0 B19R2.52042 C#CCCCCNC(=O)c1nc2ccccc2o1 WXVL_AK00614SE0704 [0,0,0,0,0,0|2,0,2]=4 1 B19R2.52042 C#CCCCCNC(=O)c1nc2ccccc2o1 WXVL_AK00614SE0704 [0,0,0,0,0,0|2,0,2]=4 2 B19R2.52042 CCCCCCCC(=O)N1Cc2ccccc2C1 WXVL_AN0094SB0393 [0,0,0,0,0,0|4,0,0]=4 3 B19R2.52042 CCCCCCCC(=O)N1Cc2ccccc2C1 WXVL_AN0094SB0393 [0,0,0,0,0,0|4,0,0]=4 4 B19R2.52042 CCCCCCCC(=O)N1Cc2cncnc2C1 WXVL_AN0315SB0393 [0,0,0,0,0,0|4,0,0]=4 5 B19R2.52042 CCCCCCNC(=O)C1Cc2ccccc2O1 WXVL_AK0286SB0867 [0,0,0,0,0,0|3,0,1]=4 6 B19R2.52042 CCCCCCNC(=O)C1Cc2ccccc2O1 WXVL_AK0286SB0867 [0,0,0,0,0,0|3,0,1]=4 7 B19R2.52042 CCCCCCNC(=O)c1cc2ccccc2[nH]1 WXVL_AK0286SE0001 [0,0,0,0,0,0|3,0,1]=4 8 B19R2.52042 CCCCCCNC(=O)c1cc2ccccc2[nH]1 WXVL_AK0286SE0001 [0,0,0,0,0,0|3,0,1]=4 9 B19R2.52042 CCCCCCNC(=O)c1cc2ccccc2o1 WXVL_AK0286SE0105 [0,0,0,0,0,0|3,0,0]=3 10 B19R2.52042 CCCCCCNC(=O)c1cc2ccccc2o1 WXVL_AK0286SE0105 [0,0,0,0,0,0|3,0,0]=3 11 B19R2.52042 CCCCCCNC(=O)c1cc2ccccc2s1 WXVL_AK0286SE0107 [0,0,0,0,0,0|3,1,0]=4 12 B19R2.52042 CCCCCCNC(=O)c1cc2ccccc2s1 WXVL_AK0286SE0107 [0,0,0,0,0,0|3,1,0]=4 13 B19R2.52042 CCCCCCNC(=O)c1cc2ccccn2n1 WXVL_AK0286SE0030 [0,0,0,0,0,0|4,0,0]=4 14 B19R2.52042 CCCCCCNC(=O)c1cc2ccccn2n1 WXVL_AK0286SE0030 [0,0,0,0,0,0|4,0,0]=4 15 B19R2.52042 CCCCCCNC(=O)c1cc2cccnc2[nH]1 WXVL_AK0286SE0450 [0,0,0,0,0,0|2,0,1]=3 16 B19R2.52042 CCCCCCNC(=O)c1cc2cccnc2[nH]1 WXVL_AK0286SE0450 [0,0,0,0,0,0|2,0,1]=3 17 B19R2.52042 CCCCCCNC(=O)c1cc2cccnc2s1 WXVL_AK0286SE0061 [0,0,0,0,0,0|3,0,0]=3 18 B19R2.52042 CCCCCCNC(=O)c1cc2cccnc2s1 WXVL_AK0286SE0061 [0,0,0,0,0,0|3,0,0]=3 19 B19R2.52042 CCCCCCNC(=O)c1cc2cccnn2c1 WXVL_AK0286SE0985 [0,0,0,0,0,0|4,0,0]=4 20 B19R2.52042 CCCCCCNC(=O)c1cc2cccnn2c1 WXVL_AK0286SE0985 [0,0,0,0,0,0|4,0,0]=4 21 B19R2.52042 CCCCCCNC(=O)c1cc2cccnn2n1 WXVL_AK0286SC00097 [0,0,0,0,0,0|3,0,0]=3 22 B19R2.52042 CCCCCCNC(=O)c1cc2cccnn2n1 WXVL_AK0286SC00097 [0,0,0,0,0,0|3,0,0]=3 23 B19R2.52042 CCCCCCNC(=O)c1cc2ncccc2[nH]1 WXVL_AK0286SE0680 [0,0,0,0,0,0|3,0,0]=3 24 B19R2.52042 CCCCCCNC(=O)c1cc2ncccc2[nH]1 WXVL_AK0286SE0680 [0,0,0,0,0,0|3,0,0]=3 25 B19R2.52042 CCCCCCNC(=O)c1cc2ncccn2n1 WXVL_AK0286SE0309 [0,0,0,0,0,0|4,0,0]=4 26 B19R2.52042 CCCCCCNC(=O)c1cc2ncccn2n1 WXVL_AK0286SE0309 [0,0,0,0,0,0|4,0,0]=4 27 B19R2.52042 CCCCCCNC(=O)c1cn2cccnc2n1 WXVL_AK0286SE0332 [0,0,0,0,0,0|3,0,0]=3 28 B19R2.52042 CCCCCCNC(=O)c1cn2cccnc2n1 WXVL_AK0286SE0332 [0,0,0,0,0,0|3,0,0]=3 29 B19R2.52042 CCCCCCNC(=O)c1cn2ncccc2n1 WXVL_AK0286SE0145 [0,0,0,0,0,0|4,0,0]=4 30 B19R2.52042 CCCCCCNC(=O)c1cn2ncccc2n1 WXVL_AK0286SE0145 [0,0,0,0,0,0|4,0,0]=4 31 B19R2.52042 CCCCCCNC(=O)c1nc2ccccc2[nH]1 WXVL_AK0286SE0026 [0,0,0,0,0,0|3,0,0]=3 32 B19R2.52042 CCCCCCNC(=O)c1nc2ccccc2[nH]1 WXVL_AK0286SE0026 [0,0,0,0,0,0|3,0,0]=3 33 B19R2.52042 CCCCCCNC(=O)c1nc2ccccc2o1 WXVL_AK0286SE0704 [0,0,0,0,0,0|2,0,0]=2 34 B19R2.52042 CCCCCCNC(=O)c1nc2ccccc2o1 WXVL_AK0286SE0704 [0,0,0,0,0,0|2,0,0]=2 35 B19R2.52042 CCCCCCNC(=O)c1nc2ccccn2n1 WXVL_AK0286SC00085 [0,0,0,0,0,0|4,0,0]=4 36 B19R2.52042 CCCCCCNC(=O)c1nc2ccccn2n1 WXVL_AK0286SC00085 [0,0,0,0,0,0|4,0,0]=4 37 B19R2.52042 CCCCCCNC(=O)c1nc2ncccn2n1 WXVL_AK0286SE0103 [0,0,0,0,0,0|3,0,0]=3 38 B19R2.52042 CCCCCCNC(=O)c1nc2ncccn2n1 WXVL_AK0286SE0103 [0,0,0,0,0,0|3,0,0]=3 39 B19R2.52042 CCOCCCNC(=O)c1cc2ccccc2o1 WXVL_AK0072SE0105 [0,0,0,0,0,0|4,0,0]=4 40 B19R2.52042 CCOCCCNC(=O)c1cc2ccccc2o1 WXVL_AK0072SE0105 [0,0,0,0,0,0|4,0,0]=4 41 B19R2.52042 CCOCCCNC(=O)c1cc2cccnc2[nH]1 WXVL_AK0072SE0450 [0,0,0,0,0,0|3,0,1]=4 42 B19R2.52042 CCOCCCNC(=O)c1cc2cccnc2[nH]1 WXVL_AK0072SE0450 [0,0,0,0,0,0|3,0,1]=4 43 B19R2.52042 CCOCCCNC(=O)c1cc2cccnc2s1 WXVL_AK0072SE0061 [0,0,0,0,0,0|4,0,0]=4 44 B19R2.52042 CCOCCCNC(=O)c1cc2cccnc2s1 WXVL_AK0072SE0061 [0,0,0,0,0,0|4,0,0]=4 45 B19R2.52042 CCOCCCNC(=O)c1cc2cccnn2n1 WXVL_AK0072SC00097 [0,0,0,0,0,0|4,0,0]=4 46 B19R2.52042 CCOCCCNC(=O)c1cc2cccnn2n1 WXVL_AK0072SC00097 [0,0,0,0,0,0|4,0,0]=4 47 B19R2.52042 CCOCCCNC(=O)c1cc2ncccc2[nH]1 WXVL_AK0072SE0680 [0,0,0,0,0,0|4,0,0]=4 48 B19R2.52042 CCOCCCNC(=O)c1cc2ncccc2[nH]1 WXVL_AK0072SE0680 [0,0,0,0,0,0|4,0,0]=4 49 B19R2.52042 CCOCCCNC(=O)c1cn2cccnc2n1 WXVL_AK0072SE0332 [0,0,0,0,0,0|4,0,0]=4 50 B19R2.52042 CCOCCCNC(=O)c1cn2cccnc2n1 WXVL_AK0072SE0332 [0,0,0,0,0,0|4,0,0]=4 51 B19R2.52042 CCOCCCNC(=O)c1nc2ccccc2[nH]1 WXVL_AK0072SE0026 [0,0,0,0,0,0|4,0,0]=4 52 B19R2.52042 CCOCCCNC(=O)c1nc2ccccc2[nH]1 WXVL_AK0072SE0026 [0,0,0,0,0,0|4,0,0]=4 53 B19R2.52042 CCOCCCNC(=O)c1nc2ccccc2o1 WXVL_AK0072SE0704 [0,0,0,0,0,0|3,0,0]=3 54 B19R2.52042 CCOCCCNC(=O)c1nc2ccccc2o1 WXVL_AK0072SE0704 [0,0,0,0,0,0|3,0,0]=3 55 B19R2.52042 CCOCCCNC(=O)c1nc2ncccn2n1 WXVL_AK0072SE0103 [0,0,0,0,0,0|4,0,0]=4 56 B19R2.52042 CCOCCCNC(=O)c1nc2ncccn2n1 WXVL_AK0072SE0103 [0,0,0,0,0,0|4,0,0]=4 57 B19R2.52042 O=C(NCCCCCO)c1cc2ccccc2o1 WXVL_AK0077SE0105 [0,0,0,0,0,0|4,0,0]=4 58 B19R2.52042 O=C(NCCCCCO)c1cc2ccccc2o1 WXVL_AK0077SE0105 [0,0,0,0,0,0|4,0,0]=4 59 B19R2.52042 O=C(NCCCCCO)c1cc2cccnc2[nH]1 WXVL_AK0077SE0450 [0,0,0,0,0,0|3,0,1]=4 60 B19R2.52042 O=C(NCCCCCO)c1cc2cccnc2[nH]1 WXVL_AK0077SE0450 [0,0,0,0,0,0|3,0,1]=4 61 B19R2.52042 O=C(NCCCCCO)c1cc2cccnc2s1 WXVL_AK0077SE0061 [0,0,0,0,0,0|4,0,0]=4 62 B19R2.52042 O=C(NCCCCCO)c1cc2cccnc2s1 WXVL_AK0077SE0061 [0,0,0,0,0,0|4,0,0]=4 63 B19R2.52042 O=C(NCCCCCO)c1cc2cccnn2n1 WXVL_AK0077SC00097 [0,0,0,0,0,0|4,0,0]=4 64 B19R2.52042 O=C(NCCCCCO)c1cc2cccnn2n1 WXVL_AK0077SC00097 [0,0,0,0,0,0|4,0,0]=4 65 B19R2.52042 O=C(NCCCCCO)c1cc2ncccc2[nH]1 WXVL_AK0077SE0680 [0,0,0,0,0,0|4,0,0]=4 66 B19R2.52042 O=C(NCCCCCO)c1cc2ncccc2[nH]1 WXVL_AK0077SE0680 [0,0,0,0,0,0|4,0,0]=4 67 B19R2.52042 O=C(NCCCCCO)c1cn2cccnc2n1 WXVL_AK0077SE0332 [0,0,0,0,0,0|4,0,0]=4 68 B19R2.52042 O=C(NCCCCCO)c1cn2cccnc2n1 WXVL_AK0077SE0332 [0,0,0,0,0,0|4,0,0]=4 69 B19R2.52042 O=C(NCCCCCO)c1nc2ccccc2[nH]1 WXVL_AK0077SE0026 [0,0,0,0,0,0|4,0,0]=4 70 B19R2.52042 O=C(NCCCCCO)c1nc2ccccc2[nH]1 WXVL_AK0077SE0026 [0,0,0,0,0,0|4,0,0]=4 71 B19R2.52042 O=C(NCCCCCO)c1nc2ccccc2o1 WXVL_AK0077SE0704 [0,0,0,0,0,0|3,0,0]=3 72 B19R2.52042 