0 B23R3.19444762 O=C(CCCCc1ccccc1)N2Cc3ccccc3C2 WXVL_AN0094SB0460 [0,0,0,0,0,0|4,0,0]=4 1 B23R3.19444762 O=C(CCCCc1ccccc1)N2Cc3ccccc3C2 WXVL_AN0094SB0460 [0,0,0,0,0,0|4,0,0]=4 2 B23R3.19444762 O=C(CCCCc1ccccc1)N2Cc3cncnc3C2 WXVL_AN0315SB0460 [0,0,0,0,0,0|4,0,0]=4 3 B23R3.19444762 O=C(NC/C=C/c1ccccc1)c2nc3ccccc3o2 WXVL_AK00073SE0704 [0,0,0,0,0,0|2,0,2]=4 4 B23R3.19444762 O=C(NC/C=C/c1ccccc1)c2nc3ccccc3o2 WXVL_AK00073SE0704 [0,0,0,0,0,0|2,0,2]=4 5 B23R3.19444762 O=C(NCCCc1ccccc1)C2Cc3ccccc3O2 WXVL_AK0074SB0867 [0,0,0,0,0,0|3,0,1]=4 6 B23R3.19444762 O=C(NCCCc1ccccc1)C2Cc3ccccc3O2 WXVL_AK0074SB0867 [0,0,0,0,0,0|3,0,1]=4 7 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3ccccc3[nH]2 WXVL_AK0074SE0001 [0,0,0,0,0,0|3,0,1]=4 8 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3ccccc3[nH]2 WXVL_AK0074SE0001 [0,0,0,0,0,0|3,0,1]=4 9 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3ccccc3o2 WXVL_AK0074SE0105 [0,0,0,0,0,0|3,0,0]=3 10 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3ccccc3o2 WXVL_AK0074SE0105 [0,0,0,0,0,0|3,0,0]=3 11 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3ccccc3s2 WXVL_AK0074SE0107 [0,0,0,0,0,0|3,1,0]=4 12 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3ccccc3s2 WXVL_AK0074SE0107 [0,0,0,0,0,0|3,1,0]=4 13 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3ccccn3n2 WXVL_AK0074SE0030 [0,0,0,0,0,0|4,0,0]=4 14 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3ccccn3n2 WXVL_AK0074SE0030 [0,0,0,0,0,0|4,0,0]=4 15 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3cccnc3[nH]2 WXVL_AK0074SE0450 [0,0,0,0,0,0|2,0,1]=3 16 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3cccnc3[nH]2 WXVL_AK0074SE0450 [0,0,0,0,0,0|2,0,1]=3 17 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3cccnc3s2 WXVL_AK0074SE0061 [0,0,0,0,0,0|3,0,0]=3 18 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3cccnc3s2 WXVL_AK0074SE0061 [0,0,0,0,0,0|3,0,0]=3 19 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3cccnn3c2 WXVL_AK0074SE0985 [0,0,0,0,0,0|4,0,0]=4 20 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3cccnn3c2 WXVL_AK0074SE0985 [0,0,0,0,0,0|4,0,0]=4 21 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3cccnn3n2 WXVL_AK0074SC00097 [0,0,0,0,0,0|3,0,0]=3 22 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3cccnn3n2 WXVL_AK0074SC00097 [0,0,0,0,0,0|3,0,0]=3 23 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3ncccc3[nH]2 WXVL_AK0074SE0680 [0,0,0,0,0,0|3,0,0]=3 24 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3ncccc3[nH]2 WXVL_AK0074SE0680 [0,0,0,0,0,0|3,0,0]=3 25 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3ncccn3n2 WXVL_AK0074SE0309 [0,0,0,0,0,0|4,0,0]=4 26 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3ncccn3n2 WXVL_AK0074SE0309 [0,0,0,0,0,0|4,0,0]=4 27 B23R3.19444762 O=C(NCCCc1ccccc1)c2cn3cccnc3n2 WXVL_AK0074SE0332 [0,0,0,0,0,0|3,0,0]=3 28 B23R3.19444762 O=C(NCCCc1ccccc1)c2cn3cccnc3n2 WXVL_AK0074SE0332 [0,0,0,0,0,0|3,0,0]=3 29 B23R3.19444762 O=C(NCCCc1ccccc1)c2cn3ncccc3n2 WXVL_AK0074SE0145 [0,0,0,0,0,0|4,0,0]=4 30 B23R3.19444762 O=C(NCCCc1ccccc1)c2cn3ncccc3n2 WXVL_AK0074SE0145 [0,0,0,0,0,0|4,0,0]=4 31 B23R3.19444762 O=C(NCCCc1ccccc1)c2nc3ccccc3[nH]2 WXVL_AK0074SE0026 [0,0,0,0,0,0|3,0,0]=3 32 B23R3.19444762 O=C(NCCCc1ccccc1)c2nc3ccccc3[nH]2 WXVL_AK0074SE0026 [0,0,0,0,0,0|3,0,0]=3 33 B23R3.19444762 O=C(NCCCc1ccccc1)c2nc3ccccc3o2 WXVL_AK0074SE0704 [0,0,0,0,0,0|2,0,0]=2 34 B23R3.19444762 O=C(NCCCc1ccccc1)c2nc3ccccc3o2 WXVL_AK0074SE0704 [0,0,0,0,0,0|2,0,0]=2 35 B23R3.19444762 O=C(NCCCc1ccccc1)c2nc3ccccn3n2 WXVL_AK0074SC00085 [0,0,0,0,0,0|4,0,0]=4 36 B23R3.19444762 O=C(NCCCc1ccccc1)c2nc3ccccn3n2 WXVL_AK0074SC00085 [0,0,0,0,0,0|4,0,0]=4 37 B23R3.19444762 O=C(NCCCc1ccccc1)c2nc3ncccn3n2 WXVL_AK0074SE0103 [0,0,0,0,0,0|3,0,0]=3 38 B23R3.19444762 O=C(NCCCc1ccccc1)c2nc3ncccn3n2 WXVL_AK0074SE0103 [0,0,0,0,0,0|3,0,0]=3 39 B23R3.19444762 O=C(NCCCc1cccnc1)c2cc3ccccc3o2 WXVL_AK2339SE0105 [0,0,0,0,0,0|4,0,0]=4 40 B23R3.19444762 O=C(NCCCc1cccnc1)c2cc3ccccc3o2 WXVL_AK2339SE0105 [0,0,0,0,0,0|4,0,0]=4 41 B23R3.19444762 O=C(NCCCc1cccnc1)c2cc3cccnc3[nH]2 WXVL_AK2339SE0450 [0,0,0,0,0,0|3,0,1]=4 42 B23R3.19444762 O=C(NCCCc1cccnc1)c2cc3cccnc3[nH]2 WXVL_AK2339SE0450 [0,0,0,0,0,0|3,0,1]=4 43 B23R3.19444762 O=C(NCCCc1cccnc1)c2cc3cccnc3s2 WXVL_AK2339SE0061 [0,0,0,0,0,0|4,0,0]=4 44 B23R3.19444762 O=C(NCCCc1cccnc1)c2cc3cccnc3s2 WXVL_AK2339SE0061 [0,0,0,0,0,0|4,0,0]=4 45 B23R3.19444762 O=C(NCCCc1cccnc1)c2cc3cccnn3n2 WXVL_AK2339SC00097 [0,0,0,0,0,0|4,0,0]=4 46 B23R3.19444762 O=C(NCCCc1cccnc1)c2cc3cccnn3n2 WXVL_AK2339SC00097 [0,0,0,0,0,0|4,0,0]=4 47 B23R3.19444762 O=C(NCCCc1cccnc1)c2cc3ncccc3[nH]2 WXVL_AK2339SE0680 [0,0,0,0,0,0|4,0,0]=4 48 B23R3.19444762 O=C(NCCCc1cccnc1)c2cc3ncccc3[nH]2 WXVL_AK2339SE0680 [0,0,0,0,0,0|4,0,0]=4 49 B23R3.19444762 O=C(NCCCc1cccnc1)c2cn3cccnc3n2 WXVL_AK2339SE0332 [0,0,0,0,0,0|4,0,0]=4 50 B23R3.19444762 O=C(NCCCc1cccnc1)c2cn3cccnc3n2 WXVL_AK2339SE0332 [0,0,0,0,0,0|4,0,0]=4 51 B23R3.19444762 O=C(NCCCc1cccnc1)c2nc3ccccc3[nH]2 WXVL_AK2339SE0026 [0,0,0,0,0,0|4,0,0]=4 52 B23R3.19444762 O=C(NCCCc1cccnc1)c2nc3ccccc3[nH]2 WXVL_AK2339SE0026 [0,0,0,0,0,0|4,0,0]=4 53 B23R3.19444762 O=C(NCCCc1cccnc1)c2nc3ccccc3o2 WXVL_AK2339SE0704 [0,0,0,0,0,0|3,0,0]=3 54 B23R3.19444762 O=C(NCCCc1cccnc1)c2nc3ccccc3o2 WXVL_AK2339SE0704 [0,0,0,0,0,0|3,0,0]=3 55 B23R3.19444762 O=C(NCCCc1cccnc1)c2nc3ncccn3n2 WXVL_AK2339SE0103 [0,0,0,0,0,0|4,0,0]=4 56 B23R3.19444762 O=C(NCCCc1cccnc1)c2nc3ncccn3n2 WXVL_AK2339SE0103 [0,0,0,0,0,0|4,0,0]=4 57 B23R3.19444762 O=C(NCCCc1ccncc1)c2cc3ccccc3o2 WXVL_AK1251SE0105 [0,0,0,0,0,0|4,0,0]=4 58 B23R3.19444762 O=C(NCCCc1ccncc1)c2cc3ccccc3o2 WXVL_AK1251SE0105 [0,0,0,0,0,0|4,0,0]=4 59 B23R3.19444762 O=C(NCCCc1ccncc1)c2cc3cccnc3[nH]2 WXVL_AK1251SE0450 [0,0,0,0,0,0|3,0,1]=4 60 B23R3.19444762 O=C(NCCCc1ccncc1)c2cc3cccnc3[nH]2 WXVL_AK1251SE0450 [0,0,0,0,0,0|3,0,1]=4 61 B23R3.19444762 O=C(NCCCc1ccncc1)c2cc3cccnc3s2 WXVL_AK1251SE0061 [0,0,0,0,0,0|4,0,0]=4 62 B23R3.19444762 O=C(NCCCc1ccncc1)c2cc3cccnc3s2 WXVL_AK1251SE0061 [0,0,0,0,0,0|4,0,0]=4 63 B23R3.19444762 O=C(NCCCc1ccncc1)c2cc3cccnn3n2 WXVL_AK1251SC00097 [0,0,0,0,0,0|4,0,0]=4 64 B23R3.19444762 O=C(NCCCc1ccncc1)c2cc3cccnn3n2 WXVL_AK1251SC00097 [0,0,0,0,0,0|4,0,0]=4 65 B23R3.19444762 O=C(NCCCc1ccncc1)c2cc3ncccc3[nH]2 WXVL_AK1251SE0680 [0,0,0,0,0,0|4,0,0]=4 66 B23R3.19444762 O=C(NCCCc1ccncc1)c2cc3ncccc3[nH]2 WXVL_AK1251SE0680 [0,0,0,0,0,0|4,0,0]=4 67 B23R3.19444762 O=C(NCCCc1ccncc1)c2cn3cccnc3n2 WXVL_AK1251SE0332 [0,0,0,0,0,0|4,0,0]=4 68 B23R3.19444762 O=C(NCCCc1ccncc1)c2cn3cccnc3n2 WXVL_AK1251SE0332 [0,0,0,0,0,0|4,0,0]=4 69 B23R3.19444762 O=C(NCCCc1ccncc1)c2nc3ccccc3[nH]2 WXVL_AK1251SE0026 [0,0,0,0,0,0|4,0,0]=4 70 B23R3.19444762 O=C(NCCCc1ccncc1)c2nc3ccccc3[nH]2 WXVL_AK1251SE0026 [0,0,0,0,0,0|4,0,0]=4 71 B23R3.19444762 O=C(NCCCc1ccncc1)c2nc3ccccc3o2 WXVL_AK1251SE0704 [0,0,0,0,0,0|3,0,0]=3 72 B23R3.19444762 O=C(NCCCc1ccncc1)c2nc3ccccc3o2 WXVL_AK1251SE0704 [0,0,0,0,0,0|3,0,0]=3 73 B23R3.19444762 O=C(NCCCc1ccncc1)c2nc3ncccn3n2 WXVL_AK1251SE0103 [0,0,0,0,0,0|4,0,0]=4 74 B23R3.19444762 O=C(NCCCc1ccncc1)c2nc3ncccn3n2 WXVL_AK1251SE0103 [0,0,0,0,0,0|4,0,0]=4 75 B23R3.19444762 O=C(NCCNc1ccccc1)c2cc3ccccc3o2 WXVL_AK2478SE0105 [0,0,0,0,0,0|4,0,0]=4 76 B23R3.19444762 O=C(NCCNc1ccccc1)c2cc3ccccc3o2 WXVL_AK2478SE0105 [0,0,0,0,0,0|4,0,0]=4 77 B23R3.19444762 O=C(NCCNc1ccccc1)c2cc3cccnc3[nH]2 WXVL_AK2478SE0450 [0,0,0,0,0,0|3,0,1]=4 78 B23R3.19444762 O=C(NCCNc1ccccc1)c2cc3cccnc3[nH]2 WXVL_AK2478SE0450 [0,0,0,0,0,0|3,0,1]=4 79 B23R3.19444762 O=C(NCCNc1ccccc1)c2cc3cccnc3s2 WXVL_AK2478SE0061 [0,0,0,0,0,0|4,0,0]=4 80 B23R3.19444762 O=C(NCCNc1ccccc1)c2cc3cccnc3s2 WXVL_AK2478SE0061 [0,0,0,0,0,0|4,0,0]=4 81 B23R3.19444762 O=C(NCCNc1ccccc1)c2cc3cccnn3n2 WXVL_AK2478SC00097 [0,0,0,0,0,0|4,0,0]=4 82 B23R3.19444762 O=C(NCCNc1ccccc1)c2cc3cccnn3n2 WXVL_AK2478SC00097 [0,0,0,0,0,0|4,0,0]=4 83 B23R3.19444762 O=C(NCCNc1ccccc1)c2cc3ncccc3[nH]2 WXVL_AK2478SE0680 [0,0,0,0,0,0|4,0,0]=4 84 B23R3.19444762 O=C(NCCNc1ccccc1)c2cc3ncccc3[nH]2 WXVL_AK2478SE0680 [0,0,0,0,0,0|4,0,0]=4 85 B23R3.19444762 O=C(NCCNc1ccccc1)c2cn3cccnc3n2 WXVL_AK2478SE0332 [0,0,0,0,0,0|4,0,0]=4 86 B23R3.19444762 O=C(NCCNc1ccccc1)c2cn3cccnc3n2 WXVL_AK2478SE0332 [0,0,0,0,0,0|4,0,0]=4 87 B23R3.19444762 O=C(NCCNc1ccccc1)c2nc3ccccc3[nH]2 WXVL_AK2478SE0026 [0,0,0,0,0,0|4,0,0]=4 88 B23R3.19444762 O=C(NCCNc1ccccc1)c2nc3ccccc3[nH]2 WXVL_AK2478SE0026 [0,0,0,0,0,0|4,0,0]=4 89 B23R3.19444762 O=C(NCCNc1ccccc1)c2nc3ccccc3o2 WXVL_AK2478SE0704 [0,0,0,0,0,0|3,0,0]=3 90 B23R3.19444762 O=C(NCCNc1ccccc1)c2nc3ccccc3o2 WXVL_AK2478SE0704 [0,0,0,0,0,0|3,0,0]=3 91 B23R3.19444762 O=C(NCCNc1ccccc1)c2nc3ncccn3n2 WXVL_AK2478SE0103 [0,0,0,0,0,0|4,0,0]=4 92 B23R3.19444762 O=C(NCCNc1ccccc1)c2nc3ncccn3n2 WXVL_AK2478SE0103 [0,0,0,0,0,0|4,0,0]=4 93 B23R3.19444762 O=C(NCCOc1ccccc1)c2cc3ccccc3o2 WXVL_AK0103SE0105 [0,0,0,0,0,0|4,0,0]=4 94 B23R3.19444762 O=C(NCCOc1ccccc1)c2cc3ccccc3o2 WXVL_AK0103SE0105 [0,0,0,0,0,0|4,0,0]=4 95 B23R3.19444762 O=C(NCCOc1ccccc1)c2cc3cccnc3[nH]2 WXVL_AK0103SE0450 [0,0,0,0,0,0|3,0,1]=4 96 B23R3.19444762 O=C(NCCOc1ccccc1)c2cc3cccnc3[nH]2 WXVL_AK0103SE0450 [0,0,0,0,0,0|3,0,1]=4 97 B23R3.19444762 O=C(NCCOc1ccccc1)c2cc3cccnc3s2 WXVL_AK0103SE0061 [0,0,0,0,0,0|4,0,0]=4 98 B23R3.19444762 O=C(NCCOc1ccccc1)c2cc3cccnc3s2 WXVL_AK0103SE0061 [0,0,0,0,0,0|4,0,0]=4 99 B23R3.19444762 O=C(NCCOc1ccccc1)c2cc3cccnn3n2 WXVL_AK0103SC00097 [0,0,0,0,0,0|4,0,0]=4 100 B23R3.19444762 O=C(NCCOc1ccccc1)c2cc3cccnn3n2 WXVL_AK0103SC00097 [0,0,0,0,0,0|4,0,0]=4 101 B23R3.19444762 O=C(NCCOc1ccccc1)c2cc3ncccc3[nH]2 WXVL_AK0103SE0680 [0,0,0,0,0,0|4,0,0]=4 102 B23R3.19444762 O=C(NCCOc1ccccc1)c2cc3ncccc3[nH]2 WXVL_AK0103SE0680 [0,0,0,0,0,0|4,0,0]=4 103 B23R3.19444762 O=C(NCCOc1ccccc1)c2cn3cccnc3n2 WXVL_AK0103SE0332 [0,0,0,0,0,0|4,0,0]=4 104 B23R3.19444762 O=C(NCCOc1ccccc1)c2cn3cccnc3n2 WXVL_AK0103SE0332 [0,0,0,0,0,0|4,0,0]=4 105 B23R3.19444762 O=C(NCCOc1ccccc1)c2nc3ccccc3[nH]2 WXVL_AK0103SE0026 [0,0,0,0,0,0|4,0,0]=4 106 B23R3.19444762 O=C(NCCOc1ccccc1)c2nc3ccccc3[nH]2 WXVL_AK0103SE0026 [0,0,0,0,0,0|4,0,0]=4 107 B23R3.19444762 O=C(NCCOc1ccccc1)c2nc3ccccc3o2 WXVL_AK0103SE0704 [0,0,0,0,0,0|3,0,0]=3 108 B23R3.19444762 O=C(NCCOc1ccccc1)c2nc3ccccc3o2 WXVL_AK0103SE0704 [0,0,0,0,0,0|3,0,0]=3 109 B23R3.19444762 O=C(NCCOc1ccccc1)c2nc3ncccn3n2 WXVL_AK0103SE0103 [0,0,0,0,0,0|4,0,0]=4 110 B23R3.19444762 O=C(NCCOc1ccccc1)c2nc3ncccn3n2 WXVL_AK0103SE0103 [0,0,0,0,0,0|4,0,0]=4 111 B23R3.19444762 O=C(NCCOc1ccccn1)c2nc3ccccc3o2 WXVL_AK2654SE0704 [0,0,0,0,0,0|4,0,0]=4 112 B23R3.19444762 O=C(NCCOc1ccccn1)c2nc3ccccc3o2 WXVL_AK2654SE0704 [0,0,0,0,0,0|4,0,0]=4 113 B23R3.19444762 O=C(NCCOc1cccnc1)c2nc3ccccc3o2 WXVL_AK2245SE0704 [0,0,0,0,0,0|4,0,0]=4 114 B23R3.19444762 O=C(NCCOc1cccnc1)c2nc3ccccc3o2 WXVL_AK2245SE0704 [0,0,0,0,0,0|4,0,0]=4 115 B23R3.19444762 O=C(NCCOc1ccncc1)c2nc3ccccc3o2 WXVL_AK00818SE0704 [0,0,0,0,0,0|4,0,0]=4 116 B23R3.19444762 O=C(NCCOc1ccncc1)c2nc3ccccc3o2 WXVL_AK00818SE0704 [0,0,0,0,0,0|4,0,0]=4 117 B24R3.446256 O=C(NC[C@H](O)Cc1ccccc1)c2cc3ccccc3o2 WXVL_AKA020SE0105 [0,1,0,0,0,0|3,0,0]=4 118 B24R3.446256 O=C(NC[C@H](O)Cc1ccccc1)c2cc3ccccc3o2 WXVL_AKA020SE0105 [0,1,0,0,0,0|3,0,0]=4 119 B24R3.446256 O=C(NC[C@H](O)Cc1ccccc1)c2cc3cccnc3[nH]2 WXVL_AKA020SE0450 [0,1,0,0,0,0|2,0,1]=4 120 B24R3.446256 O=C(NC[C@H](O)Cc1ccccc1)c2cc3cccnc3[nH]2 WXVL_AKA020SE0450 [0,1,0,0,0,0|2,0,1]=4 121 B24R3.446256 O=C(NC[C@H](O)Cc1ccccc1)c2cc3cccnc3s2 WXVL_AKA020SE0061 [0,1,0,0,0,0|3,0,0]=4 122 B24R3.446256 O=C(NC[C@H](O)Cc1ccccc1)c2cc3cccnc3s2 WXVL_AKA020SE0061 [0,1,0,0,0,0|3,0,0]=4 123 B24R3.446256 O=C(NC[C@H](O)Cc1ccccc1)c2cc3cccnn3n2 WXVL_AKA020SC00097 [0,1,0,0,0,0|3,0,0]=4 124 B24R3.446256 O=C(NC[C@H](O)Cc1ccccc1)c2cc3cccnn3n2 WXVL_AKA020SC00097 [0,1,0,0,0,0|3,0,0]=4 125 B24R3.446256 O=C(NC[C@H](O)Cc1ccccc1)c2cc3ncccc3[nH]2 WXVL_AKA020SE0680 [0,1,0,0,0,0|3,0,0]=4 126 B24R3.446256 O=C(NC[C@H](O)Cc1ccccc1)c2cc3ncccc3[nH]2 WXVL_AKA020SE0680 [0,1,0,0,0,0|3,0,0]=4 127 B24R3.446256 O=C(NC[C@H](O)Cc1ccccc1)c2cn3cccnc3n2 WXVL_AKA020SE0332 [0,1,0,0,0,0|3,0,0]=4 128 B24R3.446256 O=C(NC[C@H](O)Cc1ccccc1)c2cn3cccnc3n2 WXVL_AKA020SE0332 [0,1,0,0,0,0|3,0,0]=4 129 B24R3.446256 O=C(NC[C@H](O)Cc1ccccc1)c2nc3ccccc3[nH]2 WXVL_AKA020SE0026 [0,1,0,0,0,0|3,0,0]=4 