0,0,0,0|1,0,1]=4 93 B13R2.2130 CNc1ncc2c(n1)ccn2C WXDL_WXCD00611199_AN4223_LP1483 [0,2,0,0,0,0|1,0,1]=4 94 B13R2.2130 CNc1ncc2c(n1)ccn2C WXDL_WXCD00611670_AN4223_LP1483 [0,2,0,0,0,0|1,0,1]=4 95 B13R2.2130 CNc1ncc2c(n1)ccn2C WXDL_WXCD00611671_AN4223_LP1483 [0,2,0,0,0,0|1,0,1]=4 96 B13R2.2130 CNc1ncc2c(n1)ccn2C WXDL_WXCD00905463_AN4223_LP1483 [0,2,0,0,0,0|1,0,1]=4 97 B13R2.2130 CNc1ncc2c(n1)ccn2C WXDL_WXCD01004270_AN4223_LP1483 [0,2,0,0,0,0|1,0,1]=4 98 B13R2.2130 CNc1ncc2c(n1)ccn2C WXDL_WXCD02002292_AN4223_LP1483 [0,2,0,0,0,0|1,0,1]=4