O=C(NCCCCCO)c1nc2ccccc2o1 WXVL_AK0077SE0704 [0,0,0,0,0,0|3,0,0]=3 73 B19R2.52042 O=C(NCCCCCO)c1nc2ncccn2n1 WXVL_AK0077SE0103 [0,0,0,0,0,0|4,0,0]=4 74 B19R2.52042 O=C(NCCCCCO)c1nc2ncccn2n1 WXVL_AK0077SE0103 [0,0,0,0,0,0|4,0,0]=4 75 B19R2.52042 O=C(NCCNCCO)c1nc2ccccc2o1 WXVL_AK0954SE0704 [0,0,0,0,0,0|4,0,0]=4 76 B19R2.52042 O=C(NCCNCCO)c1nc2ccccc2o1 WXVL_AK0954SE0704 [0,0,0,0,0,0|4,0,0]=4 77 B18R2.14794 CCCCCNC(=O)c1cc2ccccc2o1 WXVL_AK0076SE0105 [1,0,0,0,0,0|3,0,0]=4 78 B18R2.14794 CCCCCNC(=O)c1cc2ccccc2o1 WXVL_AK0076SE0105 [1,0,0,0,0,0|3,0,0]=4 79 B18R2.14794 CCCCCNC(=O)c1cc2cccnc2[nH]1 WXVL_AK0076SE0450 [1,0,0,0,0,0|2,0,1]=4 80 B18R2.14794 CCCCCNC(=O)c1cc2cccnc2[nH]1 WXVL_AK0076SE0450 [1,0,0,0,0,0|2,0,1]=4 81 B18R2.14794 CCCCCNC(=O)c1cc2cccnc2s1 WXVL_AK0076SE0061 [1,0,0,0,0,0|3,0,0]=4 82 B18R2.14794 CCCCCNC(=O)c1cc2cccnc2s1 WXVL_AK0076SE0061 [1,0,0,0,0,0|3,0,0]=4 83 B18R2.14794 CCCCCNC(=O)c1cc2cccnn2n1 WXVL_AK0076SC00097 [1,0,0,0,0,0|3,0,0]=4 84 B18R2.14794 CCCCCNC(=O)c1cc2cccnn2n1 WXVL_AK0076SC00097 [1,0,0,0,0,0|3,0,0]=4 85 B18R2.14794 CCCCCNC(=O)c1cc2ncccc2[nH]1 WXVL_AK0076SE0680 [1,0,0,0,0,0|3,0,0]=4 86 B18R2.14794 CCCCCNC(=O)c1cc2ncccc2[nH]1 WXVL_AK0076SE0680 [1,0,0,0,0,0|3,0,0]=4 87 B18R2.14794 CCCCCNC(=O)c1cn2cccnc2n1 WXVL_AK0076SE0332 [1,0,0,0,0,0|3,0,0]=4 88 B18R2.14794 CCCCCNC(=O)c1cn2cccnc2n1 WXVL_AK0076SE0332 [1,0,0,0,0,0|3,0,0]=4 89 B18R2.14794 CCCCCNC(=O)c1nc2ccccc2[nH]1 WXVL_AK0076SE0026 [1,0,0,0,0,0|3,0,0]=4 90 B18R2.14794 CCCCCNC(=O)c1nc2ccccc2[nH]1 WXVL_AK0076SE0026 [1,0,0,0,0,0|3,0,0]=4 91 B18R2.14794 CCCCCNC(=O)c1nc2ccccc2o1 WXVL_AK0076SE0704 [1,0,0,0,0,0|2,0,0]=3 92 B18R2.14794 CCCCCNC(=O)c1nc2ccccc2o1 WXVL_AK0076SE0704 [1,0,0,0,0,0|2,0,0]=3 93 B18R2.14794 CCCCCNC(=O)c1nc2ncccn2n1 WXVL_AK0076SE0103 [1,0,0,0,0,0|3,0,0]=4 94 B18R2.14794 CCCCCNC(=O)c1nc2ncccn2n1 WXVL_AK0076SE0103 [1,0,0,0,0,0|3,0,0]=4 95 B18R2.14794 CCSCCNC(=O)c1nc2ccccc2o1 WXVL_AK00494SE0704 [1,0,0,0,0,0|3,0,0]=4 96 B18R2.14794 CCSCCNC(=O)c1nc2ccccc2o1 WXVL_AK00494SE0704 [1,0,0,0,0,0|3,0,0]=4 97 B18R2.14794 COCCCNC(=O)c1nc2ccccc2o1 WXVL_AK00637SE0704 [1,0,0,0,0,0|3,0,0]=4 98 B18R2.14794 COCCCNC(=O)c1nc2ccccc2o1 WXVL_AK00637SE0704 [1,0,0,0,0,0|3,0,0]=4 99 B18R2.14794 CSCCCNC(=O)c1nc2ccccc2o1 WXVL_AK0965SE0704 [1,0,0,0,0,0|3,0,0]=4 100 B18R2.14794 CSCCCNC(=O)c1nc2ccccc2o1 WXVL_AK0965SE0704 [1,0,0,0,0,0|3,0,0]=4 101 B18R2.14794 O=C(NCCCCO)c1nc2ccccc2o1 WXVL_AK0075SE0704 [1,0,0,0,0,0|3,0,0]=4 102 B18R2.14794 O=C(NCCCCO)c1nc2ccccc2o1 WXVL_AK0075SE0704 [1,0,0,0,0,0|3,0,0]=4 103 B20R2.46935 CCCCOCCNC(=O)c1cc2ccccc2o1 WXVL_AK9674SE0105 [0,1,0,0,0,0|3,0,0]=4 104 B20R2.46935 CCCCOCCNC(=O)c1cc2ccccc2o1 WXVL_AK9674SE0105 [0,1,0,0,0,0|3,0,0]=4 105 B20R2.46935 CCCCOCCNC(=O)c1cc2cccnc2[nH]1 WXVL_AK9674SE0450 [0,1,0,0,0,0|2,0,1]=4 106 B20R2.46935 CCCCOCCNC(=O)c1cc2cccnc2[nH]1 WXVL_AK9674SE0450 [0,1,0,0,0,0|2,0,1]=4 107 B20R2.46935 CCCCOCCNC(=O)c1cc2cccnc2s1 WXVL_AK9674SE0061 [0,1,0,0,0,0|3,0,0]=4 108 B20R2.46935 CCCCOCCNC(=O)c1cc2cccnc2s1 WXVL_AK9674SE0061 [0,1,0,0,0,0|3,0,0]=4 109 B20R2.46935 CCCCOCCNC(=O)c1cc2cccnn2n1 WXVL_AK9674SC00097 [0,1,0,0,0,0|3,0,0]=4 110 B20R2.46935 CCCCOCCNC(=O)c1cc2cccnn2n1 WXVL_AK9674SC00097 [0,1,0,0,0,0|3,0,0]=4 111 B20R2.46935 CCCCOCCNC(=O)c1cc2ncccc2[nH]1 WXVL_AK9674SE0680 [0,1,0,0,0,0|3,0,0]=4 112 B20R2.46935 CCCCOCCNC(=O)c1cc2ncccc2[nH]1 WXVL_AK9674SE0680 [0,1,0,0,0,0|3,0,0]=4 113 B20R2.46935 CCCCOCCNC(=O)c1cn2cccnc2n1 WXVL_AK9674SE0332 [0,1,0,0,0,0|3,0,0]=4 114 B20R2.46935 CCCCOCCNC(=O)c1cn2cccnc2n1 WXVL_AK9674SE0332 [0,1,0,0,0,0|3,0,0]=4 115 B20R2.46935 CCCCOCCNC(=O)c1nc2ccccc2[nH]1 WXVL_AK9674SE0026 [0,1,0,0,0,0|3,0,0]=4 116 B20R2.46935 CCCCOCCNC(=O)c1nc2ccccc2[nH]1 WXVL_AK9674SE0026 [0,1,0,0,0,0|3,0,0]=4 117 B20R2.46935 CCCCOCCNC(=O)c1nc2ccccc2o1 WXVL_AK9674SE0704 [0,1,0,0,0,0|2,0,0]=3 118 B20R2.46935 CCCCOCCNC(=O)c1nc2ccccc2o1 WXVL_AK9674SE0704 [0,1,0,0,0,0|2,0,0]=3 119 B20R2.46935 CCCCOCCNC(=O)c1nc2ncccn2n1 WXVL_AK9674SE0103 [0,1,0,0,0,0|3,0,0]=4 120 B20R2.46935 CCCCOCCNC(=O)c1nc2ncccn2n1 WXVL_AK9674SE0103 [0,1,0,0,0,0|3,0,0]=4 121 B20R2.46935 COCCOCCNC(=O)c1nc2ccccc2o1 WXVL_AK2206SE0704 [0,1,0,0,0,0|3,0,0]=4 122 B20R2.46935 COCCOCCNC(=O)c1nc2ccccc2o1 WXVL_AK2206SE0704 [0,1,0,0,0,0|3,0,0]=4 123 B20R2.46935 O=C(NCCCCCCO)c1cc2ccccc2o1 WXVL_AK0751SE0105 [0,1,0,0,0,0|3,0,0]=4 124 B20R2.46935 O=C(NCCCCCCO)c1cc2ccccc2o1 WXVL_AK0751SE0105 [0,1,0,0,0,0|3,0,0]=4 125 B20R2.46935 O=C(NCCCCCCO)c1cc2cccnc2[nH]1 WXVL_AK0751SE0450 [0,1,0,0,0,0|2,0,1]=4 126 B20R2.46935 O=C(NCCCCCCO)c1cc2cccnc2[nH]1 WXVL_AK0751SE0450 [0,1,0,0,0,0|2,0,1]=4 127 B20R2.46935 O=C(NCCCCCCO)c1cc2cccnc2s1 WXVL_AK0751SE0061 [0,1,0,0,0,0|3,0,0]=4 128 B20R2.46935 O=C(NCCCCCCO)c1cc2cccnc2s1 WXVL_AK0751SE0061 [0,1,0,0,0,0|3,0,0]=4 129 B20R2.46935 O=C(NCCCCCCO)c1cc2cccnn2n1 WXVL_AK0751SC00097 [0,1,0,0,0,0|3,0,0]=4 130 B20R2.46935 O=C(NCCCCCCO)c1cc2cccnn2n1 WXVL_AK0751SC00097 [0,1,0,0,0,0|3,0,0]=4 131 B20R2.46935 O=C(NCCCCCCO)c1cc2ncccc2[nH]1 WXVL_AK0751SE0680 [0,1,0,0,0,0|3,0,0]=4 132 B20R2.46935 O=C(NCCCCCCO)c1cc2ncccc2[nH]1 WXVL_AK0751SE0680 [0,1,0,0,0,0|3,0,0]=4 133 B20R2.46935 O=C(NCCCCCCO)c1cn2cccnc2n1 WXVL_AK0751SE0332 [0,1,0,0,0,0|3,0,0]=4 134 B20R2.46935 O=C(NCCCCCCO)c1cn2cccnc2n1 WXVL_AK0751SE0332 [0,1,0,0,0,0|3,0,0]=4 135 B20R2.46935 O=C(NCCCCCCO)c1nc2ccccc2[nH]1 WXVL_AK0751SE0026 [0,1,0,0,0,0|3,0,0]=4 136 B20R2.46935 O=C(NCCCCCCO)c1nc2ccccc2[nH]1 WXVL_AK0751SE0026 [0,1,0,0,0,0|3,0,0]=4 137 B20R2.46935 O=C(NCCCCCCO)c1nc2ccccc2o1 WXVL_AK0751SE0704 [0,1,0,0,0,0|2,0,0]=3 138 B20R2.46935 O=C(NCCCCCCO)c1nc2ccccc2o1 WXVL_AK0751SE0704 [0,1,0,0,0,0|2,0,0]=3 139 B20R2.46935 O=C(NCCCCCCO)c1nc2ncccn2n1 WXVL_AK0751SE0103 [0,1,0,0,0,0|3,0,0]=4 140 B20R2.46935 O=C(NCCCCCCO)c1nc2ncccn2n1 WXVL_AK0751SE0103 [0,1,0,0,0,0|3,0,0]=4 141 B20R2.77728 CCCCCCCC(=O)N1Cc2cc(cnc2C1)Br WXVL_AN00850SB0393 [0,1,0,0,0,0|3,0,0]=4 142 B20R2.77728 CCCCCCCC(=O)N1Cc2ccc(nc2C1)Cl WXVL_AN00754SB0393 [0,1,0,0,0,0|3,0,0]=4 143 B20R2.77728 CCCCCCNC(=O)c1cc2ccc(cc2o1)O