130 B24R3.446256 O=C(NC[C@H](O)Cc1ccccc1)c2nc3ccccc3[nH]2 WXVL_AKA020SE0026 [0,1,0,0,0,0|3,0,0]=4 131 B24R3.446256 O=C(NC[C@H](O)Cc1ccccc1)c2nc3ccccc3o2 WXVL_AKA020SE0704 [0,1,0,0,0,0|2,0,0]=3 132 B24R3.446256 O=C(NC[C@H](O)Cc1ccccc1)c2nc3ccccc3o2 WXVL_AKA020SE0704 [0,1,0,0,0,0|2,0,0]=3 133 B24R3.446256 O=C(NC[C@H](O)Cc1ccccc1)c2nc3ncccn3n2 WXVL_AKA020SE0103 [0,1,0,0,0,0|3,0,0]=4 134 B24R3.446256 O=C(NC[C@H](O)Cc1ccccc1)c2nc3ncccn3n2 WXVL_AKA020SE0103 [0,1,0,0,0,0|3,0,0]=4 135 B24R3.448607 CN(CCNC(=O)c1nc2ccccc2o1)c3ccccc3 WXVL_AK00706SE0704 [0,1,0,0,0,0|3,0,0]=4 136 B24R3.448607 CN(CCNC(=O)c1nc2ccccc2o1)c3ccccc3 WXVL_AK00706SE0704 [0,1,0,0,0,0|3,0,0]=4 137 B24R3.2710304 Cc1c(oc2c1cccc2)C(=O)NCCCc3ccccc3 WXVL_AK0074SE0058 [0,1,0,0,0,0|3,0,0]=4 138 B24R3.2710304 Cc1c(oc2c1cccc2)C(=O)NCCCc3ccccc3 WXVL_AK0074SE0058 [0,1,0,0,0,0|3,0,0]=4 139 B24R3.11388209 O=C(NCCOc1cccc(c1)Br)c2nc3ccccc3o2 WXVL_AK0441SE0704 [0,1,0,0,0,0|3,0,0]=4 140 B24R3.11388209 O=C(NCCOc1cccc(c1)Br)c2nc3ccccc3o2 WXVL_AK0441SE0704 [0,1,0,0,0,0|3,0,0]=4 141 B24R3.11388209 O=C(NCCOc1cccc(c1)F)c2nc3ccccc3o2 WXVL_AK2572SE0704 [0,1,0,0,0,0|3,0,0]=4 142 B24R3.11388209 O=C(NCCOc1cccc(c1)F)c2nc3ccccc3o2 WXVL_AK2572SE0704 [0,1,0,0,0,0|3,0,0]=4 143 B24R3.11555009 Cc1ccc2oc(cc2n1)C(=O)NCCCc3ccccc3 WXVL_AK0074SC00024 [0,1,0,0,0,0|2,0,0]=3 144 B24R3.11555009 Cc1ccc2oc(cc2n1)C(=O)NCCCc3ccccc3 WXVL_AK0074SC00024 [0,1,0,0,0,0|2,0,0]=3 145 B24R3.11555009 Cc1ccc2oc(cc2n1)C(=O)NCCCc3cccnc3 WXVL_AK2339SC00024 [0,1,0,0,0,0|3,0,0]=4 146 B24R3.11555009 Cc1ccc2oc(cc2n1)C(=O)NCCCc3cccnc3 WXVL_AK2339SC00024 [0,1,0,0,0,0|3,0,0]=4 147 B24R3.11555009 Cc1ccc2oc(cc2n1)C(=O)NCCCc3ccncc3 WXVL_AK1251SC00024 [0,1,0,0,0,0|3,0,0]=4 148 B24R3.11555009 Cc1ccc2oc(cc2n1)C(=O)NCCCc3ccncc3 WXVL_AK1251SC00024 [0,1,0,0,0,0|3,0,0]=4 149 B24R3.11555009 Cc1ccc2oc(cc2n1)C(=O)NCCNc3ccccc3 WXVL_AK2478SC00024 [0,1,0,0,0,0|3,0,0]=4 150 B24R3.11555009 Cc1ccc2oc(cc2n1)C(=O)NCCNc3ccccc3 WXVL_AK2478SC00024 [0,1,0,0,0,0|3,0,0]=4 151 B24R3.11555009 Cc1ccc2oc(cc2n1)C(=O)NCCOc3ccccc3 WXVL_AK0103SC00024 [0,1,0,0,0,0|3,0,0]=4 152 B24R3.11555009 Cc1ccc2oc(cc2n1)C(=O)NCCOc3ccccc3 WXVL_AK0103SC00024 [0,1,0,0,0,0|3,0,0]=4 153 B24R3.11555009 O=C(CCCCc1ccccc1)N2Cc3cc(cnc3C2)Br WXVL_AN00850SB0460 [0,1,0,0,0,0|3,0,0]=4 154 B24R3.11555009 O=C(CCCCc1ccccc1)N2Cc3ccc(nc3C2)Cl WXVL_AN00754SB0460 [0,1,0,0,0,0|3,0,0]=4 155 B24R3.11555009 O=C(NCCCc1ccccc1)c2cc3ccc(cc3o2)O WXVL_AK0074SE0774 [0,1,0,0,0,0|3,0,0]=4 156 B24R3.11555009 O=C(NCCCc1ccccc1)c2cc3ccc(cc3o2)O WXVL_AK0074SE0774 [0,1,0,0,0,0|3,0,0]=4 157 B24R3.11555009 O=C(NCCCc1ccccc1)c2cc3ccc(nc3[nH]2)Cl WXVL_AK0074SE0468 [0,1,0,0,0,0|2,0,1]=4 158 B24R3.11555009 O=C(NCCCc1ccccc1)c2cc3ccc(nc3[nH]2)Cl WXVL_AK0074SE0468 [0,1,0,0,0,0|2,0,1]=4 159 B24R3.11904236 Cc1ccccc1OCCNC(=O)c2nc3ccccc3o2 WXVL_AK1111SE0704 [0,1,0,0,0,0|3,0,0]=4 160 B24R3.11904236 Cc1ccccc1OCCNC(=O)c2nc3ccccc3o2 WXVL_AK1111SE0704 [0,1,0,0,0,0|3,0,0]=4 161 B24R3.11904236 O=C(NCCOc1ccccc1Cl)c2nc3ccccc3o2 WXVL_AK0815SE0704 [0,1,0,0,0,0|3,0,0]=4 162 B24R3.11904236 O=C(NCCOc1ccccc1Cl)c2nc3ccccc3o2 WXVL_AK0815SE0704 [0,1,0,0,0,0|3,0,0]=4 163 B24R3.23768342 Cc1cccc2c1nc([nH]2)C(=O)NCCCc3ccccc3 WXVL_AK0074SE0513 [0,1,0,0,0,0|3,0,0]=4 164 B24R3.23768342 Cc1cccc2c1nc([nH]2)C(=O)NCCCc3ccccc3 WXVL_AK0074SE0513 [0,1,0,0,0,0|3,0,0]=4 165 B24R3.37409406 Cc1ccc(cc1)OCCNC(=O)c2nc3ccccc3o2 WXVL_AK7560SE0704 [0,1,0,0,0,0|3,0,0]=4 166 B24R3.37409406 Cc1ccc(cc1)OCCNC(=O)c2nc3ccccc3o2 WXVL_AK7560SE0704 [0,1,0,0,0,0|3,0,0]=4 167 B24R3.37409406 O=C(NCCOc1ccc(cc1)Cl)c2nc3ccccc3o2 WXVL_AK0501SE0704 [0,1,0,0,0,0|3,0,0]=4 168 B24R3.37409406 O=C(NCCOc1ccc(cc1)Cl)c2nc3ccccc3o2 WXVL_AK0501SE0704 [0,1,0,0,0,0|3,0,0]=4 169 B24R3.37409406 O=C(NCCOc1ccc(cc1)F)c2nc3ccccc3o2 WXVL_AK0979SE0704 [0,1,0,0,0,0|3,0,0]=4 170 B24R3.37409406 O=C(NCCOc1ccc(cc1)F)c2nc3ccccc3o2 WXVL_AK0979SE0704 [0,1,0,0,0,0|3,0,0]=4 171 B24R3.248836599 CN(CCCc1ccccc1)C(=O)c2cc3ccccc3o2 WXVL_AN2288SE0105 [0,1,0,0,0,0|3,0,0]=4 172 B24R3.248836599 CN(CCCc1ccccc1)C(=O)c2cc3ccccc3o2 WXVL_AN2288SE0105 [0,1,0,0,0,0|3,0,0]=4 173 B24R3.248836599 CN(CCCc1ccccc1)C(=O)c2cc3cccnc3[nH]2 WXVL_AN2288SE0450 [0,1,0,0,0,0|2,0,1]=4 174 B24R3.248836599 CN(CCCc1ccccc1)C(=O)c2cc3cccnc3[nH]2 WXVL_AN2288SE0450 [0,1,0,0,0,0|2,0,1]=4 175 B24R3.248836599 CN(CCCc1ccccc1)C(=O)c2cc3cccnc3s2 WXVL_AN2288SE0061 [0,1,0,0,0,0|3,0,0]=4 176 B24R3.248836599 CN(CCCc1ccccc1)C(=O)c2cc3cccnc3s2 WXVL_AN2288SE0061 [0,1,0,0,0,0|3,0,0]=4 177 B24R3.248836599 CN(CCCc1ccccc1)C(=O)c2cc3cccnn3n2 WXVL_AN2288SC00097 [0,1,0,0,0,0|3,0,0]=4 178 B24R3.248836599 CN(CCCc1ccccc1)C(=O)c2cc3cccnn3n2 WXVL_AN2288SC00097 [0,1,0,0,0,0|3,0,0]=4 179 B24R3.248836599 CN(CCCc1ccccc1)C(=O)c2cc3ncccc3[nH]2 WXVL_AN2288SE0680 [0,1,0,0,0,0|3,0,0]=4 180 B24R3.248836599 CN(CCCc1ccccc1)C(=O)c2cc3ncccc3[nH]2 WXVL_AN2288SE0680 [0,1,0,0,0,0|3,0,0]=4 181 B24R3.248836599 CN(CCCc1ccccc1)C(=O)c2cn3cccnc3n2 WXVL_AN2288SE0332 [0,1,0,0,0,0|3,0,0]=4 182 B24R3.248836599 CN(CCCc1ccccc1)C(=O)c2cn3cccnc3n2 WXVL_AN2288SE0332 [0,1,0,0,0,0|3,0,0]=4 183 B24R3.248836599 CN(CCCc1ccccc1)C(=O)c2nc3ccccc3[nH]2 WXVL_AN2288SE0026 [0,1,0,0,0,0|3,0,0]=4 184 B24R3.248836599 CN(CCCc1ccccc1)C(=O)c2nc3ccccc3[nH]2 WXVL_AN2288SE0026 [0,1,0,0,0,0|3,0,0]=4 185 B24R3.248836599 CN(CCCc1ccccc1)C(=O)c2nc3ccccc3o2 WXVL_AN2288SE0704 [0,1,0,0,0,0|2,0,0]=3 186 B24R3.248836599 CN(CCCc1ccccc1)C(=O)c2nc3ccccc3o2 WXVL_AN2288SE0704 [0,1,0,0,0,0|2,0,0]=3 187 B24R3.248836599 CN(CCCc1ccccc1)C(=O)c2nc3ncccn3n2 WXVL_AN2288SE0103 [0,1,0,0,0,0|3,0,0]=4 188 B24R3.248836599 CN(CCCc1ccccc1)C(=O)c2nc3ncccn3n2 WXVL_AN2288SE0103 [0,1,0,0,0,0|3,0,0]=4 189 B22R2.202375 Cc1cccnc1CNC(=O)CCCCc2ccccc2 WXVL_AK0162SB0460 [0,0,1,0,0,0|3,0,0]=4 190 B22R2.202375 Cc1cccnc1CNC(=O)CCCCc2ccccc2 WXVL_AK0162SB0460 [0,0,1,0,0,0|3,0,0]=4 191 B22R2.202375 Cc1ncccc1CNC(=O)CCCCc2ccccc2 WXVL_AK00258SB0460 [0,0,1,0,0,0|3,0,0]=4 192 B22R2.202375 Cc1ncccc1CNC(=O)CCCCc2ccccc2 WXVL_AK00258SB0460 [0,0,1,0,0,0|3,0,0]=4 193 B22R2.202375 O=C(CCCCc1ccccc1)NCc2ccccc2O WXVL_AK0963SB0460 [0,0,1,0,0,0|3,0,0]=4 194 B22R2.202375 O=C(CCCCc1ccccc1)NCc2ccccc2O WXVL_AK0963SB0460 [0,0,1,0,0,0|3,0,0]=4 195 B22R2.202375 O=C(CCCCc1ccccc1)NCc2cccnc2Br WXVL_AK4357SB0460 [0,0,1,0,0,0|3,0,0]=4 196 B22R2.202375 O=C(CCCCc1ccccc1)NCc2cccnc2Br WXVL_AK4357SB0460 [0,0,1,0,0,0|3,0,0]=4 197 B22R2.202375 O=C(CCCCc1ccccc1)NCc2cccnc2F WXVL_AK00552SB0460 [0,0,1,0,0,0|3,0,0]=4 198 B22R2.202375 O=C(CCCCc1ccccc1)NCc2cccnc2F WXVL_AK00552SB0460 [0,0,1,0,0,0|3,0,0]=4 199 B22R2.202375 O=C(CCCCc1ccccc1)NCc2ncccc2F WXVL_AK00098SB0460 [0,0,1,0,0,0|3,0,0]=4 200 B22R2.202375 O=C(CCCCc1ccccc1)NCc2ncccc2F WXVL_AK00098SB0460 [0,0,1,0,0,0|3,0,0]=4 201 B22R2.359951 C/C(=C\c1cccnc1)/C(=O)NCCCc2ccccc2 WXVL_AK0074SA1933 [0,0,1,0,0,0|3,0,0]=4 202 B22R2.359951 C/C(=C\c1cccnc1)/C(=O)NCCCc2ccccc2 WXVL_AK0074SA1933 [0,0,1,0,0,0|3,0,0]=4 203 B22R2.359951 CN(Cc1ccccn1)C(=O)CCCCc2ccccc2 WXVL_AN0108SB0460 [0,0,1,0,0,0|3,0,0]=4 204 B22R2.359951 CN(Cc1ccccn1)C(=O)CCCCc2ccccc2 WXVL_AN0108SB0460 [0,0,1,0,0,0|3,0,0]=4 205 B22R2.359951 CN(Cc1cccnc1)C(=O)CCCCc2ccccc2 WXVL_AN0060SB0460 [0,0,1,0,0,0|3,0,0]=4 206 B22R2.359951 CN(Cc1cccnc1)C(=O)CCCCc2ccccc2 WXVL_AN0060SB0460 [0,0,1,0,0,0|3,0,0]=4 207 B24R4.1622655 O=C(NC1CCc2c1cccc2)c3cc4ccccc4o3 WXVL_AK1156SE0105 [0,0,0,1,0,0|3,0,0]=4 208 B24R4.1622655 O=C(NC1CCc2c1cccc2)c3cc4ccccc4o3 WXVL_AK1156SE0105 [0,0,0,1,0,0|3,0,0]=4 209 B24R4.1622655 O=C(NC1CCc2c1cccc2)c3cc4cccnc4[nH]3 WXVL_AK1156SE0450 [0,0,0,1,0,0|2,0,1]=4 210 B24R4.1622655 O=C(NC1CCc2c1cccc2)c3cc4cccnc4[nH]3 WXVL_AK1156SE0450 [0,0,0,1,0,0|2,0,1]=4 211 B24R4.1622655 O=C(NC1CCc2c1cccc2)c3cc4cccnc4s3 WXVL_AK1156SE0061 [0,0,0,1,0,0|3,0,0]=4 212 B24R4.1622655 O=C(NC1CCc2c1cccc2)c3cc4cccnc4s3 WXVL_AK1156SE0061 [0,0,0,1,0,0|3,0,0]=4 213 B24R4.1622655 O=C(NC1CCc2c1cccc2)c3cc4cccnn4n3 WXVL_AK1156SC00097 [0,0,0,1,0,0|3,0,0]=4 214 B24R4.1622655 O=C(NC1CCc2c1cccc2)c3cc4cccnn4n3 WXVL_AK1156SC00097 [0,0,0,1,0,0|3,0,0]=4 215 B24R4.1622655 O=C(NC1CCc2c1cccc2)c3cc4ncccc4[nH]3 WXVL_AK1156SE0680 [0,0,0,1,0,0|3,0,0]=4 216 B24R4.1622655 O=C(NC1CCc2c1cccc2)c3cc4ncccc4[nH]3 WXVL_AK1156SE0680 [0,0,0,1,0,0|3,0,0]=4 217 B24R4.1622655 O=C(NC1CCc2c1cccc2)c3cn4cccnc4n3 WXVL_AK1156SE0332 [0,0,0,1,0,0|3,0,0]=4 218 B24R4.1622655 O=C(NC1CCc2c1cccc2)c3cn4cccnc4n3 WXVL_AK1156SE0332 [0,0,0,1,0,0|3,0,0]=4 219 B24R4.1622655 O=C(NC1CCc2c1cccc2)c3nc4ccccc4[nH]3 WXVL_AK1156SE0026 [0,0,0,1,0,0|3,0,0]=4 220 B24R4.1622655 O=C(NC1CCc2c1cccc2)c3nc4ccccc4[nH]3 WXVL_AK1156SE0026 [0,0,0,1,0,0|3,0,0]=4 221 B24R4.1622655 O=C(NC1CCc2c1cccc2)c3nc4ccccc4o3 WXVL_AK1156SE0704 [0,0,0,1,0,0|2,0,0]=3 222 B24R4.1622655 O=C(NC1CCc2c1cccc2)c3nc4ccccc4o3 WXVL_AK1156SE0704 [0,0,0,1,0,0|2,0,0]=3 223 B24R4.1622655 O=C(NC1CCc2c1cccc2)c3nc4ncccn4n3 WXVL_AK1156SE0103 [0,0,0,1,0,0|3,0,0]=4 224 B24R4.1622655 O=C(NC1CCc2c1cccc2)c3nc4ncccn4n3 WXVL_AK1156SE0103 [0,0,0,1,0,0|3,0,0]=4 225 B24R4.1622655 O=C(NC1CCc2c1nccc2)c3nc4ccccc4o3 WXVL_AK2236SE0704 [0,0,0,1,0,0|3,0,0]=4 226 B24R4.1622655 O=C(NC1CCc2c1nccc2)c3nc4ccccc4o3 WXVL_AK2236SE0704 [0,0,0,1,0,0|3,0,0]=4 227 B24R4.1622655 O=C(NC1COc2c1cccc2)c3nc4ccccc4o3 WXVL_AK2368SE0704 [0,0,0,1,0,0|3,0,0]=4 228 B24R4.1622655 O=C(NC1COc2c1cccc2)c3nc4ccccc4o3 WXVL_AK2368SE0704 [0,0,0,1,0,0|3,0,0]=4 229 B24R4.1622655 O=C(N[C@H]1CCc2c1cccc2)c3cc4ccccc4o3 WXVL_AK00474SE0105 [0,0,0,1,0,0|3,0,0]=4 230 B24R4.1622655 O=C(N[C@H]1CCc2c1cccc2)c3cc4ccccc4o3 WXVL_AK00474SE0105 [0,0,0,1,0,0|3,0,0]=4 231 B24R4.1622655 O=C(N[C@H]1CCc2c1cccc2)c3cc4cccnc4[nH]3 WXVL_AK00474SE0450 [0,0,0,1,0,0|2,0,1]=4 232 B24R4.1622655 O=C(N[C@H]1CCc2c1cccc2)c3cc4cccnc4[nH]3 WXVL_AK00474SE0450 [0,0,0,1,0,0|2,0,1]=4 233 B24R4.1622655 O=C(N[C@H]1CCc2c1cccc2)c3cc4cccnc4s3 WXVL_AK00474SE0061 [0,0,0,1,0,0|3,0,0]=4 234 B24R4.1622655 O=C(N[C@H]1CCc2c1cccc2)c3cc4cccnc4s3 WXVL_AK00474SE0061 [0,0,0,1,0,0|3,0,0]=4 235 B24R4.1622655 O=C(N[C@H]1CCc2c1cccc2)c3cc4cccnn4n3 WXVL_AK00474SC00097 [0,0,0,1,0,0|3,0,0]=4 236 B24R4.1622655 O=C(N[C@H]1CCc2c1cccc2)c3cc4cccnn4n3 WXVL_AK00474SC00097 [0,0,0,1,0,0|3,0,0]=4 237 B24R4.1622655 O=C(N[C@H]1CCc2c1cccc2)c3cc4ncccc4[nH]3 WXVL_AK00474SE0680 [0,0,0,1,0,0|3,0,0]=4 238 B24R4.1622655 O=C(N[C@H]1CCc2c1cccc2)c3cc4ncccc4[nH]3 WXVL_AK00474SE0680 [0,0,0,1,0,0|3,0,0]=4 239 B24R4.1622655 O=C(N[C@H]1CCc2c1cccc2)c3cn4cccnc4n3 WXVL_AK00474SE0332 [0,0,0,1,0,0|3,0,0]=4 240 B24R4.1622655 O=C(N[C@H]1CCc2c1cccc2)c3cn4cccnc4n3 WXVL_AK00474SE0332 [0,0,0,1,0,0|3,0,0]=4 241 B24R4.1622655 O=C(N[C@H]1CCc2c1cccc2)c3nc4ccccc4[nH]3 WXVL_AK00474SE0026 [0,0,0,1,0,0|3,0,0]=4 242 B24R4.1622655 O=C(N[C@H]1CCc2c1cccc2)c3nc4ccccc4[nH]3 WXVL_AK00474SE0026 [0,0,0,1,0,0|3,0,0]=4 243 B24R4.1622655 O=C(N[C@H]1CCc2c1cccc2)c3nc4ccccc4o3 WXVL_AK00474SE0704 [0,0,0,1,0,0|2,0,0]=3 244 B24R4.1622655 O=C(N[C@H]1CCc2c1cccc2)c3nc4ccccc4o3 WXVL_AK00474SE0704 [0,0,0,1,0,0|2,0,0]=3 245 B24R4.1622655 O=C(N[C@H]1CCc2c1cccc2)c3nc4ncccn4n3 WXVL_AK00474SE0103 [0,0,0,1,0,0|3,0,0]=4 246 B24R4.1622655 O=C(N[C@H]1CCc2c1cccc2)c3nc4ncccn4n3 WXVL_AK00474SE0103 [0,0,0,1,0,0|3,0,0]=4 247 B24R4.5131261 O=C(c1cc2ccccc2o1)N3CCC3c4ccccc4 WXVL_AN3661SE0105 [0,0,0,1,0,0|3,0,0]=4 248 B24R4.5131261 O=C(c1cc2cccnc2[nH]1)N3CCC3c4ccccc4 WXVL_AN3661SE0450 [0,0,0,1,0,0|2,0,1]=4 249 B24R4.5131261 O=C(c1cc2cccnc2s1)N3CCC3c4ccccc4 WXVL_AN3661SE0061 [0,0,0,1,0,0|3,0,0]=4 250 B24R4.5131261 O=C(c1cc2cccnn2n1)N3CCC3c4ccccc4 WXVL_AN3661SC00097 [0,0,0,1,0,0|3,0,0]=4 251 B24R4.5131261 O=C(c1cc2ncccc2[nH]1)N3CCC3c4ccccc4 WXVL_AN3661SE0680 [0,0,0,1,0,0|3,0,0]=4 252 B24R4.5131261 O=C(c1cn2cccnc2n1)N3CCC3c4ccccc4 WXVL_AN3661SE0332 [0,0,0,1,0,0|3,0,0]=4 253 B24R4.5131261 O=C(c1nc2ccccc2[nH]1)N3CCC3c4ccccc4 WXVL_AN3661SE0026 [0,0,0,1,0,0|3,0,0]=4 254 B24R4.5131261 O=C(c1nc2ccccc2o1)N3CCC3c4ccccc4 WXVL_AN3661SE0704 [0,0,0,1,0,0|2,0,0]=3 255 B24R4.5131261 O=C(c1nc2ncccn2n1)N3CCC3c4ccccc4 WXVL_AN3661SE0103 [0,0,0,1,0,0|3,0,0]=4 256 B22R3.12500697 O=C(NCCc1ccccc1)c2cc3ccccc3o2 WXVL_AK00498SE0105 [0,0,0,0,1,0|3,0,0]=4 257 B22R3.12500697 O=C(NCCc1ccccc1)c2cc3ccccc3o2 WXVL_AK00498SE0105 [0,0,0,0,1,0|3,0,0]=4 258 B22R3.12500697 O=C(NCCc1ccccc1)c2cc3cccnc3[nH]2 WXVL_AK00498SE0450 [0,0,0,0,1,0|2,0,1]=4 259 B22R3.12500697 O=C(NCCc1ccccc1)c2cc3cccnc3[nH]2 WXVL_AK00498SE0450 [0,0,0,0,1,0|2,0,1]=4 260 B22R3.12500697 