WXVL_AK0286SE0774 [0,1,0,0,0,0|3,0,0]=4 144 B20R2.77728 CCCCCCNC(=O)c1cc2ccc(cc2o1)O WXVL_AK0286SE0774 [0,1,0,0,0,0|3,0,0]=4 145 B20R2.77728 CCCCCCNC(=O)c1cc2ccc(nc2[nH]1)Cl WXVL_AK0286SE0468 [0,1,0,0,0,0|2,0,1]=4 146 B20R2.77728 CCCCCCNC(=O)c1cc2ccc(nc2[nH]1)Cl WXVL_AK0286SE0468 [0,1,0,0,0,0|2,0,1]=4 147 B20R2.77728 CCCCCCNC(=O)c1cc2nc(ccc2o1)C WXVL_AK0286SC00024 [0,1,0,0,0,0|2,0,0]=3 148 B20R2.77728 CCCCCCNC(=O)c1cc2nc(ccc2o1)C WXVL_AK0286SC00024 [0,1,0,0,0,0|2,0,0]=3 149 B20R2.77728 CCOCCCNC(=O)c1cc2nc(ccc2o1)C WXVL_AK0072SC00024 [0,1,0,0,0,0|3,0,0]=4 150 B20R2.77728 CCOCCCNC(=O)c1cc2nc(ccc2o1)C WXVL_AK0072SC00024 [0,1,0,0,0,0|3,0,0]=4 151 B20R2.77728 Cc1ccc2oc(cc2n1)C(=O)NCCCCCO WXVL_AK0077SC00024 [0,1,0,0,0,0|3,0,0]=4 152 B20R2.77728 Cc1ccc2oc(cc2n1)C(=O)NCCCCCO WXVL_AK0077SC00024 [0,1,0,0,0,0|3,0,0]=4 153 B20R2.77730 CCCCCCNC(=O)c1oc2ccccc2c1C WXVL_AK0286SE0058 [0,1,0,0,0,0|3,0,0]=4 154 B20R2.77730 CCCCCCNC(=O)c1oc2ccccc2c1C WXVL_AK0286SE0058 [0,1,0,0,0,0|3,0,0]=4 155 B20R2.77737 CCCCCCNC(=O)c1nc2c(cccc2[nH]1)C WXVL_AK0286SE0513 [0,1,0,0,0,0|3,0,0]=4 156 B20R2.77737 CCCCCCNC(=O)c1nc2c(cccc2[nH]1)C WXVL_AK0286SE0513 [0,1,0,0,0,0|3,0,0]=4 157 B20R2.173405 CN(C)CCCCNC(=O)c1nc2ccccc2o1 WXVL_AK0097SE0704 [0,1,0,0,0,0|3,0,0]=4 158 B20R2.173405 CN(C)CCCCNC(=O)c1nc2ccccc2o1 WXVL_AK0097SE0704 [0,1,0,0,0,0|3,0,0]=4 159 B18R1.315 CCCCCCCC(=O)N(C)Cc1ccccn1 WXVL_AN0108SB0393 [0,0,1,0,0,0|3,0,0]=4 160 B18R1.315 CCCCCCCC(=O)N(C)Cc1ccccn1 WXVL_AN0108SB0393 [0,0,1,0,0,0|3,0,0]=4 161 B18R1.315 CCCCCCCC(=O)N(C)Cc1cccnc1 WXVL_AN0060SB0393 [0,0,1,0,0,0|3,0,0]=4 162 B18R1.315 CCCCCCCC(=O)N(C)Cc1cccnc1 WXVL_AN0060SB0393 [0,0,1,0,0,0|3,0,0]=4 163 B18R1.315 CCCCCCNC(=O)/C(=C/c1cccnc1)/C WXVL_AK0286SA1933 [0,0,1,0,0,0|3,0,0]=4 164 B18R1.315 CCCCCCNC(=O)/C(=C/c1cccnc1)/C WXVL_AK0286SA1933 [0,0,1,0,0,0|3,0,0]=4 165 B18R1.10542 CCCCCCCC(=O)NCc1ccccc1O WXVL_AK0963SB0393 [0,0,1,0,0,0|3,0,0]=4 166 B18R1.10542 CCCCCCCC(=O)NCc1ccccc1O WXVL_AK0963SB0393 [0,0,1,0,0,0|3,0,0]=4 167 B18R1.10542 CCCCCCCC(=O)NCc1cccnc1Br WXVL_AK4357SB0393 [0,0,1,0,0,0|3,0,0]=4 168 B18R1.10542 CCCCCCCC(=O)NCc1cccnc1Br WXVL_AK4357SB0393 [0,0,1,0,0,0|3,0,0]=4 169 B18R1.10542 CCCCCCCC(=O)NCc1cccnc1C WXVL_AK00258SB0393 [0,0,1,0,0,0|3,0,0]=4 170 B18R1.10542 CCCCCCCC(=O)NCc1cccnc1C WXVL_AK00258SB0393 [0,0,1,0,0,0|3,0,0]=4 171 B18R1.10542 CCCCCCCC(=O)NCc1cccnc1F WXVL_AK00552SB0393 [0,0,1,0,0,0|3,0,0]=4 172 B18R1.10542 CCCCCCCC(=O)NCc1cccnc1F WXVL_AK00552SB0393 [0,0,1,0,0,0|3,0,0]=4 173 B18R1.10542 CCCCCCCC(=O)NCc1ncccc1C WXVL_AK0162SB0393 [0,0,1,0,0,0|3,0,0]=4 174 B18R1.10542 CCCCCCCC(=O)NCc1ncccc1C WXVL_AK0162SB0393 [0,0,1,0,0,0|3,0,0]=4 175 B18R1.10542 CCCCCCCC(=O)NCc1ncccc1F WXVL_AK00098SB0393 [0,0,1,0,0,0|3,0,0]=4 176 B18R1.10542 CCCCCCCC(=O)NCc1ncccc1F WXVL_AK00098SB0393 [0,0,1,0,0,0|3,0,0]=4 177 B20R3.331219 O=C(NC1CCCCC1)c2cc3ccccc3o2 WXVL_AK00480SE0105 [0,0,0,1,0,0|3,0,0]=4 178 B20R3.331219 O=C(NC1CCCCC1)c2cc3ccccc3o2 WXVL_AK00480SE0105 [0,0,0,1,0,0|3,0,0]=4 179 B20R3.331219 O=C(NC1CCCCC1)c2cc3cccnc3[nH]2 WXVL_AK00480SE0450 [0,0,0,1,0,0|2,0,1]=4 180 B20R3.331219 O=C(NC1CCCCC1)c2cc3cccnc3[nH]2 WXVL_AK00480SE0450 [0,0,0,1,0,0|2,0,1]=4 181 B20R3.331219 O=C(NC1CCCCC1)c2cc3cccnc3s2 WXVL_AK00480SE0061 [0,0,0,1,0,0|3,0,0]=4 182 B20R3.331219 O=C(NC1CCCCC1)c2cc3cccnc3s2 WXVL_AK00480SE0061 [0,0,0,1,0,0|3,0,0]=4 183 B20R3.331219 O=C(NC1CCCCC1)c2cc3cccnn3n2 WXVL_AK00480SC00097 [0,0,0,1,0,0|3,0,0]=4 184 B20R3.331219 O=C(NC1CCCCC1)c2cc3cccnn3n2 WXVL_AK00480SC00097 [0,0,0,1,0,0|3,0,0]=4 185 B20R3.331219 O=C(NC1CCCCC1)c2cc3ncccc3[nH]2 WXVL_AK00480SE0680 [0,0,0,1,0,0|3,0,0]=4 186 B20R3.331219 O=C(NC1CCCCC1)c2cc3ncccc3[nH]2 WXVL_AK00480SE0680 [0,0,0,1,0,0|3,0,0]=4 187 B20R3.331219 O=C(NC1CCCCC1)c2cn3cccnc3n2 WXVL_AK00480SE0332 [0,0,0,1,0,0|3,0,0]=4 188 B20R3.331219 O=C(NC1CCCCC1)c2cn3cccnc3n2 WXVL_AK00480SE0332 [0,0,0,1,0,0|3,0,0]=4 189 B20R3.331219 O=C(NC1CCCCC1)c2nc3ccccc3[nH]2 WXVL_AK00480SE0026 [0,0,0,1,0,0|3,0,0]=4 190 B20R3.331219 O=C(NC1CCCCC1)c2nc3ccccc3[nH]2 WXVL_AK00480SE0026 [0,0,0,1,0,0|3,0,0]=4 191 B20R3.331219 O=C(NC1CCCCC1)c2nc3ccccc3o2 WXVL_AK00480SE0704 [0,0,0,1,0,0|2,0,0]=3 192 B20R3.331219 O=C(NC1CCCCC1)c2nc3ccccc3o2 WXVL_AK00480SE0704 [0,0,0,1,0,0|2,0,0]=3 193 B20R3.331219 O=C(NC1CCCCC1)c2nc3ncccn3n2 WXVL_AK00480SE0103 [0,0,0,1,0,0|3,0,0]=4 194 B20R3.331219 O=C(NC1CCCCC1)c2nc3ncccn3n2 WXVL_AK00480SE0103 [0,0,0,1,0,0|3,0,0]=4 195 B20R3.331219 O=C(NC1CCCOC1)c2nc3ccccc3o2 WXVL_AK1073SE0704 [0,0,0,1,0,0|3,0,0]=4 196 B20R3.331219 O=C(NC1CCCOC1)c2nc3ccccc3o2 WXVL_AK1073SE0704 [0,0,0,1,0,0|3,0,0]=4 197 B20R3.1866124 O=C(c1nc2ccccc2o1)N3CCCOCC3 WXVL_AN00350SE0704 [0,0,0,1,0,0|3,0,0]=4 198 B20R3.1866124 O=C(c1nc2ccccc2o1)N3CCCOCC3 WXVL_AN00350SE0704 [0,0,0,1,0,0|3,0,0]=4 199 B20R3.2310115 O=C(c1nc2ccccc2o1)N3CCC[C@H]3CO WXVL_AN0917SE0704 [0,0,0,1,0,0|3,0,0]=4 200 B20R3.2864785 C[C@@H]1COCCN1C(=O)c2nc3ccccc3o2 WXVL_AN00562SE0704 [0,0,0,1,0,0|3,0,0]=4 201 B20R3.2864785 C[C@H]1CCCCN1C(=O)c2cc3ccccc3o2 WXVL_AN00851SE0105 [0,0,0,1,0,0|3,0,0]=4 202 B20R3.2864785 C[C@H]1CCCCN1C(=O)c2cc3cccnc3[nH]2 WXVL_AN00851SE0450 [0,0,0,1,0,0|2,0,1]=4 203 B20R3.2864785 C[C@H]1CCCCN1C(=O)c2cc3cccnc3s2 WXVL_AN00851SE0061 [0,0,0,1,0,0|3,0,0]=4 204 B20R3.2864785 C[C@H]1CCCCN1C(=O)c2cc3cccnn3n2 WXVL_AN00851SC00097 [0,0,0,1,0,0|3,0,0]=4 205 B20R3.2864785 C[C@H]1CCCCN1C(=O)c2cc3ncccc3[nH]2 WXVL_AN00851SE0680 [0,0,0,1,0,0|3,0,0]=4 206 B20R3.2864785 C[C@H]1CCCCN1C(=O)c2cn3cccnc3n2 WXVL_AN00851SE0332 [0,0,0,1,0,0|3,0,0]=4 207 B20R3.2864785 C[C@H]1CCCCN1C(=O)c2nc3ccccc3[nH]2 WXVL_AN00851SE0026 [0,0,0,1,0,0|3,0,0]=4 208 B20R3.2864785 C[C@H]1CCCCN1C(=O)c2nc3ccccc3o2 WXVL_AN00851SE0704 [0,0,0,1,0,0|2,0,0]=3 209 B20R3.2864785 C[C@H]1CCCCN1C(=O)c2nc3ncccn3n2 WXVL_AN00851SE0103 [0,0,0,1,0,0|3,0,0]=4 210 B20R3.2864785 C[C@H]1COCCN1C(=O)c2nc3ccccc3o2 WXVL_AN00472SE0704 [0,0,0,1,0,0|3,0,0]=4 211 B20R3.2864785 C[C@H]1COCCN1C(=O)c2nc3ccccc3o2 WXVL_AN00472SE0704 [0,0,0,1,0,0|3,0,0]=4 212 B20R3.5153540 