O=C(NCCc1ccccc1)c2cc3cccnc3s2 WXVL_AK00498SE0061 [0,0,0,0,1,0|3,0,0]=4 261 B22R3.12500697 O=C(NCCc1ccccc1)c2cc3cccnc3s2 WXVL_AK00498SE0061 [0,0,0,0,1,0|3,0,0]=4 262 B22R3.12500697 O=C(NCCc1ccccc1)c2cc3cccnn3n2 WXVL_AK00498SC00097 [0,0,0,0,1,0|3,0,0]=4 263 B22R3.12500697 O=C(NCCc1ccccc1)c2cc3cccnn3n2 WXVL_AK00498SC00097 [0,0,0,0,1,0|3,0,0]=4 264 B22R3.12500697 O=C(NCCc1ccccc1)c2cc3ncccc3[nH]2 WXVL_AK00498SE0680 [0,0,0,0,1,0|3,0,0]=4 265 B22R3.12500697 O=C(NCCc1ccccc1)c2cc3ncccc3[nH]2 WXVL_AK00498SE0680 [0,0,0,0,1,0|3,0,0]=4 266 B22R3.12500697 O=C(NCCc1ccccc1)c2cn3cccnc3n2 WXVL_AK00498SE0332 [0,0,0,0,1,0|3,0,0]=4 267 B22R3.12500697 O=C(NCCc1ccccc1)c2cn3cccnc3n2 WXVL_AK00498SE0332 [0,0,0,0,1,0|3,0,0]=4 268 B22R3.12500697 O=C(NCCc1ccccc1)c2nc3ccccc3[nH]2 WXVL_AK00498SE0026 [0,0,0,0,1,0|3,0,0]=4 269 B22R3.12500697 O=C(NCCc1ccccc1)c2nc3ccccc3[nH]2 WXVL_AK00498SE0026 [0,0,0,0,1,0|3,0,0]=4 270 B22R3.12500697 O=C(NCCc1ccccc1)c2nc3ccccc3o2 WXVL_AK00498SE0704 [0,0,0,0,1,0|2,0,0]=3 271 B22R3.12500697 O=C(NCCc1ccccc1)c2nc3ccccc3o2 WXVL_AK00498SE0704 [0,0,0,0,1,0|2,0,0]=3 272 B22R3.12500697 O=C(NCCc1ccccc1)c2nc3ncccn3n2 WXVL_AK00498SE0103 [0,0,0,0,1,0|3,0,0]=4 273 B22R3.12500697 O=C(NCCc1ccccc1)c2nc3ncccn3n2 WXVL_AK00498SE0103 [0,0,0,0,1,0|3,0,0]=4 274 B22R3.12500697 O=C(NCCc1ccccn1)c2nc3ccccc3o2 WXVL_AK0019SE0704 [0,0,0,0,1,0|3,0,0]=4 275 B22R3.12500697 O=C(NCCc1ccccn1)c2nc3ccccc3o2 WXVL_AK0019SE0704 [0,0,0,0,1,0|3,0,0]=4 276 B22R3.12500697 O=C(NCCc1cccnc1)c2nc3ccccc3o2 WXVL_AK00436SE0704 [0,0,0,0,1,0|3,0,0]=4 277 B22R3.12500697 O=C(NCCc1cccnc1)c2nc3ccccc3o2 WXVL_AK00436SE0704 [0,0,0,0,1,0|3,0,0]=4 278 B22R3.12500697 O=C(NCCc1ccncc1)c2nc3ccccc3o2 WXVL_AK0093SE0704 [0,0,0,0,1,0|3,0,0]=4 279 B22R3.12500697 O=C(NCCc1ccncc1)c2nc3ccccc3o2 WXVL_AK0093SE0704 [0,0,0,0,1,0|3,0,0]=4 280 B24R3.446311 O=C(CCCCc1ccccc1)N2CCc3cccnc3C2 WXVL_AN00388SB0460 [0,0,0,0,0,1|3,0,0]=4 281 B24R3.446311 O=C(CCCCc1ccccc1)N2CCc3cccnc3C2 WXVL_AN00388SB0460 [0,0,0,0,0,1|3,0,0]=4 282 B24R3.446311 O=C(CCCCc1ccccc1)N2CCc3ncccc3C2 WXVL_AN00470SB0460 [0,0,0,0,0,1|3,0,0]=4 283 B24R3.446311 O=C(CCCCc1ccccc1)N2CCc3ncccc3C2 WXVL_AN00470SB0460 [0,0,0,0,0,1|3,0,0]=4 284 B24R3.446311 O=C(NCCCc1ccccc1)c2cc3ccccc3cn2 WXVL_AK0074SE0464 [0,0,0,0,0,1|3,0,0]=4 285 B24R3.446311 O=C(NCCCc1ccccc1)c2cc3ccccc3cn2 WXVL_AK0074SE0464 [0,0,0,0,0,1|3,0,0]=4 286 B24R3.446311 O=C(NCCCc1ccccc1)c2ccc3ccccc3n2 WXVL_AK0074SE0005 [0,0,0,0,0,1|3,0,0]=4 287 B24R3.446311 O=C(NCCCc1ccccc1)c2ccc3ccccc3n2 WXVL_AK0074SE0005 [0,0,0,0,0,1|3,0,0]=4 288 B24R3.446311 O=C(NCCCc1ccccc1)c2ccc3cccnc3c2 WXVL_AK0074SE0111 [0,0,0,0,0,1|3,0,0]=4 289 B24R3.446311 O=C(NCCCc1ccccc1)c2ccc3cccnc3c2 WXVL_AK0074SE0111 [0,0,0,0,0,1|3,0,0]=4 290 B24R3.446311 O=C(NCCCc1ccccc1)c2ccc3cccnc3n2 WXVL_AK0074SE0284 [0,0,0,0,0,1|2,0,0]=3 291 B24R3.446311 O=C(NCCCc1ccccc1)c2ccc3cccnc3n2 WXVL_AK0074SE0284 [0,0,0,0,0,1|2,0,0]=3 292 B24R3.446311 O=C(NCCCc1ccccc1)c2ccc3ncccc3c2 WXVL_AK0074SE0022 [0,0,0,0,0,1|3,0,0]=4 293 B24R3.446311 O=C(NCCCc1ccccc1)c2ccc3ncccc3c2 WXVL_AK0074SE0022 [0,0,0,0,0,1|3,0,0]=4 294 B24R3.446311 O=C(NCCCc1ccccc1)c2cnc3ccccc3c2 WXVL_AK0074SE0006 [0,0,0,0,0,1|3,0,0]=4 295 B24R3.446311 O=C(NCCCc1ccccc1)c2cnc3ccccc3c2 WXVL_AK0074SE0006 [0,0,0,0,0,1|3,0,0]=4 296 B24R3.446311 O=C(NCCCc1ccccc1)c2cnc3ccccc3n2 WXVL_AK0074SE0009 [0,0,0,0,0,1|3,0,0]=4 297 B24R3.446311 O=C(NCCCc1ccccc1)c2cnc3ccccc3n2 WXVL_AK0074SE0009 [0,0,0,0,0,1|3,0,0]=4 298 B24R3.446311 O=C(NCCCc1cccnc1)c2ccc3cccnc3n2 WXVL_AK2339SE0284 [0,0,0,0,0,1|3,0,0]=4 299 B24R3.446311 O=C(NCCCc1cccnc1)c2ccc3cccnc3n2 WXVL_AK2339SE0284 [0,0,0,0,0,1|3,0,0]=4 300 B24R3.446311 O=C(NCCCc1ccncc1)c2ccc3cccnc3n2 WXVL_AK1251SE0284 [0,0,0,0,0,1|3,0,0]=4 301 B24R3.446311 O=C(NCCCc1ccncc1)c2ccc3cccnc3n2 WXVL_AK1251SE0284 [0,0,0,0,0,1|3,0,0]=4 302 B24R3.446311 O=C(NCCNc1ccccc1)c2ccc3cccnc3n2 WXVL_AK2478SE0284 [0,0,0,0,0,1|3,0,0]=4 303 B24R3.446311 O=C(NCCNc1ccccc1)c2ccc3cccnc3n2 WXVL_AK2478SE0284 [0,0,0,0,0,1|3,0,0]=4 304 B24R3.446311 O=C(NCCOc1ccccc1)c2ccc3cccnc3n2 WXVL_AK0103SE0284 [0,0,0,0,0,1|3,0,0]=4 305 B24R3.446311 O=C(NCCOc1ccccc1)c2ccc3cccnc3n2 WXVL_AK0103SE0284 [0,0,0,0,0,1|3,0,0]=4 306 B24R3.28927599 O=C(CCCCc1ccccc1)Nc2cc3ccccc3[nH]2 WXVL_AF00292SB0460 [0,0,0,0,0,1|2,0,1]=4 307 B24R3.28927599 O=C(CCCCc1ccccc1)Nc2cc3ccccc3[nH]2 WXVL_AF00292SB0460 [0,0,0,0,0,1|2,0,1]=4 308 B24R3.28927599 O=C(CCCCc1ccccc1)Nc2cc3ccccc3s2 WXVL_AF0734SB0460 [0,0,0,0,0,1|2,1,0]=4 309 B24R3.28927599 O=C(CCCCc1ccccc1)Nc2cc3ccccc3s2 WXVL_AF0734SB0460 [0,0,0,0,0,1|2,1,0]=4 310 B24R3.28927599 O=C(CCCCc1ccccc1)Nc2cc3ccccn3n2 WXVL_AF2150SB0460 [0,0,0,0,0,1|3,0,0]=4 311 B24R3.28927599 O=C(CCCCc1ccccc1)Nc2cc3ccccn3n2 WXVL_AF2150SB0460 [0,0,0,0,0,1|3,0,0]=4 312 B24R3.28927599 O=C(CCCCc1ccccc1)Nc2cn3ccccc3n2 WXVL_AF1811SB0460 [0,0,0,0,0,1|3,0,0]=4 313 B24R3.28927599 O=C(CCCCc1ccccc1)Nc2cn3ccccc3n2 WXVL_AF1811SB0460 [0,0,0,0,0,1|3,0,0]=4 314 B24R3.28927599 O=C(CCCCc1ccccc1)Nc2nc3ccccc3[nH]2 WXVL_AF0204SB0460 [0,0,0,0,0,1|2,0,0]=3 315 B24R3.28927599 O=C(CCCCc1ccccc1)Nc2nc3ccccc3[nH]2 WXVL_AF0204SB0460 [0,0,0,0,0,1|2,0,0]=3 316 B24R3.28927599 O=C(CCCCc1ccccc1)Nc2nc3ccccc3s2 WXVL_AF0063SB0460 [0,0,0,0,0,1|1,1,0]=3 317 B24R3.28927599 O=C(CCCCc1ccccc1)Nc2nc3ccccc3s2 WXVL_AF0063SB0460 [0,0,0,0,0,1|1,1,0]=3 318 B24R3.28927599 O=C(CCCCc1ccccc1)Nc2nc3cccnc3s2 WXVL_AF2700SB0460 [0,0,0,0,0,1|2,0,0]=3 319 B24R3.28927599 O=C(CCCCc1ccccc1)Nc2nc3cccnc3s2 WXVL_AF2700SB0460 [0,0,0,0,0,1|2,0,0]=3 320 B24R3.28951759 O=C(NCCCCc1ccccc1)C2Cc3ccccc3O2 WXVL_AK00516SB0867 [0,0,0,0,0,1|2,0,1]=4 321 B24R3.28951759 O=C(NCCCCc1ccccc1)C2Cc3ccccc3O2 WXVL_AK00516SB0867 [0,0,0,0,0,1|2,0,1]=4 322 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cc3ccccc3[nH]2 WXVL_AK00516SE0001 [0,0,0,0,0,1|2,0,1]=4 323 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cc3ccccc3[nH]2 WXVL_AK00516SE0001 [0,0,0,0,0,1|2,0,1]=4 324 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cc3ccccc3o2 WXVL_AK00516SE0105 [0,0,0,0,0,1|2,0,0]=3 325 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cc3ccccc3o2 WXVL_AK00516SE0105 [0,0,0,0,0,1|2,0,0]=3 326 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cc3ccccc3s2 