O=C(NCCC1CCC1)c2cc3ccccc3o2 WXVL_AK2418SE0105 [0,0,0,1,0,0|3,0,0]=4 213 B20R3.5153540 O=C(NCCC1CCC1)c2cc3ccccc3o2 WXVL_AK2418SE0105 [0,0,0,1,0,0|3,0,0]=4 214 B20R3.5153540 O=C(NCCC1CCC1)c2cc3cccnc3[nH]2 WXVL_AK2418SE0450 [0,0,0,1,0,0|2,0,1]=4 215 B20R3.5153540 O=C(NCCC1CCC1)c2cc3cccnc3[nH]2 WXVL_AK2418SE0450 [0,0,0,1,0,0|2,0,1]=4 216 B20R3.5153540 O=C(NCCC1CCC1)c2cc3cccnc3s2 WXVL_AK2418SE0061 [0,0,0,1,0,0|3,0,0]=4 217 B20R3.5153540 O=C(NCCC1CCC1)c2cc3cccnc3s2 WXVL_AK2418SE0061 [0,0,0,1,0,0|3,0,0]=4 218 B20R3.5153540 O=C(NCCC1CCC1)c2cc3cccnn3n2 WXVL_AK2418SC00097 [0,0,0,1,0,0|3,0,0]=4 219 B20R3.5153540 O=C(NCCC1CCC1)c2cc3cccnn3n2 WXVL_AK2418SC00097 [0,0,0,1,0,0|3,0,0]=4 220 B20R3.5153540 O=C(NCCC1CCC1)c2cc3ncccc3[nH]2 WXVL_AK2418SE0680 [0,0,0,1,0,0|3,0,0]=4 221 B20R3.5153540 O=C(NCCC1CCC1)c2cc3ncccc3[nH]2 WXVL_AK2418SE0680 [0,0,0,1,0,0|3,0,0]=4 222 B20R3.5153540 O=C(NCCC1CCC1)c2cn3cccnc3n2 WXVL_AK2418SE0332 [0,0,0,1,0,0|3,0,0]=4 223 B20R3.5153540 O=C(NCCC1CCC1)c2cn3cccnc3n2 WXVL_AK2418SE0332 [0,0,0,1,0,0|3,0,0]=4 224 B20R3.5153540 O=C(NCCC1CCC1)c2nc3ccccc3[nH]2 WXVL_AK2418SE0026 [0,0,0,1,0,0|3,0,0]=4 225 B20R3.5153540 O=C(NCCC1CCC1)c2nc3ccccc3[nH]2 WXVL_AK2418SE0026 [0,0,0,1,0,0|3,0,0]=4 226 B20R3.5153540 O=C(NCCC1CCC1)c2nc3ccccc3o2 WXVL_AK2418SE0704 [0,0,0,1,0,0|2,0,0]=3 227 B20R3.5153540 O=C(NCCC1CCC1)c2nc3ccccc3o2 WXVL_AK2418SE0704 [0,0,0,1,0,0|2,0,0]=3 228 B20R3.5153540 O=C(NCCC1CCC1)c2nc3ncccn3n2 WXVL_AK2418SE0103 [0,0,0,1,0,0|3,0,0]=4 229 B20R3.5153540 O=C(NCCC1CCC1)c2nc3ncccn3n2 WXVL_AK2418SE0103 [0,0,0,1,0,0|3,0,0]=4 230 B20R3.7033140 O=C(NCC1CCCC1)c2cc3ccccc3o2 WXVL_AK0303SE0105 [0,0,0,1,0,0|3,0,0]=4 231 B20R3.7033140 O=C(NCC1CCCC1)c2cc3ccccc3o2 WXVL_AK0303SE0105 [0,0,0,1,0,0|3,0,0]=4 232 B20R3.7033140 O=C(NCC1CCCC1)c2cc3cccnc3[nH]2 WXVL_AK0303SE0450 [0,0,0,1,0,0|2,0,1]=4 233 B20R3.7033140 O=C(NCC1CCCC1)c2cc3cccnc3[nH]2 WXVL_AK0303SE0450 [0,0,0,1,0,0|2,0,1]=4 234 B20R3.7033140 O=C(NCC1CCCC1)c2cc3cccnc3s2 WXVL_AK0303SE0061 [0,0,0,1,0,0|3,0,0]=4 235 B20R3.7033140 O=C(NCC1CCCC1)c2cc3cccnc3s2 WXVL_AK0303SE0061 [0,0,0,1,0,0|3,0,0]=4 236 B20R3.7033140 O=C(NCC1CCCC1)c2cc3cccnn3n2 WXVL_AK0303SC00097 [0,0,0,1,0,0|3,0,0]=4 237 B20R3.7033140 O=C(NCC1CCCC1)c2cc3cccnn3n2 WXVL_AK0303SC00097 [0,0,0,1,0,0|3,0,0]=4 238 B20R3.7033140 O=C(NCC1CCCC1)c2cc3ncccc3[nH]2 WXVL_AK0303SE0680 [0,0,0,1,0,0|3,0,0]=4 239 B20R3.7033140 O=C(NCC1CCCC1)c2cc3ncccc3[nH]2 WXVL_AK0303SE0680 [0,0,0,1,0,0|3,0,0]=4 240 B20R3.7033140 O=C(NCC1CCCC1)c2cn3cccnc3n2 WXVL_AK0303SE0332 [0,0,0,1,0,0|3,0,0]=4 241 B20R3.7033140 O=C(NCC1CCCC1)c2cn3cccnc3n2 WXVL_AK0303SE0332 [0,0,0,1,0,0|3,0,0]=4 242 B20R3.7033140 O=C(NCC1CCCC1)c2nc3ccccc3[nH]2 WXVL_AK0303SE0026 [0,0,0,1,0,0|3,0,0]=4 243 B20R3.7033140 O=C(NCC1CCCC1)c2nc3ccccc3[nH]2 WXVL_AK0303SE0026 [0,0,0,1,0,0|3,0,0]=4 244 B20R3.7033140 O=C(NCC1CCCC1)c2nc3ccccc3o2 WXVL_AK0303SE0704 [0,0,0,1,0,0|2,0,0]=3 245 B20R3.7033140 O=C(NCC1CCCC1)c2nc3ccccc3o2 WXVL_AK0303SE0704 [0,0,0,1,0,0|2,0,0]=3 246 B20R3.7033140 O=C(NCC1CCCC1)c2nc3ncccn3n2 WXVL_AK0303SE0103 [0,0,0,1,0,0|3,0,0]=4 247 B20R3.7033140 O=C(NCC1CCCC1)c2nc3ncccn3n2 WXVL_AK0303SE0103 [0,0,0,1,0,0|3,0,0]=4 248 B20R3.7033140 O=C(NCC1CCOC1)c2nc3ccccc3o2 WXVL_AK00634SE0704 [0,0,0,1,0,0|3,0,0]=4 249 B20R3.7033140 O=C(NCC1CCOC1)c2nc3ccccc3o2 WXVL_AK00634SE0704 [0,0,0,1,0,0|3,0,0]=4 250 B20R3.7033140 O=C(NC[C@@H]1CCCO1)c2nc3ccccc3o2 WXVL_AK00754SE0704 [0,0,0,1,0,0|3,0,0]=4 251 B20R3.7033140 O=C(NC[C@@H]1CCCO1)c2nc3ccccc3o2 WXVL_AK00754SE0704 [0,0,0,1,0,0|3,0,0]=4 252 B20R3.7033140 O=C(NC[C@H]1CCOC1)c2nc3ccccc3o2 WXVL_AK2110SE0704 [0,0,0,1,0,0|3,0,0]=4 253 B20R3.7033140 O=C(NC[C@H]1CCOC1)c2nc3ccccc3o2 WXVL_AK2110SE0704 [0,0,0,1,0,0|3,0,0]=4 254 B20R2.77707 CCCCCCCC(=O)Nc1cc2ccccc2[nH]1 WXVL_AF00292SB0393 [0,0,0,0,0,1|2,0,1]=4 255 B20R2.77707 CCCCCCCC(=O)Nc1cc2ccccc2[nH]1 WXVL_AF00292SB0393 [0,0,0,0,0,1|2,0,1]=4 256 B20R2.77707 CCCCCCCC(=O)Nc1cc2ccccc2s1 WXVL_AF0734SB0393 [0,0,0,0,0,1|2,1,0]=4 257 B20R2.77707 CCCCCCCC(=O)Nc1cc2ccccc2s1 WXVL_AF0734SB0393 [0,0,0,0,0,1|2,1,0]=4 258 B20R2.77707 CCCCCCCC(=O)Nc1cc2ccccn2n1 WXVL_AF2150SB0393 [0,0,0,0,0,1|3,0,0]=4 259 B20R2.77707 CCCCCCCC(=O)Nc1cc2ccccn2n1 WXVL_AF2150SB0393 [0,0,0,0,0,1|3,0,0]=4 260 B20R2.77707 CCCCCCCC(=O)Nc1cn2ccccc2n1 WXVL_AF1811SB0393 [0,0,0,0,0,1|3,0,0]=4 261 B20R2.77707 CCCCCCCC(=O)Nc1cn2ccccc2n1 WXVL_AF1811SB0393 [0,0,0,0,0,1|3,0,0]=4 262 B20R2.77707 CCCCCCCC(=O)Nc1nc2ccccc2[nH]1 WXVL_AF0204SB0393 [0,0,0,0,0,1|2,0,0]=3 263 B20R2.77707 CCCCCCCC(=O)Nc1nc2ccccc2[nH]1 WXVL_AF0204SB0393 [0,0,0,0,0,1|2,0,0]=3 264 B20R2.77707 CCCCCCCC(=O)Nc1nc2ccccc2s1 WXVL_AF0063SB0393 [0,0,0,0,0,1|1,1,0]=3 265 B20R2.77707 CCCCCCCC(=O)Nc1nc2ccccc2s1 WXVL_AF0063SB0393 [0,0,0,0,0,1|1,1,0]=3 266 B20R2.77707 CCCCCCCC(=O)Nc1nc2cccnc2s1 WXVL_AF2700SB0393 [0,0,0,0,0,1|2,0,0]=3 267 B20R2.77707 CCCCCCCC(=O)Nc1nc2cccnc2s1 WXVL_AF2700SB0393 [0,0,0,0,0,1|2,0,0]=3 268 B20R2.77707 O=C(CCCCCCBr)Nc1nc2ccccc2[nH]1 WXVL_AF0204SB1386 [0,0,0,0,0,1|3,0,0]=4 269 B20R2.77707 O=C(CCCCCCBr)Nc1nc2ccccc2[nH]1 WXVL_AF0204SB1386 [0,0,0,0,0,1|3,0,0]=4 270 B20R2.77707 O=C(CCCCCCBr)Nc1nc2ccccc2s1 WXVL_AF0063SB1386 [0,0,0,0,0,1|2,1,0]=4 271 B20R2.77707 O=C(CCCCCCBr)Nc1nc2ccccc2s1 WXVL_AF0063SB1386 [0,0,0,0,0,1|2,1,0]=4 272 B20R2.77707 O=C(CCCCCCBr)Nc1nc2cccnc2s1 WXVL_AF2700SB1386 [0,0,0,0,0,1|3,0,0]=4 273 B20R2.77707 O=C(CCCCCCBr)Nc1nc2cccnc2s1 WXVL_AF2700SB1386 [0,0,0,0,0,1|3,0,0]=4 274 B20R2.77740 CCCCCCCC(=O)N1CCc2cccnc2C1 WXVL_AN00388SB0393 [0,0,0,0,0,1|3,0,0]=4 275 B20R2.77740 CCCCCCCC(=O)N1CCc2cccnc2C1 WXVL_AN00388SB0393 [0,0,0,0,0,1|3,0,0]=4 276 B20R2.77740 CCCCCCCC(=O)N1CCc2ncccc2C1 WXVL_AN00470SB0393 [0,0,0,0,0,1|3,0,0]=4 277 B20R2.77740 CCCCCCCC(=O)N1CCc2ncccc2C1 WXVL_AN00470SB0393 [0,0,0,0,0,1|3,0,0]=4 278 B20R2.77740 CCCCCCNC(=O)c1cc2ccccc2cn1 WXVL_AK0286SE0464 [0,0,0,0,0,1|3,0,0]=4 279 B20R2.77740 CCCCCCNC(=O)c1cc2ccccc2cn1 WXVL_AK0286SE0464 [0,0,0,0,0,1|3,0,0]=4 280 B20R2.77740 CCCCCCNC(=O)c1ccc2ccccc2n1 WXVL_AK0286SE0005 [0,0,0,0,0,1|3,0,0]=4 281 B20R2.77740 CCCCCCNC(=O)c1ccc2ccccc2n1 WXVL_AK0286SE0005 [0,0,0,0,0,1|3,0,0]=4 282 B20R2.77740 CCCCCCNC(=O)c1ccc2cccnc2c1 WXVL_AK0286SE0111 [0,0,0,0,0,1|3,0,0]=4 283 B20R2.77740 CCCCCCNC(=O)c1ccc2cccnc2c1 WXVL_AK0286SE0111 [0,0,0,0,0,1|3,0,0]=4 284 B20R2.77740 CCCCCCNC(=O)c1ccc2cccnc2n1 WXVL_AK0286SE0284 [0,0,0,0,0,1|2,0,0]=3 285 B20R2.77740 CCCCCCNC(=O)c1ccc2cccnc2n1 WXVL_AK0286SE0284 [0,0,0,0,0,1|2,0,0]=3 286 B20R2.77740 CCCCCCNC(=O)c1ccc2ncccc2c1 WXVL_AK0286SE0022 [0,0,0,0,0,1|3,0,0]=4 287 B20R2.77740 CCCCCCNC(=O)c1ccc2ncccc2c1 WXVL_AK0286SE0022 [0,0,0,0,0,1|3,0,0]=4 288 B20R2.77740 CCCCCCNC(=O)c1cnc2ccccc2c1 WXVL_AK0286SE0006 [0,0,0,0,0,1|3,0,0]=4 289 B20R2.77740 CCCCCCNC(=O)c1cnc2ccccc2c1 WXVL_AK0286SE0006 [0,0,0,0,0,1|3,0,0]=4 290 B20R2.77740 CCCCCCNC(=O)c1cnc2ccccc2n1 WXVL_AK0286SE0009 [0,0,0,0,0,1|3,0,0]=4 291 B20R2.77740 CCCCCCNC(=O)c1cnc2ccccc2n1 WXVL_AK0286SE0009 [0,0,0,0,0,1|3,0,0]=4 292 B20R2.77740 CCOCCCNC(=O)c1ccc2cccnc2n1 WXVL_AK0072SE0284 [0,0,0,0,0,1|3,0,0]=4 293 B20R2.77740 CCOCCCNC(=O)c1ccc2cccnc2n1 WXVL_AK0072SE0284 [0,0,0,0,0,1|3,0,0]=4 294 B20R2.77740 O=C(NCCCCCO)c1ccc2cccnc2n1 WXVL_AK0077SE0284 [0,0,0,0,0,1|3,0,0]=4 295 B20R2.77740 O=C(NCCCCCO)c1ccc2cccnc2n1 WXVL_AK0077SE0284 [0,0,0,0,0,1|3,0,0]=4 296 B17R1.1287 CCCCCCCC(=O)NCc1ccccn1 WXVL_AK0018SB0393 [1,0,1,0,0,0|2,0,0]=4 297 B17R1.1287 CCCCCCCC(=O)NCc1ccccn1 WXVL_AK0018SB0393 [1,0,1,0,0,0|2,0,0]=4 298 B17R1.1287 CCCCCCCC(=O)NCc1cccnc1 WXVL_AK0020SB0393 [1,0,1,0,0,0|2,0,0]=4 299 B17R1.1287 CCCCCCCC(=O)NCc1cccnc1 WXVL_AK0020SB0393 [1,0,1,0,0,0|2,0,0]=4 300 B17R1.1287 CCCCCCNC(=O)/C=C/c1cccnc1 WXVL_AK0286SA0193 [1,0,1,0,0,0|2,0,0]=4 301 B17R1.1287 CCCCCCNC(=O)/C=C/c1cccnc1 WXVL_AK0286SA0193 [1,0,1,0,0,0|2,0,0]=4 302 B17R1.1287 CCCCCCNC(=O)COc1cccnc1 WXVL_AK0286SA0051 [1,0,1,0,0,0|1,0,1]=4 303 B17R1.1287 CCCCCCNC(=O)COc1cccnc1 WXVL_AK0286SA0051 [1,0,1,0,0,0|1,0,1]=4 304 B17R2.2322 CCCCNC(=O)c1nc2ccccc2o1 WXVL_AK00588SE0704 [2,0,0,0,0,0|2,0,0]=4 305 B17R2.2322 CCCCNC(=O)c1nc2ccccc2o1 WXVL_AK00588SE0704 [2,0,0,0,0,0|2,0,0]=4 306 B19R2.20982 CCCCCNC(=O)c1cc2nc(ccc2o1)C WXVL_AK0076SC00024 [1,1,0,0,0,0|2,0,0]=4 307 B19R2.20982 CCCCCNC(=O)c1cc2nc(ccc2o1)C WXVL_AK0076SC00024 [1,1,0,0,0,0|2,0,0]=4 308 B21R2.67336 CCCCCCCCC(=O)Nc1nc2ccccc2[nH]1 WXVL_AF0204SB0409 [0,1,0,0,0,1|2,0,0]=4 309 B21R2.67336 CCCCCCCCC(=O)Nc1nc2ccccc2[nH]1 WXVL_AF0204SB0409 [0,1,0,0,0,1|2,0,0]=4 310 B21R2.67336 CCCCCCCCC(=O)Nc1nc2ccccc2s1 WXVL_AF0063SB0409 [0,1,0,0,0,1|1,1,0]=4 311 B21R2.67336 CCCCCCCCC(=O)Nc1nc2ccccc2s1 WXVL_AF0063SB0409 [0,1,0,0,0,1|1,1,0]=4 312 B21R2.67336 CCCCCCCCC(=O)Nc1nc2cccnc2s1 WXVL_AF2700SB0409 [0,1,0,0,0,1|2,0,0]=4 313 B21R2.67336 CCCCCCCCC(=O)Nc1nc2cccnc2s1 WXVL_AF2700SB0409 [0,1,0,0,0,1|2,0,0]=4 314 B21R2.67336 O=C(CCCCCCCBr)Nc1nc2ccccc2[nH]1 WXVL_AF0204SB0559 [0,1,0,0,0,1|2,0,0]=4 315 B21R2.67336 O=C(CCCCCCCBr)Nc1nc2ccccc2[nH]1 WXVL_AF0204SB0559 [0,1,0,0,0,1|2,0,0]=4 316 B21R2.67336 O=C(CCCCCCCBr)Nc1nc2ccccc2s1 WXVL_AF0063SB0559 [0,1,0,0,0,1|1,1,0]=4 317 B21R2.67336 O=C(CCCCCCCBr)Nc1nc2ccccc2s1 WXVL_AF0063SB0559 [0,1,0,0,0,1|1,1,0]=4 318 B21R2.67336 O=C(CCCCCCCBr)Nc1nc2cccnc2s1 WXVL_AF2700SB0559 [0,1,0,0,0,1|2,0,0]=4 319 B21R2.67336 O=C(CCCCCCCBr)Nc1nc2cccnc2s1 WXVL_AF2700SB0559 [0,1,0,0,0,1|2,0,0]=4 320 B21R2.67336 O=C(CCCCCCCO)Nc1nc2ccccc2[nH]1 WXVL_AF0204SB1306 [0,1,0,0,0,1|2,0,0]=4 321 B21R2.67336 O=C(CCCCCCCO)Nc1nc2ccccc2[nH]1 WXVL_AF0204SB1306 [0,1,0,0,0,1|2,0,0]=4 322 B21R2.67336 O=C(CCCCCCCO)Nc1nc2ccccc2s1 WXVL_AF0063SB1306 [0,1,0,0,0,1|1,1,0]=4 323 B21R2.67336 O=C(CCCCCCCO)Nc1nc2ccccc2s1 WXVL_AF0063SB1306 [0,1,0,0,0,1|1,1,0]=4 324 B21R2.67336 O=C(CCCCCCCO)Nc1nc2cccnc2s1 WXVL_AF2700SB1306 [0,1,0,0,0,1|2,0,0]=4 325 B21R2.67336 O=C(CCCCCCCO)Nc1nc2cccnc2s1 WXVL_AF2700SB1306 [0,1,0,0,0,1|2,0,0]=4 326 B21R2.111305 CCCCCCCC(=O)Nc1nc2ccccc2n1C WXVL_AF0191SB0393 [0,1,0,0,0,1|2,0,0]=4 327 B21R2.111305 CCCCCCCC(=O)Nc1nc2ccccc2n1C WXVL_AF0191SB0393 [0,1,0,0,0,1|2,0,0]=4 328 B21R2.275468 CCCCCCCC(=O)Nc1nc2cc(ccc2o1)Br WXVL_AF0254SB0393 [0,1,0,0,0,1|1,0,0]=3 329 B21R2.275468 CCCCCCCC(=O)Nc1nc2cc(ccc2o1)Br WXVL_AF0254SB0393 [0,1,0,0,0,1|1,0,0]=3 330 B21R2.275468 CCCCCCCC(=O)Nc1nc2cc(ccc2s1)C WXVL_AF0205SB0393 [0,1,0,0,0,1|1,1,0]=4 331 B21R2.275468 CCCCCCCC(=O)Nc1nc2cc(ccc2s1)C WXVL_AF0205SB0393 [0,1,0,0,0,1|1,1,0]=4 332 B21R2.275468 CCCCCCCC(=O)Nc1nc2cc(ccc2s1)Cl WXVL_AF2689SB0393 [0,1,0,0,0,1|1,1,0]=4 333 B21R2.275468 CCCCCCCC(=O)Nc1nc2cc(ccc2s1)Cl WXVL_AF2689SB0393 [0,1,0,0,0,1|1,1,0]=4 334 B21R2.275468 CCCCCCCC(=O)Nc1nc2cc(ccc2s1)F WXVL_AF3394SB0393 [0,1,0,0,0,1|1,1,0]=4 335 B21R2.275468 CCCCCCCC(=O)Nc1nc2cc(ccc2s1)F WXVL_AF3394SB0393 [0,1,0,0,0,1|1,1,0]=4 336 B21R2.275468 CCCCCCCC(=O)Nc1nc2cc(cnc2[nH]1)Br WXVL_AF00282SB0393 [0,1,0,0,0,1|1,0,1]=4 337 B21R2.275468 CCCCCCCC(=O)Nc1nc2cc(cnc2[nH]1)Br WXVL_AF00282SB0393 [0,1,0,0,0,1|1,0,1]=4 338 B21R2.275468 CCCCCCCC(=O)Nc1nc2ccc(cc2[nH]1)C WXVL_AF0282SB0393 [0,1,0,0,0,1|2,0,0]=4 339 B21R2.275468 CCCCCCCC(=O)Nc1nc2ccc(cc2[nH]1)C WXVL_AF0282SB0393 [0,1,0,0,0,1|2,0,0]=4 340 B21R2.275468 CCCCCCCC(=O)Nc1nc2ccc(cc2[nH]1)Cl WXVL_AF00010SB0393 [0,1,0,0,0,1|2,0,0]=4 341 B21R2.275468 CCCCCCCC(=O)Nc1nc2ccc(cc2[nH]1)Cl WXVL_AF00010SB0393 [0,1,0,0,0,1|2,0,0]=4 342 B21R2.275468 CCCCCCCC(=O)Nc1nc2ccc(cc2o1)Br WXVL_AF3022SB0393 [0,1,0,0,0,1|1,0,0]=3 343 B21R2.275468 CCCCCCCC(=O)Nc1nc2ccc(cc2o1)Br WXVL_AF3022SB0393 [0,1,0,0,0,1|1,0,0]=3 344 B21R2.275468 CCCCCCCC(=O)Nc1nc2ccc(cc2o1)I WXVL_AF5006SB0393 [0,1,0,0,0,1|1,0,0]=3 345 B21R2.275468 CCCCCCCC(=O)Nc1nc2ccc(cc2o1)I WXVL_AF5006SB0393 [0,1,0,0,0,1|1,0,0]=3 346 B21R2.275468 CCCCCCCC(=O)Nc1nc2ccc(cc2s1)Br WXVL_AF0229SB0393 [0,1,0,0,0,1|1,1,0]=4 347 B21R2.275468 CCCCCCCC(=O)Nc1nc2ccc(cc2s1)Br WXVL_AF0229SB0393 [0,1,0,0,0,1|1,1,0]=4 348 B21R2.275468 CCCCCCCC(=O)Nc1nc2ccc(cc2s1)C WXVL_AF0267SB0393 [0,1,0,0,0,1|1,1,0]=4 349 B21R2.275468 CCCCCCCC(=O)Nc1nc2ccc(cc2s1)C WXVL_AF0267SB0393 [0,1,0,0,0,1|1,1,0]=4 350 B21R2.275468 