WXVL_AK00516SE0107 [0,0,0,0,0,1|2,1,0]=4 327 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cc3ccccc3s2 WXVL_AK00516SE0107 [0,0,0,0,0,1|2,1,0]=4 328 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cc3ccccn3n2 WXVL_AK00516SE0030 [0,0,0,0,0,1|3,0,0]=4 329 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cc3ccccn3n2 WXVL_AK00516SE0030 [0,0,0,0,0,1|3,0,0]=4 330 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cc3cccnc3[nH]2 WXVL_AK00516SE0450 [0,0,0,0,0,1|1,0,1]=3 331 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cc3cccnc3[nH]2 WXVL_AK00516SE0450 [0,0,0,0,0,1|1,0,1]=3 332 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cc3cccnc3s2 WXVL_AK00516SE0061 [0,0,0,0,0,1|2,0,0]=3 333 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cc3cccnc3s2 WXVL_AK00516SE0061 [0,0,0,0,0,1|2,0,0]=3 334 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cc3cccnn3c2 WXVL_AK00516SE0985 [0,0,0,0,0,1|3,0,0]=4 335 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cc3cccnn3c2 WXVL_AK00516SE0985 [0,0,0,0,0,1|3,0,0]=4 336 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cc3cccnn3n2 WXVL_AK00516SC00097 [0,0,0,0,0,1|2,0,0]=3 337 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cc3cccnn3n2 WXVL_AK00516SC00097 [0,0,0,0,0,1|2,0,0]=3 338 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cc3ncccc3[nH]2 WXVL_AK00516SE0680 [0,0,0,0,0,1|2,0,0]=3 339 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cc3ncccc3[nH]2 WXVL_AK00516SE0680 [0,0,0,0,0,1|2,0,0]=3 340 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cc3ncccn3n2 WXVL_AK00516SE0309 [0,0,0,0,0,1|3,0,0]=4 341 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cc3ncccn3n2 WXVL_AK00516SE0309 [0,0,0,0,0,1|3,0,0]=4 342 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cn3cccnc3n2 WXVL_AK00516SE0332 [0,0,0,0,0,1|2,0,0]=3 343 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cn3cccnc3n2 WXVL_AK00516SE0332 [0,0,0,0,0,1|2,0,0]=3 344 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cn3ncccc3n2 WXVL_AK00516SE0145 [0,0,0,0,0,1|3,0,0]=4 345 B24R3.28951759 O=C(NCCCCc1ccccc1)c2cn3ncccc3n2 WXVL_AK00516SE0145 [0,0,0,0,0,1|3,0,0]=4 346 B24R3.28951759 O=C(NCCCCc1ccccc1)c2nc3ccccc3[nH]2 WXVL_AK00516SE0026 [0,0,0,0,0,1|2,0,0]=3 347 B24R3.28951759 O=C(NCCCCc1ccccc1)c2nc3ccccc3[nH]2 WXVL_AK00516SE0026 [0,0,0,0,0,1|2,0,0]=3 348 B24R3.28951759 O=C(NCCCCc1ccccc1)c2nc3ccccc3o2 WXVL_AK00516SE0704 [0,0,0,0,0,1|1,0,0]=2 349 B24R3.28951759 O=C(NCCCCc1ccccc1)c2nc3ccccc3o2 WXVL_AK00516SE0704 [0,0,0,0,0,1|1,0,0]=2 350 B24R3.28951759 O=C(NCCCCc1ccccc1)c2nc3ccccn3n2 WXVL_AK00516SC00085 [0,0,0,0,0,1|3,0,0]=4 351 B24R3.28951759 O=C(NCCCCc1ccccc1)c2nc3ccccn3n2 WXVL_AK00516SC00085 [0,0,0,0,0,1|3,0,0]=4 352 B24R3.28951759 O=C(NCCCCc1ccccc1)c2nc3ncccn3n2 WXVL_AK00516SE0103 [0,0,0,0,0,1|2,0,0]=3 353 B24R3.28951759 O=C(NCCCCc1ccccc1)c2nc3ncccn3n2 WXVL_AK00516SE0103 [0,0,0,0,0,1|2,0,0]=3 354 B24R3.28951759 O=C(NCCCOc1ccccc1)c2cc3ccccc3o2 WXVL_AK2366SE0105 [0,0,0,0,0,1|3,0,0]=4 355 B24R3.28951759 O=C(NCCCOc1ccccc1)c2cc3ccccc3o2 WXVL_AK2366SE0105 [0,0,0,0,0,1|3,0,0]=4 356 B24R3.28951759 O=C(NCCCOc1ccccc1)c2cc3cccnc3[nH]2 WXVL_AK2366SE0450 [0,0,0,0,0,1|2,0,1]=4 357 B24R3.28951759 O=C(NCCCOc1ccccc1)c2cc3cccnc3[nH]2 WXVL_AK2366SE0450 [0,0,0,0,0,1|2,0,1]=4 358 B24R3.28951759 O=C(NCCCOc1ccccc1)c2cc3cccnc3s2 WXVL_AK2366SE0061 [0,0,0,0,0,1|3,0,0]=4 359 B24R3.28951759 O=C(NCCCOc1ccccc1)c2cc3cccnc3s2 WXVL_AK2366SE0061 [0,0,0,0,0,1|3,0,0]=4 360 B24R3.28951759 O=C(NCCCOc1ccccc1)c2cc3cccnn3n2 WXVL_AK2366SC00097 [0,0,0,0,0,1|3,0,0]=4 361 B24R3.28951759 O=C(NCCCOc1ccccc1)c2cc3cccnn3n2 WXVL_AK2366SC00097 [0,0,0,0,0,1|3,0,0]=4 362 B24R3.28951759 O=C(NCCCOc1ccccc1)c2cc3ncccc3[nH]2 WXVL_AK2366SE0680 [0,0,0,0,0,1|3,0,0]=4 363 B24R3.28951759 O=C(NCCCOc1ccccc1)c2cc3ncccc3[nH]2 WXVL_AK2366SE0680 [0,0,0,0,0,1|3,0,0]=4 364 B24R3.28951759 O=C(NCCCOc1ccccc1)c2cn3cccnc3n2 WXVL_AK2366SE0332 [0,0,0,0,0,1|3,0,0]=4 365 B24R3.28951759 O=C(NCCCOc1ccccc1)c2cn3cccnc3n2 WXVL_AK2366SE0332 [0,0,0,0,0,1|3,0,0]=4 366 B24R3.28951759 O=C(NCCCOc1ccccc1)c2nc3ccccc3[nH]2 WXVL_AK2366SE0026 [0,0,0,0,0,1|3,0,0]=4 367 B24R3.28951759 O=C(NCCCOc1ccccc1)c2nc3ccccc3[nH]2 WXVL_AK2366SE0026 [0,0,0,0,0,1|3,0,0]=4 368 B24R3.28951759 O=C(NCCCOc1ccccc1)c2nc3ccccc3o2 WXVL_AK2366SE0704 [0,0,0,0,0,1|2,0,0]=3 369 B24R3.28951759 O=C(NCCCOc1ccccc1)c2nc3ccccc3o2 WXVL_AK2366SE0704 [0,0,0,0,0,1|2,0,0]=3 370 B24R3.28951759 O=C(NCCCOc1ccccc1)c2nc3ncccn3n2 WXVL_AK2366SE0103 [0,0,0,0,0,1|3,0,0]=4 371 B24R3.28951759 O=C(NCCCOc1ccccc1)c2nc3ncccn3n2 WXVL_AK2366SE0103 [0,0,0,0,0,1|3,0,0]=4 372 B24R3.28951759 O=C(NCCOCc1ccccc1)c2cc3ccccc3o2 WXVL_AK1105SE0105 [0,0,0,0,0,1|3,0,0]=4 373 B24R3.28951759 O=C(NCCOCc1ccccc1)c2cc3ccccc3o2 WXVL_AK1105SE0105 [0,0,0,0,0,1|3,0,0]=4 374 B24R3.28951759 O=C(NCCOCc1ccccc1)c2cc3cccnc3[nH]2 WXVL_AK1105SE0450 [0,0,0,0,0,1|2,0,1]=4 375 B24R3.28951759 O=C(NCCOCc1ccccc1)c2cc3cccnc3[nH]2 WXVL_AK1105SE0450 [0,0,0,0,0,1|2,0,1]=4 376 B24R3.28951759 O=C(NCCOCc1ccccc1)c2cc3cccnc3s2 WXVL_AK1105SE0061 [0,0,0,0,0,1|3,0,0]=4 377 B24R3.28951759 O=C(NCCOCc1ccccc1)c2cc3cccnc3s2 WXVL_AK1105SE0061 [0,0,0,0,0,1|3,0,0]=4 378 B24R3.28951759 O=C(NCCOCc1ccccc1)c2cc3cccnn3n2 WXVL_AK1105SC00097 [0,0,0,0,0,1|3,0,0]=4 379 B24R3.28951759 O=C(NCCOCc1ccccc1)c2cc3cccnn3n2 WXVL_AK1105SC00097 [0,0,0,0,0,1|3,0,0]=4 380 B24R3.28951759 O=C(NCCOCc1ccccc1)c2cc3ncccc3[nH]2 WXVL_AK1105SE0680 [0,0,0,0,0,1|3,0,0]=4 381 B24R3.28951759 O=C(NCCOCc1ccccc1)c2cc3ncccc3[nH]2 WXVL_AK1105SE0680 [0,0,0,0,0,1|3,0,0]=4 382 B24R3.28951759 O=C(NCCOCc1ccccc1)c2cn3cccnc3n2 WXVL_AK1105SE0332 [0,0,0,0,0,1|3,0,0]=4 383 B24R3.28951759 O=C(NCCOCc1ccccc1)c2cn3cccnc3n2 WXVL_AK1105SE0332 [0,0,0,0,0,1|3,0,0]=4 384 B24R3.28951759 O=C(NCCOCc1ccccc1)c2nc3ccccc3[nH]2 WXVL_AK1105SE0026 [0,0,0,0,0,1|3,0,0]=4 385 B24R3.28951759 O=C(NCCOCc1ccccc1)c2nc3ccccc3[nH]2 WXVL_AK1105SE0026 [0,0,0,0,0,1|3,0,0]=4 386 B24R3.28951759 O=C(NCCOCc1ccccc1)c2nc3ccccc3o2 WXVL_AK1105SE0704 [0,0,0,0,0,1|2,0,0]=3 387 B24R3.28951759 O=C(NCCOCc1ccccc1)c2nc3ccccc3o2 WXVL_AK1105SE0704 [0,0,0,0,0,1|2,0,0]=3 388 B24R3.28951759 O=C(NCCOCc1ccccc1)c2nc3ncccn3n2 