O=C(CCCCCCBr)Nc1nc2cc(ccc2o1)Br WXVL_AF0254SB1386 [0,1,0,0,0,1|2,0,0]=4 351 B21R2.275468 O=C(CCCCCCBr)Nc1nc2cc(ccc2o1)Br WXVL_AF0254SB1386 [0,1,0,0,0,1|2,0,0]=4 352 B21R2.275468 O=C(CCCCCCBr)Nc1nc2ccc(cc2o1)Br WXVL_AF3022SB1386 [0,1,0,0,0,1|2,0,0]=4 353 B21R2.275468 O=C(CCCCCCBr)Nc1nc2ccc(cc2o1)Br WXVL_AF3022SB1386 [0,1,0,0,0,1|2,0,0]=4 354 B21R2.275468 O=C(CCCCCCBr)Nc1nc2ccc(cc2o1)I WXVL_AF5006SB1386 [0,1,0,0,0,1|2,0,0]=4 355 B21R2.275468 O=C(CCCCCCBr)Nc1nc2ccc(cc2o1)I WXVL_AF5006SB1386 [0,1,0,0,0,1|2,0,0]=4 356 B21R2.275473 CCCCCCCC(=O)Nc1nc2c(cccc2o1)O WXVL_AF4655SB0393 [0,1,0,0,0,1|1,0,0]=3 357 B21R2.275473 CCCCCCCC(=O)Nc1nc2c(cccc2o1)O WXVL_AF4655SB0393 [0,1,0,0,0,1|1,0,0]=3 358 B21R2.275473 CCCCCCCC(=O)Nc1nc2c(cccc2s1)Br WXVL_AF3331SB0393 [0,1,0,0,0,1|1,1,0]=4 359 B21R2.275473 CCCCCCCC(=O)Nc1nc2c(cccc2s1)Br WXVL_AF3331SB0393 [0,1,0,0,0,1|1,1,0]=4 360 B21R2.275473 CCCCCCCC(=O)Nc1nc2c(cccc2s1)C WXVL_AF0121SB0393 [0,1,0,0,0,1|1,1,0]=4 361 B21R2.275473 CCCCCCCC(=O)Nc1nc2c(cccc2s1)C WXVL_AF0121SB0393 [0,1,0,0,0,1|1,1,0]=4 362 B21R2.275473 CCCCCCCC(=O)Nc1nc2cccc(c2s1)Br WXVL_AF0290SB0393 [0,1,0,0,0,1|1,1,0]=4 363 B21R2.275473 CCCCCCCC(=O)Nc1nc2cccc(c2s1)Br WXVL_AF0290SB0393 [0,1,0,0,0,1|1,1,0]=4 364 B21R2.275473 CCCCCCCC(=O)Nc1nc2cccc(c2s1)Cl WXVL_AF0186SB0393 [0,1,0,0,0,1|1,1,0]=4 365 B21R2.275473 CCCCCCCC(=O)Nc1nc2cccc(c2s1)Cl WXVL_AF0186SB0393 [0,1,0,0,0,1|1,1,0]=4 366 B21R2.275473 O=C(CCCCCCBr)Nc1nc2c(cccc2o1)O WXVL_AF4655SB1386 [0,1,0,0,0,1|2,0,0]=4 367 B21R2.275473 O=C(CCCCCCBr)Nc1nc2c(cccc2o1)O WXVL_AF4655SB1386 [0,1,0,0,0,1|2,0,0]=4 368 B21R2.278445 CCCCC(C)CCC(=O)Nc1nc2ccccc2[nH]1 WXVL_AF0204SB1315 [0,1,0,0,0,1|2,0,0]=4 369 B21R2.278445 CCCCC(C)CCC(=O)Nc1nc2ccccc2[nH]1 WXVL_AF0204SB1315 [0,1,0,0,0,1|2,0,0]=4 370 B21R2.278445 CCCCC(C)CCC(=O)Nc1nc2ccccc2s1 WXVL_AF0063SB1315 [0,1,0,0,0,1|1,1,0]=4 371 B21R2.278445 CCCCC(C)CCC(=O)Nc1nc2ccccc2s1 WXVL_AF0063SB1315 [0,1,0,0,0,1|1,1,0]=4 372 B21R2.278445 CCCCC(C)CCC(=O)Nc1nc2cccnc2s1 WXVL_AF2700SB1315 [0,1,0,0,0,1|2,0,0]=4 373 B21R2.278445 CCCCC(C)CCC(=O)Nc1nc2cccnc2s1 WXVL_AF2700SB1315 [0,1,0,0,0,1|2,0,0]=4 374 B21R2.67369 CCCCOCCNC(=O)c1ccc2cccnc2n1 WXVL_AK9674SE0284 [0,1,0,0,0,1|2,0,0]=4 375 B21R2.67369 CCCCOCCNC(=O)c1ccc2cccnc2n1 WXVL_AK9674SE0284 [0,1,0,0,0,1|2,0,0]=4 376 B21R2.67369 O=C(NCCCCCCO)c1ccc2cccnc2n1 WXVL_AK0751SE0284 [0,1,0,0,0,1|2,0,0]=4 377 B21R2.67369 O=C(NCCCCCCO)c1ccc2cccnc2n1 WXVL_AK0751SE0284 [0,1,0,0,0,1|2,0,0]=4 378 B21R2.3306393 CCCCCCNC(=O)c1cc2cccnc2nc1O WXVL_AK0286SE0731 [0,1,0,0,0,1|2,0,0]=4 379 B21R2.3306393 CCCCCCNC(=O)c1cc2cccnc2nc1O WXVL_AK0286SE0731 [0,1,0,0,0,1|2,0,0]=4 380 B21R2.254227 CC(C)CCCC(C)NC(=O)c1nc2ccccc2o1 WXVL_AK00574SE0704 [0,2,0,0,0,0|2,0,0]=4 381 B21R2.254227 CC(C)CCCC(C)NC(=O)c1nc2ccccc2o1 WXVL_AK00574SE0704 [0,2,0,0,0,0|2,0,0]=4 382 B21R2.67357 CCCCOCCNC(=O)c1cc2nc(ccc2o1)C WXVL_AK9674SC00024 [0,2,0,0,0,0|2,0,0]=4 383 B21R2.67357 CCCCOCCNC(=O)c1cc2nc(ccc2o1)C WXVL_AK9674SC00024 [0,2,0,0,0,0|2,0,0]=4 384 B21R2.67357 Cc1ccc2oc(cc2n1)C(=O)NCCCCCCO WXVL_AK0751SC00024 [0,2,0,0,0,0|2,0,0]=4 385 B21R2.67357 Cc1ccc2oc(cc2n1)C(=O)NCCCCCCO WXVL_AK0751SC00024 [0,2,0,0,0,0|2,0,0]=4 386 B21R2.257473 CN(C)CCCCCNC(=O)c1nc2ccccc2o1 WXVL_AK0956SE0704 [0,2,0,0,0,0|2,0,0]=4 387 B21R2.257473 CN(C)CCCCCNC(=O)c1nc2ccccc2o1 WXVL_AK0956SE0704 [0,2,0,0,0,0|2,0,0]=4 388 B21R2.282343 CCCCCCCCNC(=O)c1cc2ccccc2o1 WXVL_AK1818SE0105 [0,2,0,0,0,0|2,0,0]=4 389 B21R2.282343 CCCCCCCCNC(=O)c1cc2ccccc2o1 WXVL_AK1818SE0105 [0,2,0,0,0,0|2,0,0]=4 390 B21R2.282343 CCCCCCCCNC(=O)c1cc2cccnc2[nH]1 WXVL_AK1818SE0450 [0,2,0,0,0,0|1,0,1]=4 391 B21R2.282343 CCCCCCCCNC(=O)c1cc2cccnc2[nH]1 WXVL_AK1818SE0450 [0,2,0,0,0,0|1,0,1]=4 392 B21R2.282343 CCCCCCCCNC(=O)c1cc2cccnc2s1 WXVL_AK1818SE0061 [0,2,0,0,0,0|2,0,0]=4 393 B21R2.282343 CCCCCCCCNC(=O)c1cc2cccnc2s1 WXVL_AK1818SE0061 [0,2,0,0,0,0|2,0,0]=4 394 B21R2.282343 CCCCCCCCNC(=O)c1cc2cccnn2n1 WXVL_AK1818SC00097 [0,2,0,0,0,0|2,0,0]=4 395 B21R2.282343 CCCCCCCCNC(=O)c1cc2cccnn2n1 WXVL_AK1818SC00097 [0,2,0,0,0,0|2,0,0]=4 396 B21R2.282343 CCCCCCCCNC(=O)c1cc2ncccc2[nH]1 WXVL_AK1818SE0680 [0,2,0,0,0,0|2,0,0]=4 397 B21R2.282343 CCCCCCCCNC(=O)c1cc2ncccc2[nH]1 WXVL_AK1818SE0680 [0,2,0,0,0,0|2,0,0]=4 398 B21R2.282343 CCCCCCCCNC(=O)c1cn2cccnc2n1 WXVL_AK1818SE0332 [0,2,0,0,0,0|2,0,0]=4 399 B21R2.282343 CCCCCCCCNC(=O)c1cn2cccnc2n1 WXVL_AK1818SE0332 [0,2,0,0,0,0|2,0,0]=4 400 B21R2.282343 CCCCCCCCNC(=O)c1nc2ccccc2[nH]1 WXVL_AK1818SE0026 [0,2,0,0,0,0|2,0,0]=4 401 B21R2.282343 CCCCCCCCNC(=O)c1nc2ccccc2[nH]1 WXVL_AK1818SE0026 [0,2,0,0,0,0|2,0,0]=4 402 B21R2.282343 CCCCCCCCNC(=O)c1nc2ccccc2o1 WXVL_AK1818SE0704 [0,2,0,0,0,0|1,0,0]=3 403 B21R2.282343 CCCCCCCCNC(=O)c1nc2ccccc2o1 WXVL_AK1818SE0704 [0,2,0,0,0,0|1,0,0]=3 404 B21R2.282343 CCCCCCCCNC(=O)c1nc2ncccn2n1 WXVL_AK1818SE0103 [0,2,0,0,0,0|2,0,0]=4 405 B21R2.282343 CCCCCCCCNC(=O)c1nc2ncccn2n1 WXVL_AK1818SE0103 [0,2,0,0,0,0|2,0,0]=4 406 B21R2.282343 CCCCOCCCNC(=O)c1cc2ccccc2o1 WXVL_AK2310SE0105 [0,2,0,0,0,0|2,0,0]=4 407 B21R2.282343 CCCCOCCCNC(=O)c1cc2ccccc2o1 WXVL_AK2310SE0105 [0,2,0,0,0,0|2,0,0]=4 408 B21R2.282343 CCCCOCCCNC(=O)c1cc2cccnc2[nH]1 WXVL_AK2310SE0450 [0,2,0,0,0,0|1,0,1]=4 409 B21R2.282343 CCCCOCCCNC(=O)c1cc2cccnc2[nH]1 WXVL_AK2310SE0450 [0,2,0,0,0,0|1,0,1]=4 410 B21R2.282343 CCCCOCCCNC(=O)c1cc2cccnc2s1 WXVL_AK2310SE0061 [0,2,0,0,0,0|2,0,0]=4 411 B21R2.282343 CCCCOCCCNC(=O)c1cc2cccnc2s1 WXVL_AK2310SE0061 [0,2,0,0,0,0|2,0,0]=4 412 B21R2.282343 CCCCOCCCNC(=O)c1cc2cccnn2n1 WXVL_AK2310SC00097 [0,2,0,0,0,0|2,0,0]=4 413 B21R2.282343 CCCCOCCCNC(=O)c1cc2cccnn2n1 WXVL_AK2310SC00097 [0,2,0,0,0,0|2,0,0]=4 414 B21R2.282343 CCCCOCCCNC(=O)c1cc2ncccc2[nH]1 WXVL_AK2310SE0680 [0,2,0,0,0,0|2,0,0]=4 415 B21R2.282343 CCCCOCCCNC(=O)c1cc2ncccc2[nH]1 WXVL_AK2310SE0680 [0,2,0,0,0,0|2,0,0]=4 416 B21R2.282343 CCCCOCCCNC(=O)c1cn2cccnc2n1 WXVL_AK2310SE0332 [0,2,0,0,0,0|2,0,0]=4 417 B21R2.282343 CCCCOCCCNC(=O)c1cn2cccnc2n1 WXVL_AK2310SE0332 [0,2,0,0,0,0|2,0,0]=4 418 B21R2.282343 