WXVL_AK1105SE0103 [0,0,0,0,0,1|3,0,0]=4 389 B24R3.28951759 O=C(NCCOCc1ccccc1)c2nc3ncccn3n2 WXVL_AK1105SE0103 [0,0,0,0,0,1|3,0,0]=4 390 B21R2.257631 O=C(/C=C/c1cccnc1)NCCCc2ccccc2 WXVL_AK0074SA0193 [1,0,1,0,0,0|2,0,0]=4 391 B21R2.257631 O=C(/C=C/c1cccnc1)NCCCc2ccccc2 WXVL_AK0074SA0193 [1,0,1,0,0,0|2,0,0]=4 392 B21R2.257631 O=C(CCCCc1ccccc1)NCc2ccccn2 WXVL_AK0018SB0460 [1,0,1,0,0,0|2,0,0]=4 393 B21R2.257631 O=C(CCCCc1ccccc1)NCc2ccccn2 WXVL_AK0018SB0460 [1,0,1,0,0,0|2,0,0]=4 394 B21R2.257631 O=C(CCCCc1ccccc1)NCc2cccnc2 WXVL_AK0020SB0460 [1,0,1,0,0,0|2,0,0]=4 395 B21R2.257631 O=C(CCCCc1ccccc1)NCc2cccnc2 WXVL_AK0020SB0460 [1,0,1,0,0,0|2,0,0]=4 396 B21R2.257631 O=C(COc1cccnc1)NCCCc2ccccc2 WXVL_AK0074SA0051 [1,0,1,0,0,0|1,0,1]=4 397 B21R2.257631 O=C(COc1cccnc1)NCCCc2ccccc2 WXVL_AK0074SA0051 [1,0,1,0,0,0|1,0,1]=4 398 B23R3.938160 CC(CNC(=O)c1nc2ccccc2o1)c3ccccc3 WXVL_AK00546SE0704 [0,1,0,0,1,0|2,0,0]=4 399 B23R3.938160 CC(CNC(=O)c1nc2ccccc2o1)c3ccccc3 WXVL_AK00546SE0704 [0,1,0,0,1,0|2,0,0]=4 400 B23R3.938160 C[C@H](CNC(=O)c1nc2ccccc2o1)c3ccccc3 WXVL_AK00506SE0704 [0,1,0,0,1,0|2,0,0]=4 401 B23R3.938160 C[C@H](CNC(=O)c1nc2ccccc2o1)c3ccccc3 WXVL_AK00506SE0704 [0,1,0,0,1,0|2,0,0]=4 402 B23R3.938160 O=C(NCC(O)c1ccccc1)c2nc3ccccc3o2 WXVL_AK0051SE0704 [0,1,0,0,1,0|2,0,0]=4 403 B23R3.938160 O=C(NCC(O)c1ccccc1)c2nc3ccccc3o2 WXVL_AK0051SE0704 [0,1,0,0,1,0|2,0,0]=4 404 B23R3.7931150 Cc1cccc(c1)CCNC(=O)c2nc3ccccc3o2 WXVL_AK8219SE0704 [0,1,0,0,1,0|2,0,0]=4 405 B23R3.7931150 Cc1cccc(c1)CCNC(=O)c2nc3ccccc3o2 WXVL_AK8219SE0704 [0,1,0,0,1,0|2,0,0]=4 406 B23R3.7931150 O=C(NCCc1cccc(c1)Br)c2nc3ccccc3o2 WXVL_AK0800SE0704 [0,1,0,0,1,0|2,0,0]=4 407 B23R3.7931150 O=C(NCCc1cccc(c1)Br)c2nc3ccccc3o2 WXVL_AK0800SE0704 [0,1,0,0,1,0|2,0,0]=4 408 B23R3.7931150 O=C(NCCc1cccc(c1)Cl)c2nc3ccccc3o2 WXVL_AK0776SE0704 [0,1,0,0,1,0|2,0,0]=4 409 B23R3.7931150 O=C(NCCc1cccc(c1)Cl)c2nc3ccccc3o2 WXVL_AK0776SE0704 [0,1,0,0,1,0|2,0,0]=4 410 B23R3.7931150 O=C(NCCc1cccc(c1)F)c2nc3ccccc3o2 WXVL_AK0117SE0704 [0,1,0,0,1,0|2,0,0]=4 411 B23R3.7931150 O=C(NCCc1cccc(c1)F)c2nc3ccccc3o2 WXVL_AK0117SE0704 [0,1,0,0,1,0|2,0,0]=4 412 B23R3.7931150 O=C(NCCc1cccc(c1)O)c2nc3ccccc3o2 WXVL_AK00421SE0704 [0,1,0,0,1,0|2,0,0]=4 413 B23R3.7931150 O=C(NCCc1cccc(c1)O)c2nc3ccccc3o2 WXVL_AK00421SE0704 [0,1,0,0,1,0|2,0,0]=4 414 B23R3.8276522 Cc1ccccc1CCNC(=O)c2nc3ccccc3o2 WXVL_AK0254SE0704 [0,1,0,0,1,0|2,0,0]=4 415 B23R3.8276522 Cc1ccccc1CCNC(=O)c2nc3ccccc3o2 WXVL_AK0254SE0704 [0,1,0,0,1,0|2,0,0]=4 416 B23R3.8276522 O=C(NCCc1ccccc1Br)c2nc3ccccc3o2 WXVL_AK0778SE0704 [0,1,0,0,1,0|2,0,0]=4 417 B23R3.8276522 O=C(NCCc1ccccc1Br)c2nc3ccccc3o2 WXVL_AK0778SE0704 [0,1,0,0,1,0|2,0,0]=4 418 B23R3.8276522 O=C(NCCc1ccccc1Cl)c2nc3ccccc3o2 WXVL_AK0715SE0704 [0,1,0,0,1,0|2,0,0]=4 419 B23R3.8276522 O=C(NCCc1ccccc1Cl)c2nc3ccccc3o2 WXVL_AK0715SE0704 [0,1,0,0,1,0|2,0,0]=4 420 B23R3.8276522 O=C(NCCc1ccccc1F)c2nc3ccccc3o2 WXVL_AK0118SE0704 [0,1,0,0,1,0|2,0,0]=4 421 B23R3.8276522 O=C(NCCc1ccccc1F)c2nc3ccccc3o2 WXVL_AK0118SE0704 [0,1,0,0,1,0|2,0,0]=4 422 B23R3.8276522 O=C(NCCc1ccccc1O)c2nc3ccccc3o2 WXVL_AK2884SE0704 [0,1,0,0,1,0|2,0,0]=4 423 B23R3.8276522 O=C(NCCc1ccccc1O)c2nc3ccccc3o2 WXVL_AK2884SE0704 [0,1,0,0,1,0|2,0,0]=4 424 B23R3.10389065 Cc1ccc2oc(cc2n1)C(=O)NCCc3ccccc3 WXVL_AK00498SC00024 [0,1,0,0,1,0|2,0,0]=4 425 B23R3.10389065 Cc1ccc2oc(cc2n1)C(=O)NCCc3ccccc3 WXVL_AK00498SC00024 [0,1,0,0,1,0|2,0,0]=4 426 B23R3.24455889 Cc1ccc(cc1)CCNC(=O)c2nc3ccccc3o2 WXVL_AK0066SE0704 [0,1,0,0,1,0|2,0,0]=4 427 B23R3.24455889 Cc1ccc(cc1)CCNC(=O)c2nc3ccccc3o2 WXVL_AK0066SE0704 [0,1,0,0,1,0|2,0,0]=4 428 B23R3.24455889 O=C(NCCc1ccc(cc1)Br)c2nc3ccccc3o2 WXVL_AK0745SE0704 [0,1,0,0,1,0|2,0,0]=4 429 B23R3.24455889 O=C(NCCc1ccc(cc1)Br)c2nc3ccccc3o2 WXVL_AK0745SE0704 [0,1,0,0,1,0|2,0,0]=4 430 B23R3.24455889 O=C(NCCc1ccc(cc1)Cl)c2nc3ccccc3o2 WXVL_AK1369SE0704 [0,1,0,0,1,0|2,0,0]=4 431 B23R3.24455889 O=C(NCCc1ccc(cc1)Cl)c2nc3ccccc3o2 WXVL_AK1369SE0704 [0,1,0,0,1,0|2,0,0]=4 432 B23R3.24455889 O=C(NCCc1ccc(cc1)F)c2nc3ccccc3o2 WXVL_AK0123SE0704 [0,1,0,0,1,0|2,0,0]=4 433 B23R3.24455889 O=C(NCCc1ccc(cc1)F)c2nc3ccccc3o2 WXVL_AK0123SE0704 [0,1,0,0,1,0|2,0,0]=4 434 B23R3.24455889 O=C(NCCc1ccc(cc1)O)c2nc3ccccc3o2 WXVL_AK0748SE0704 [0,1,0,0,1,0|2,0,0]=4 435 B23R3.24455889 O=C(NCCc1ccc(cc1)O)c2nc3ccccc3o2 WXVL_AK0748SE0704 [0,1,0,0,1,0|2,0,0]=4 436 B25R3.3572615 O=C(NCCCc1ccccc1)c2cc3cccnc3nc2O WXVL_AK0074SE0731 [0,1,0,0,0,1|2,0,0]=4 437 B25R3.3572615 O=C(NCCCc1ccccc1)c2cc3cccnc3nc2O WXVL_AK0074SE0731 [0,1,0,0,0,1|2,0,0]=4 438 B25R3.3975314 O=C(NC[C@H](O)Cc1ccccc1)c2ccc3cccnc3n2 WXVL_AKA020SE0284 [0,1,0,0,0,1|2,0,0]=4 439 B25R3.3975314 O=C(NC[C@H](O)Cc1ccccc1)c2ccc3cccnc3n2 WXVL_AKA020SE0284 [0,1,0,0,0,1|2,0,0]=4 440 B25R3.32603518 CN(CCCc1ccccc1)C(=O)c2ccc3cccnc3n2 WXVL_AN2288SE0284 [0,1,0,0,0,1|2,0,0]=4 441 B25R3.32603518 CN(CCCc1ccccc1)C(=O)c2ccc3cccnc3n2 WXVL_AN2288SE0284 [0,1,0,0,0,1|2,0,0]=4 442 B25R3.3011125 Cn1c(nc2c1cccc2)NC(=O)CCCCc3ccccc3 WXVL_AF0191SB0460 [0,1,0,0,0,1|2,0,0]=4 443 B25R3.3011125 Cn1c(nc2c1cccc2)NC(=O)CCCCc3ccccc3 WXVL_AF0191SB0460 [0,1,0,0,0,1|2,0,0]=4 444 B25R3.13932255 Cc1ccc2nc([nH]c2c1)NC(=O)CCCCc3ccccc3 WXVL_AF0282SB0460 [0,1,0,0,0,1|2,0,0]=4 445 B25R3.13932255 Cc1ccc2nc([nH]c2c1)NC(=O)CCCCc3ccccc3 WXVL_AF0282SB0460 [0,1,0,0,0,1|2,0,0]=4 446 B25R3.13932255 Cc1ccc2nc(sc2c1)NC(=O)CCCCc3ccccc3 WXVL_AF0267SB0460 [0,1,0,0,0,1|1,1,0]=4 447 B25R3.13932255 Cc1ccc2nc(sc2c1)NC(=O)CCCCc3ccccc3 WXVL_AF0267SB0460 [0,1,0,0,0,1|1,1,0]=4 448 B25R3.13932255 Cc1ccc2sc(nc2c1)NC(=O)CCCCc3ccccc3 WXVL_AF0205SB0460 [0,1,0,0,0,1|1,1,0]=4 449 B25R3.13932255 Cc1ccc2sc(nc2c1)NC(=O)CCCCc3ccccc3 WXVL_AF0205SB0460 [0,1,0,0,0,1|1,1,0]=4 450 B25R3.13932255 O=C(CCCCc1ccccc1)Nc2nc3cc(ccc3o2)Br WXVL_AF0254SB0460 [0,1,0,0,0,1|1,0,0]=3 451 B25R3.13932255 O=C(CCCCc1ccccc1)Nc2nc3cc(ccc3o2)Br WXVL_AF0254SB0460 [0,1,0,0,0,1|1,0,0]=3 452 B25R3.13932255 O=C(CCCCc1ccccc1)Nc2nc3cc(ccc3s2)Cl WXVL_AF2689SB0460 [0,1,0,0,0,1|1,1,0]=4 453 B25R3.13932255 O=C(CCCCc1ccccc1)Nc2nc3cc(ccc3s2)Cl WXVL_AF2689SB0460 [0,1,0,0,0,1|1,1,0]=4 454 B25R3.13932255 O=C(CCCCc1ccccc1)Nc2nc3cc(ccc3s2)F