CCCCOCCCNC(=O)c1nc2ccccc2[nH]1 WXVL_AK2310SE0026 [0,2,0,0,0,0|2,0,0]=4 419 B21R2.282343 CCCCOCCCNC(=O)c1nc2ccccc2[nH]1 WXVL_AK2310SE0026 [0,2,0,0,0,0|2,0,0]=4 420 B21R2.282343 CCCCOCCCNC(=O)c1nc2ccccc2o1 WXVL_AK2310SE0704 [0,2,0,0,0,0|1,0,0]=3 421 B21R2.282343 CCCCOCCCNC(=O)c1nc2ccccc2o1 WXVL_AK2310SE0704 [0,2,0,0,0,0|1,0,0]=3 422 B21R2.282343 CCCCOCCCNC(=O)c1nc2ncccn2n1 WXVL_AK2310SE0103 [0,2,0,0,0,0|2,0,0]=4 423 B21R2.282343 CCCCOCCCNC(=O)c1nc2ncccn2n1 WXVL_AK2310SE0103 [0,2,0,0,0,0|2,0,0]=4 424 B19R3.2205563 C[C@@H]1CCCN1C(=O)c2nc3ccccc3o2 WXVL_AN00593SE0704 [1,0,0,1,0,0|2,0,0]=4 425 B19R3.6033278 O=C(NCCC1CC1)c2nc3ccccc3o2 WXVL_AK00594SE0704 [1,0,0,1,0,0|2,0,0]=4 426 B19R3.6033278 O=C(NCCC1CC1)c2nc3ccccc3o2 WXVL_AK00594SE0704 [1,0,0,1,0,0|2,0,0]=4 427 B19R3.6033511 O=C(NCC1CCC1)c2nc3ccccc3o2 WXVL_AK00492SE0704 [1,0,0,1,0,0|2,0,0]=4 428 B19R3.6033511 O=C(NCC1CCC1)c2nc3ccccc3o2 WXVL_AK00492SE0704 [1,0,0,1,0,0|2,0,0]=4 429 B21R3.8008928 O=C(Nc1nc2ccccc2[nH]1)C3CCCCCC3 WXVL_AF0204SB0385 [0,0,0,1,0,1|2,0,0]=4 430 B21R3.8008928 O=C(Nc1nc2ccccc2[nH]1)C3CCCCCC3 WXVL_AF0204SB0385 [0,0,0,1,0,1|2,0,0]=4 431 B21R3.8008928 O=C(Nc1nc2ccccc2s1)C3CCCCCC3 WXVL_AF0063SB0385 [0,0,0,1,0,1|1,1,0]=4 432 B21R3.8008928 O=C(Nc1nc2ccccc2s1)C3CCCCCC3 WXVL_AF0063SB0385 [0,0,0,1,0,1|1,1,0]=4 433 B21R3.8008928 O=C(Nc1nc2cccnc2s1)C3CCCCCC3 WXVL_AF2700SB0385 [0,0,0,1,0,1|2,0,0]=4 434 B21R3.8008928 O=C(Nc1nc2cccnc2s1)C3CCCCCC3 WXVL_AF2700SB0385 [0,0,0,1,0,1|2,0,0]=4 435 B21R3.12044519 O=C(CCC1CCCC1)Nc2nc3ccccc3[nH]2 WXVL_AF0204SB0045 [0,0,0,1,0,1|2,0,0]=4 436 B21R3.12044519 O=C(CCC1CCCC1)Nc2nc3ccccc3[nH]2 WXVL_AF0204SB0045 [0,0,0,1,0,1|2,0,0]=4 437 B21R3.12044519 O=C(CCC1CCCC1)Nc2nc3ccccc3s2 WXVL_AF0063SB0045 [0,0,0,1,0,1|1,1,0]=4 438 B21R3.12044519 O=C(CCC1CCCC1)Nc2nc3ccccc3s2 WXVL_AF0063SB0045 [0,0,0,1,0,1|1,1,0]=4 439 B21R3.12044519 O=C(CCC1CCCC1)Nc2nc3cccnc3s2 WXVL_AF2700SB0045 [0,0,0,1,0,1|2,0,0]=4 440 B21R3.12044519 O=C(CCC1CCCC1)Nc2nc3cccnc3s2 WXVL_AF2700SB0045 [0,0,0,1,0,1|2,0,0]=4 441 B21R3.24438 O=C(NC1CCCCC1)c2ccc3cccnc3n2 WXVL_AK00480SE0284 [0,0,0,1,0,1|2,0,0]=4 442 B21R3.24438 O=C(NC1CCCCC1)c2ccc3cccnc3n2 WXVL_AK00480SE0284 [0,0,0,1,0,1|2,0,0]=4 443 B21R3.159209 C[C@H]1CCCCN1C(=O)c2ccc3cccnc3n2 WXVL_AN00851SE0284 [0,0,0,1,0,1|2,0,0]=4 444 B21R3.520768 O=C(NCCC1CCC1)c2ccc3cccnc3n2 WXVL_AK2418SE0284 [0,0,0,1,0,1|2,0,0]=4 445 B21R3.520768 O=C(NCCC1CCC1)c2ccc3cccnc3n2 WXVL_AK2418SE0284 [0,0,0,1,0,1|2,0,0]=4 446 B21R3.2280498 O=C(NCC1CCCC1)c2ccc3cccnc3n2 WXVL_AK0303SE0284 [0,0,0,1,0,1|2,0,0]=4 447 B21R3.2280498 O=C(NCC1CCCC1)c2ccc3cccnc3n2 WXVL_AK0303SE0284 [0,0,0,1,0,1|2,0,0]=4 448 B21R3.468356 C[C@H]1CCC[C@H](N1C(=O)c2nc3ccccc3o2)C WXVL_AN3062SE0704 [0,1,0,1,0,0|2,0,0]=4 449 B21R3.7440939 O=C(N[C@H]1CCC[C@H](C1)O)c2nc3ccccc3o2 WXVL_AK2614SE0704 [0,1,0,1,0,0|2,0,0]=4 450 B21R3.7440939 O=C(N[C@H]1CCC[C@H](C1)O)c2nc3ccccc3o2 WXVL_AK2614SE0704 [0,1,0,1,0,0|2,0,0]=4 451 B21R3.147573735 CC1(CCCCC1)NC(=O)c2nc3ccccc3o2 WXVL_AK0295SE0704 [0,1,0,1,0,0|2,0,0]=4 452 B21R3.147573735 CC1(CCCCC1)NC(=O)c2nc3ccccc3o2 WXVL_AK0295SE0704 [0,1,0,1,0,0|2,0,0]=4 453 B21R3.2280253 O=C(NCC1CCCCO1)c2nc3ccccc3o2 WXVL_AK1232SE0704 [0,1,0,1,0,0|2,0,0]=4 454 B21R3.2280253 O=C(NCC1CCCCO1)c2nc3ccccc3o2 WXVL_AK1232SE0704 [0,1,0,1,0,0|2,0,0]=4 455 B21R3.2280253 O=C(NCC1CCCOC1)c2nc3ccccc3o2 WXVL_AK00150SE0704 [0,1,0,1,0,0|2,0,0]=4 456 B21R3.2280253 O=C(NCC1CCCOC1)c2nc3ccccc3o2 WXVL_AK00150SE0704 [0,1,0,1,0,0|2,0,0]=4 457 B21R3.2280253 O=C(NCC1CCOCC1)c2nc3ccccc3o2 WXVL_AK0150SE0704 [0,1,0,1,0,0|2,0,0]=4 458 B21R3.2280253 O=C(NCC1CCOCC1)c2nc3ccccc3o2 WXVL_AK0150SE0704 [0,1,0,1,0,0|2,0,0]=4 459 B21R3.2280253 O=C(NCC1CCSCC1)c2nc3ccccc3o2 WXVL_AK00654SE0704 [0,1,0,1,0,0|2,0,0]=4 460 B21R3.2280253 O=C(NCC1CCSCC1)c2nc3ccccc3o2 WXVL_AK00654SE0704 [0,1,0,1,0,0|2,0,0]=4 461 B21R3.2838524 O=C(c1nc2ccccc2o1)N3CCCCC3CO WXVL_AN0018SE0704 [0,1,0,1,0,0|2,0,0]=4 462 B21R3.2838524 O=C(c1nc2ccccc2o1)N3CCCCC3CO WXVL_AN0018SE0704 [0,1,0,1,0,0|2,0,0]=4 463 B21R3.4026275 CN1CCC[C@H]1CNC(=O)c2nc3ccccc3o2 WXVL_AK00784SE0704 [0,1,0,1,0,0|2,0,0]=4 464 B21R3.4026275 CN1CCC[C@H]1CNC(=O)c2nc3ccccc3o2 WXVL_AK00784SE0704 [0,1,0,1,0,0|2,0,0]=4 465 B21R3.43746572 O=C(NCCC1CCCC1)c2cc3ccccc3o2 WXVL_AK00531SE0105 [0,1,0,1,0,0|2,0,0]=4 466 B21R3.43746572 O=C(NCCC1CCCC1)c2cc3ccccc3o2 WXVL_AK00531SE0105 [0,1,0,1,0,0|2,0,0]=4 467 B21R3.43746572 O=C(NCCC1CCCC1)c2cc3cccnc3[nH]2 WXVL_AK00531SE0450 [0,1,0,1,0,0|1,0,1]=4 468 B21R3.43746572 O=C(NCCC1CCCC1)c2cc3cccnc3[nH]2 WXVL_AK00531SE0450 [0,1,0,1,0,0|1,0,1]=4 469 B21R3.43746572 O=C(NCCC1CCCC1)c2cc3cccnc3s2 WXVL_AK00531SE0061 [0,1,0,1,0,0|2,0,0]=4 470 B21R3.43746572 O=C(NCCC1CCCC1)c2cc3cccnc3s2 WXVL_AK00531SE0061 [0,1,0,1,0,0|2,0,0]=4 471 B21R3.43746572 O=C(NCCC1CCCC1)c2cc3cccnn3n2 WXVL_AK00531SC00097 [0,1,0,1,0,0|2,0,0]=4 472 B21R3.43746572 O=C(NCCC1CCCC1)c2cc3cccnn3n2 WXVL_AK00531SC00097 [0,1,0,1,0,0|2,0,0]=4 473 B21R3.43746572 O=C(NCCC1CCCC1)c2cc3ncccc3[nH]2 WXVL_AK00531SE0680 [0,1,0,1,0,0|2,0,0]=4 474 B21R3.43746572 O=C(NCCC1CCCC1)c2cc3ncccc3[nH]2 WXVL_AK00531SE0680 [0,1,0,1,0,0|2,0,0]=4 475 B21R3.43746572 O=C(NCCC1CCCC1)c2cn3cccnc3n2 WXVL_AK00531SE0332 [0,1,0,1,0,0|2,0,0]=4 476 B21R3.43746572 O=C(NCCC1CCCC1)c2cn3cccnc3n2 WXVL_AK00531SE0332 [0,1,0,1,0,0|2,0,0]=4 477 B21R3.43746572 O=C(NCCC1CCCC1)c2nc3ccccc3[nH]2 WXVL_AK00531SE0026 [0,1,0,1,0,0|2,0,0]=4 478 B21R3.43746572 O=C(NCCC1CCCC1)c2nc3ccccc3[nH]2 WXVL_AK00531SE0026 [0,1,0,1,0,0|2,0,0]=4 479 B21R3.43746572 O=C(NCCC1CCCC1)c2nc3ccccc3o2 WXVL_AK00531SE0704 [0,1,0,1,0,0|1,0,0]=3 480 B21R3.43746572 O=C(NCCC1CCCC1)c2nc3ccccc3o2 WXVL_AK00531SE0704 [0,1,0,1,0,0|1,0,0]=3 481 B21R3.43746572 O=C(NCCC1CCCC1)c2nc3ncccn3n2 WXVL_AK00531SE0103 [0,1,0,1,0,0|2,0,0]=4 482 B21R3.43746572 O=C(NCCC1CCCC1)c2nc3ncccn3n2 WXVL_AK00531SE0103 [0,1,0,1,0,0|2,0,0]=4 483 B21R3.154829 Cc1ccc2oc(cc2n1)C(=O)NC3CCCCC3 WXVL_AK00480SC00024 [0,1,0,1,0,0|2,0,0]=4 484 B21R3.154829 Cc1ccc2oc(cc2n1)C(=O)NC3CCCCC3 WXVL_AK00480SC00024 [0,1,0,1,0,0|2,0,0]=4 485 B21R3.3871506 Cc1ccc2oc(cc2n1)C(=O)N3CCCC[C@@H]3C WXVL_AN00851SC00024 [0,1,0,1,0,0|2,0,0]=4 486 B21R3.4729881 Cc1ccc2oc(cc2n1)C(=O)NCC3CCCC3 WXVL_AK0303SC00024 [0,1,0,1,0,0|2,0,0]=4 487 B21R3.4729881 Cc1ccc2oc(cc2n1)C(=O)NCC3CCCC3 WXVL_AK0303SC00024 [0,1,0,1,0,0|2,0,0]=4 488 B21R3.23440593 Cc1ccc2oc(cc2n1)C(=O)NCCC3CCC3 WXVL_AK2418SC00024 [0,1,0,1,0,0|2,0,0]=4 489 B21R3.23440593 Cc1ccc2oc(cc2n1)C(=O)NCCC3CCC3 WXVL_AK2418SC00024 [0,1,0,1,0,0|2,0,0]=4 490 B21R3.3737512 O=C(NCC1CCC(C1)F)c2nc3ccccc3o2 WXVL_AK00226SE0704 [0,1,0,1,0,0|2,0,0]=4 491 B21R3.3737512 O=C(NCC1CCC(C1)F)c2nc3ccccc3o2 WXVL_AK00226SE0704 [0,1,0,1,0,0|2,0,0]=4 492 B21R3.23463905 CC1CCCCN(C1)C(=O)c2nc3ccccc3o2 WXVL_AN00290SE0704 [0,1,0,1,0,0|2,0,0]=4 493 B21R3.23463905 CC1CCCCN(C1)C(=O)c2nc3ccccc3o2 WXVL_AN00290SE0704 [0,1,0,1,0,0|2,0,0]=4 494 B21R3.147787913 CC1(CCCC1)CNC(=O)c2nc3ccccc3o2 WXVL_AK0300SE0704 [0,1,0,1,0,0|2,0,0]=4 495 B21R3.147787913 CC1(CCCC1)CNC(=O)c2nc3ccccc3o2 WXVL_AK0300SE0704 [0,1,0,1,0,0|2,0,0]=4 496 B21R3.147787913 O=C(NCC1(CCCC1)O)c2nc3ccccc3o2 WXVL_AK00235SE0704 [0,1,0,1,0,0|2,0,0]=4 497 B21R3.147787913 O=C(NCC1(CCCC1)O)c2nc3ccccc3o2 WXVL_AK00235SE0704 [0,1,0,1,0,0|2,0,0]=4 498 B21R3.26722022 CC1CCCN(CC1)C(=O)c2nc3ccccc3o2 WXVL_AN00326SE0704 [0,1,0,1,0,0|2,0,0]=4 499 B21R3.26722022 CC1CCCN(CC1)C(=O)c2nc3ccccc3o2 WXVL_AN00326SE0704 [0,1,0,1,0,0|2,0,0]=4 500 B21R3.7444263 CC1C(CCCN1C(=O)c2nc3ccccc3o2)O WXVL_ANJ336SE0704 [0,1,0,1,0,0|2,0,0]=4 501 B21R3.7444263 CC1C(CCCN1C(=O)c2nc3ccccc3o2)O WXVL_ANJ336SE0704 [0,1,0,1,0,0|2,0,0]=4 502 B21R4.3289859 O=C(c1nc2ccccc2o1)N3C4CCC3CC4 WXVL_AN00445SE0704 [0,0,0,2,0,0|2,0,0]=4 503 B21R4.3289859 O=C(c1nc2ccccc2o1)N3C4CCC3CC4 WXVL_AN00445SE0704 [0,0,0,2,0,0|2,0,0]=4 504 B21R4.3289864 O=C(c1nc2ccccc2o1)N3CC4CCC3C4 WXVL_AN3504SE0704 [0,0,0,2,0,0|2,0,0]=4 505 B17R1.9274 CCCCCCCC(=O)Nc1cccnc1Br WXVL_AF0399SB0393 [0,0,1,0,1,0|2,0,0]=4 506 B17R1.9274 CCCCCCCC(=O)Nc1cccnc1Br WXVL_AF0399SB0393 [0,0,1,0,1,0|2,0,0]=4 507 B17R1.9274 CCCCCCCC(=O)Nc1cccnc1C WXVL_AF0055SB0393 [0,0,1,0,1,0|2,0,0]=4 508 B17R1.9274 CCCCCCCC(=O)Nc1cccnc1C WXVL_AF0055SB0393 [0,0,1,0,1,0|2,0,0]=4 509 B17R1.9274 CCCCCCCC(=O)Nc1cccnc1Cl WXVL_AF0009SB0393 [0,0,1,0,1,0|2,0,0]=4 510 B17R1.9274 CCCCCCCC(=O)Nc1cccnc1Cl WXVL_AF0009SB0393 [0,0,1,0,1,0|2,0,0]=4 511 B17R1.9274 CCCCCCCC(=O)Nc1cccnc1F WXVL_AF0419SB0393 [0,0,1,0,1,0|2,0,0]=4 512 B17R1.9274 CCCCCCCC(=O)Nc1cccnc1F WXVL_AF0419SB0393 [0,0,1,0,1,0|2,0,0]=4 513 B17R1.9274 CCCCCCCC(=O)Nc1cccnc1I WXVL_AF0681SB0393 [0,0,1,0,1,0|2,0,0]=4 514 B17R1.9274 CCCCCCCC(=O)Nc1cccnc1I WXVL_AF0681SB0393 [0,0,1,0,1,0|2,0,0]=4 515 B17R1.9274 CCCCCCCC(=O)Nc1cccnc1O WXVL_AF0440SB0393 [0,0,1,0,1,0|2,0,0]=4 516 B17R1.9274 CCCCCCCC(=O)Nc1cccnc1O WXVL_AF0440SB0393 [0,0,1,0,1,0|2,0,0]=4 517 B17R1.9274 CCCCCCCC(=O)Nc1ncccc1Br WXVL_AF0053SB0393 [0,0,1,0,1,0|1,0,1]=4 518 B17R1.9274 CCCCCCCC(=O)Nc1ncccc1Br WXVL_AF0053SB0393 [0,0,1,0,1,0|1,0,1]=4 519 B17R1.9274 CCCCCCCC(=O)Nc1ncccc1C WXVL_AF0013SB0393 [0,0,1,0,1,0|1,0,1]=4 520 B17R1.9274 CCCCCCCC(=O)Nc1ncccc1C WXVL_AF0013SB0393 [0,0,1,0,1,0|1,0,1]=4 521 B17R1.9274 CCCCCCCC(=O)Nc1ncccc1Cl WXVL_AF1147SB0393 [0,0,1,0,1,0|1,0,1]=4 522 B17R1.9274 CCCCCCCC(=O)Nc1ncccc1Cl WXVL_AF1147SB0393 [0,0,1,0,1,0|1,0,1]=4 523 B17R1.9274 CCCCCCCC(=O)Nc1ncccc1F WXVL_AF0321SB0393 [0,0,1,0,1,0|1,0,1]=4 524 B17R1.9274 CCCCCCCC(=O)Nc1ncccc1F WXVL_AF0321SB0393 [0,0,1,0,1,0|1,0,1]=4 525 B17R1.9274 CCCCCCCC(=O)Nc1ncccc1I WXVL_AF0298SB0393 [0,0,1,0,1,0|1,0,1]=4 526 B17R1.9274 CCCCCCCC(=O)Nc1ncccc1I WXVL_AF0298SB0393 [0,0,1,0,1,0|1,0,1]=4 527 B17R1.9274 CCCCCCCC(=O)Nc1ncccc1O WXVL_AF0347SB0393 [0,0,1,0,1,0|0,0,1]=3 528 B17R1.9274 CCCCCCCC(=O)Nc1ncccc1O WXVL_AF0347SB0393 [0,0,1,0,1,0|0,0,1]=3 529 B17R1.9274 O=C(CCCCCCBr)Nc1ncccc1O WXVL_AF0347SB1386 [0,0,1,0,1,0|1,0,1]=4 530 B17R1.9274 O=C(CCCCCCBr)Nc1ncccc1O WXVL_AF0347SB1386 [0,0,1,0,1,0|1,0,1]=4 531 B19R2.20994 CCCCCNC(=O)c1ccc2cccnc2n1 WXVL_AK0076SE0284 [1,0,0,0,0,1|2,0,0]=4 532 B19R2.20994 CCCCCNC(=O)c1ccc2cccnc2n1 WXVL_AK0076SE0284 [1,0,0,0,0,1|2,0,0]=4 533 B19R2.119765 CCCCCCCC(=O)Nc1nc2sccc2s1 WXVL_AF00158SB0393 [0,0,0,0,1,1|1,1,0]=4 534 B19R2.119765 CCCCCCCC(=O)Nc1nc2sccc2s1 WXVL_AF00158SB0393 [0,0,0,0,1,1|1,1,0]=4 535 B21R2.275449 CCCCCCCC(=O)NCc1cc2ccccc2o1 WXVL_AK2469SB0393 [0,0,0,0,0,2|2,0,0]=4 536 B21R2.275449 CCCCCCCC(=O)NCc1cc2ccccc2o1 WXVL_AK2469SB0393 [0,0,0,0,0,2|2,0,0]=4 537 B21R2.275449 CCCCCCCC(=O)NCc1nc2ccccc2[nH]1 WXVL_AK00465SB0393 [0,0,0,0,0,2|2,0,0]=4 538 B21R2.275449 CCCCCCCC(=O)NCc1nc2ccccc2[nH]1 WXVL_AK00465SB0393 [0,0,0,0,0,2|2,0,0]=4 539 B21R2.275449 CCCCCCCC(=O)NCc1nc2ccccc2s1 WXVL_AK0426SB0393 [0,0,0,0,0,2|1,1,0]=4 540 B21R2.275449 CCCCCCCC(=O)NCc1nc2ccccc2s1 WXVL_AK0426SB0393 [0,0,0,0,0,2|1,1,0]=4 541 B21R2.275474 CCCCCCCC(=O)Nc1cc2ccccc2cn1 WXVL_AF0786SB0393 [0,0,0,0,0,2|2,0,0]=4 542 B21R2.275474 CCCCCCCC(=O)Nc1cc2ccccc2cn1 WXVL_AF0786SB0393 [0,0,0,0,0,2|2,0,0]=4 543 B21R2.275474 CCCCCCCC(=O)Nc1ccc2ccccc2n1 WXVL_AF0062SB0393 [0,0,0,0,0,2|2,0,0]=4 544 B21R2.275474 CCCCCCCC(=O)Nc1ccc2ccccc2n1 WXVL_AF0062SB0393 [0,0,0,0,0,2|2,0,0]=4 545 B21R2.275474 CCCCCCCC(=O)Nc1ccc2cccnc2c1 WXVL_AG00053SB0393 [0,0,0,0,0,2|2,0,0]=4 546 B21R2.275474 CCCCCCCC(=O)Nc1ccc2cccnc2c1 WXVL_AG00053SB0393 [0,0,0,0,0,2|2,0,0]=4 547 B21R2.275474 CCCCCCCC(=O)Nc1ccc2ncccc2c1 WXVL_AG0010SB0393 [0,0,0,0,0,2|2,0,0]=4 548 B21R2.275474 CCCCCCCC(=O)Nc1ccc2ncccc2c1 WXVL_AG0010SB0393 [0,0,0,0,0,2|2,0,0]=4 549 B21R2.275474 CCCCCCCC(=O)Nc1cnc2ccccc2n1 WXVL_AF1307SB0393 [0,0,0,0,0,2|2,0,0]=4 550 B21R2.275474 CCCCCCCC(=O)Nc1cnc2ccccc2n1 WXVL_AF1307SB0393 [0,0,0,0,0,2|2,0,0]=4 551 B21R2.275474 CCCCCCCC(=O)Nc1cnc2cccnc2c1 WXVL_AF4340SB0393 [0,0,0,0,0,2|2,0,0]=4 552 B21R2.275474 CCCCCCCC(=O)Nc1cnc2cccnc2c1 WXVL_AF4340SB0393 [0,0,0,0,0,2|2,0,0]=4 553 B21R2.275474 CCCCCCCC(=O)Nc1ncc2ccccc2n1 WXVL_AF0170SB0393 [0,0,0,0,0,2|2,0,0]=4 554 B21R2.275474 CCCCCCCC(=O)Nc1ncc2ccccc2n1 WXVL_AF0170SB0393 [0,0,0,0,0,2|2,0,0]=4