WXVL_AF3394SB0460 [0,1,0,0,0,1|1,1,0]=4 455 B25R3.13932255 O=C(CCCCc1ccccc1)Nc2nc3cc(ccc3s2)F WXVL_AF3394SB0460 [0,1,0,0,0,1|1,1,0]=4 456 B25R3.13932255 O=C(CCCCc1ccccc1)Nc2nc3cc(cnc3[nH]2)Br WXVL_AF00282SB0460 [0,1,0,0,0,1|1,0,1]=4 457 B25R3.13932255 O=C(CCCCc1ccccc1)Nc2nc3cc(cnc3[nH]2)Br WXVL_AF00282SB0460 [0,1,0,0,0,1|1,0,1]=4 458 B25R3.13932255 O=C(CCCCc1ccccc1)Nc2nc3ccc(cc3[nH]2)Cl WXVL_AF00010SB0460 [0,1,0,0,0,1|2,0,0]=4 459 B25R3.13932255 O=C(CCCCc1ccccc1)Nc2nc3ccc(cc3[nH]2)Cl WXVL_AF00010SB0460 [0,1,0,0,0,1|2,0,0]=4 460 B25R3.13932255 O=C(CCCCc1ccccc1)Nc2nc3ccc(cc3o2)Br WXVL_AF3022SB0460 [0,1,0,0,0,1|1,0,0]=3 461 B25R3.13932255 O=C(CCCCc1ccccc1)Nc2nc3ccc(cc3o2)Br WXVL_AF3022SB0460 [0,1,0,0,0,1|1,0,0]=3 462 B25R3.13932255 O=C(CCCCc1ccccc1)Nc2nc3ccc(cc3o2)I WXVL_AF5006SB0460 [0,1,0,0,0,1|1,0,0]=3 463 B25R3.13932255 O=C(CCCCc1ccccc1)Nc2nc3ccc(cc3o2)I WXVL_AF5006SB0460 [0,1,0,0,0,1|1,0,0]=3 464 B25R3.13932255 O=C(CCCCc1ccccc1)Nc2nc3ccc(cc3s2)Br WXVL_AF0229SB0460 [0,1,0,0,0,1|1,1,0]=4 465 B25R3.13932255 O=C(CCCCc1ccccc1)Nc2nc3ccc(cc3s2)Br WXVL_AF0229SB0460 [0,1,0,0,0,1|1,1,0]=4 466 B25R3.27393875 Cc1cccc2c1nc(s2)NC(=O)CCCCc3ccccc3 WXVL_AF0121SB0460 [0,1,0,0,0,1|1,1,0]=4 467 B25R3.27393875 Cc1cccc2c1nc(s2)NC(=O)CCCCc3ccccc3 WXVL_AF0121SB0460 [0,1,0,0,0,1|1,1,0]=4 468 B25R3.27393875 O=C(CCCCc1ccccc1)Nc2nc3c(cccc3o2)O WXVL_AF4655SB0460 [0,1,0,0,0,1|1,0,0]=3 469 B25R3.27393875 O=C(CCCCc1ccccc1)Nc2nc3c(cccc3o2)O WXVL_AF4655SB0460 [0,1,0,0,0,1|1,0,0]=3 470 B25R3.27393875 O=C(CCCCc1ccccc1)Nc2nc3c(cccc3s2)Br WXVL_AF3331SB0460 [0,1,0,0,0,1|1,1,0]=4 471 B25R3.27393875 O=C(CCCCc1ccccc1)Nc2nc3c(cccc3s2)Br WXVL_AF3331SB0460 [0,1,0,0,0,1|1,1,0]=4 472 B25R3.27393875 O=C(CCCCc1ccccc1)Nc2nc3cccc(c3s2)Br WXVL_AF0290SB0460 [0,1,0,0,0,1|1,1,0]=4 473 B25R3.27393875 O=C(CCCCc1ccccc1)Nc2nc3cccc(c3s2)Br WXVL_AF0290SB0460 [0,1,0,0,0,1|1,1,0]=4 474 B25R3.27393875 O=C(CCCCc1ccccc1)Nc2nc3cccc(c3s2)Cl WXVL_AF0186SB0460 [0,1,0,0,0,1|1,1,0]=4 475 B25R3.27393875 O=C(CCCCc1ccccc1)Nc2nc3cccc(c3s2)Cl WXVL_AF0186SB0460 [0,1,0,0,0,1|1,1,0]=4 476 B25R3.3010083 Cc1c(oc2c1cccc2)C(=O)NCCCCc3ccccc3 WXVL_AK00516SE0058 [0,1,0,0,0,1|2,0,0]=4 477 B25R3.3010083 Cc1c(oc2c1cccc2)C(=O)NCCCCc3ccccc3 WXVL_AK00516SE0058 [0,1,0,0,0,1|2,0,0]=4 478 B25R3.13749253 O=C(NCCCOc1cccc(c1)F)c2nc3ccccc3o2 WXVL_AK4001SE0704 [0,1,0,0,0,1|2,0,0]=4 479 B25R3.13749253 O=C(NCCCOc1cccc(c1)F)c2nc3ccccc3o2 WXVL_AK4001SE0704 [0,1,0,0,0,1|2,0,0]=4 480 B25R3.13931682 Cc1ccc2oc(cc2n1)C(=O)NCCCCc3ccccc3 WXVL_AK00516SC00024 [0,1,0,0,0,1|1,0,0]=3 481 B25R3.13931682 Cc1ccc2oc(cc2n1)C(=O)NCCCCc3ccccc3 WXVL_AK00516SC00024 [0,1,0,0,0,1|1,0,0]=3 482 B25R3.13931682 Cc1ccc2oc(cc2n1)C(=O)NCCCOc3ccccc3 WXVL_AK2366SC00024 [0,1,0,0,0,1|2,0,0]=4 483 B25R3.13931682 Cc1ccc2oc(cc2n1)C(=O)NCCCOc3ccccc3 WXVL_AK2366SC00024 [0,1,0,0,0,1|2,0,0]=4 484 B25R3.13931682 Cc1ccc2oc(cc2n1)C(=O)NCCOCc3ccccc3 WXVL_AK1105SC00024 [0,1,0,0,0,1|2,0,0]=4 485 B25R3.13931682 Cc1ccc2oc(cc2n1)C(=O)NCCOCc3ccccc3 WXVL_AK1105SC00024 [0,1,0,0,0,1|2,0,0]=4 486 B25R3.13931682 O=C(NCCCCc1ccccc1)c2cc3ccc(cc3o2)O WXVL_AK00516SE0774 [0,1,0,0,0,1|2,0,0]=4 487 B25R3.13931682 O=C(NCCCCc1ccccc1)c2cc3ccc(cc3o2)O WXVL_AK00516SE0774 [0,1,0,0,0,1|2,0,0]=4 488 B25R3.13931682 O=C(NCCCCc1ccccc1)c2cc3ccc(nc3[nH]2)Cl WXVL_AK00516SE0468 [0,1,0,0,0,1|1,0,1]=4 489 B25R3.13931682 O=C(NCCCCc1ccccc1)c2cc3ccc(nc3[nH]2)Cl WXVL_AK00516SE0468 [0,1,0,0,0,1|1,0,1]=4 490 B25R3.27233317 Cc1cccc2c1nc([nH]2)C(=O)NCCCCc3ccccc3 WXVL_AK00516SE0513 [0,1,0,0,0,1|2,0,0]=4 491 B25R3.27233317 Cc1cccc2c1nc([nH]2)C(=O)NCCCCc3ccccc3 WXVL_AK00516SE0513 [0,1,0,0,0,1|2,0,0]=4 492 B25R3.42914746 O=C(NCCCCc1ccc(cc1)Cl)c2cc3ccccc3o2 WXVL_AK5305SE0105 [0,1,0,0,0,1|2,0,0]=4 493 B25R3.42914746 O=C(NCCCCc1ccc(cc1)Cl)c2cc3ccccc3o2 WXVL_AK5305SE0105 [0,1,0,0,0,1|2,0,0]=4 494 B25R3.42914746 O=C(NCCCCc1ccc(cc1)Cl)c2cc3cccnc3[nH]2 WXVL_AK5305SE0450 [0,1,0,0,0,1|1,0,1]=4 495 B25R3.42914746 O=C(NCCCCc1ccc(cc1)Cl)c2cc3cccnc3[nH]2 WXVL_AK5305SE0450 [0,1,0,0,0,1|1,0,1]=4 496 B25R3.42914746 O=C(NCCCCc1ccc(cc1)Cl)c2cc3cccnc3s2 WXVL_AK5305SE0061 [0,1,0,0,0,1|2,0,0]=4 497 B25R3.42914746 O=C(NCCCCc1ccc(cc1)Cl)c2cc3cccnc3s2 WXVL_AK5305SE0061 [0,1,0,0,0,1|2,0,0]=4 498 B25R3.42914746 O=C(NCCCCc1ccc(cc1)Cl)c2cc3cccnn3n2 WXVL_AK5305SC00097 [0,1,0,0,0,1|2,0,0]=4 499 B25R3.42914746 O=C(NCCCCc1ccc(cc1)Cl)c2cc3cccnn3n2 WXVL_AK5305SC00097 [0,1,0,0,0,1|2,0,0]=4 500 B25R3.42914746 O=C(NCCCCc1ccc(cc1)Cl)c2cc3ncccc3[nH]2 WXVL_AK5305SE0680 [0,1,0,0,0,1|2,0,0]=4 501 B25R3.42914746 O=C(NCCCCc1ccc(cc1)Cl)c2cc3ncccc3[nH]2 WXVL_AK5305SE0680 [0,1,0,0,0,1|2,0,0]=4 502 B25R3.42914746 O=C(NCCCCc1ccc(cc1)Cl)c2cn3cccnc3n2 WXVL_AK5305SE0332 [0,1,0,0,0,1|2,0,0]=4 503 B25R3.42914746 O=C(NCCCCc1ccc(cc1)Cl)c2cn3cccnc3n2 WXVL_AK5305SE0332 [0,1,0,0,0,1|2,0,0]=4 504 B25R3.42914746 O=C(NCCCCc1ccc(cc1)Cl)c2nc3ccccc3[nH]2 WXVL_AK5305SE0026 [0,1,0,0,0,1|2,0,0]=4 505 B25R3.42914746 O=C(NCCCCc1ccc(cc1)Cl)c2nc3ccccc3[nH]2 WXVL_AK5305SE0026 [0,1,0,0,0,1|2,0,0]=4 506 B25R3.42914746 O=C(NCCCCc1ccc(cc1)Cl)c2nc3ccccc3o2 WXVL_AK5305SE0704 [0,1,0,0,0,1|1,0,0]=3 507 B25R3.42914746 O=C(NCCCCc1ccc(cc1)Cl)c2nc3ccccc3o2 WXVL_AK5305SE0704 [0,1,0,0,0,1|1,0,0]=3 508 B25R3.42914746 O=C(NCCCCc1ccc(cc1)Cl)c2nc3ncccn3n2 WXVL_AK5305SE0103 [0,1,0,0,0,1|2,0,0]=4 509 B25R3.42914746 O=C(NCCCCc1ccc(cc1)Cl)c2nc3ncccn3n2 WXVL_AK5305SE0103 [0,1,0,0,0,1|2,0,0]=4 510 B25R3.42914746 O=C(NCCCOc1ccc(cc1)F)c2nc3ccccc3o2 WXVL_AK0995SE0704 [0,1,0,0,0,1|2,0,0]=4 511 B25R3.42914746 O=C(NCCCOc1ccc(cc1)F)c2nc3ccccc3o2 WXVL_AK0995SE0704 [0,1,0,0,0,1|2,0,0]=4 512 B25R3.1958304 O=C(NCC(CO)Cc1ccccc1)c2nc3ccccc3o2 WXVL_AK2953SE0704 [0,2,0,0,0,0|2,0,0]=4 513 B25R3.1958304 O=C(NCC(CO)Cc1ccccc1)c2nc3ccccc3o2 WXVL_AK2953SE0704 [0,2,0,0,0,0|2,0,0]=4 514 B25R3.13931510 Cc1ccc2oc(cc2n1)C(=O)NC[C@H](O)Cc3ccccc3 WXVL_AKA020SC00024 [0,2,0,0,0,0|2,0,0]=4 515 B25R3.13931510 Cc1ccc2oc(cc2n1)C(=O)NC[C@H](O)Cc3ccccc3 WXVL_AKA020SC00024 [0,2,0,0,0,0|2,0,0]=4 516 B25R3.13931703 Cc1ccc2oc(cc2n1)C(=O)N(C)CCCc3ccccc3 WXVL_AN2288SC00024 [0,2,0,0,0,0|2,0,0]=4 517 B25R3.13931703 Cc1ccc2oc(cc2n1)C(=O)N(C)CCCc3ccccc3 WXVL_AN2288SC00024 [0,2,0,0,0,0|2,0,0]=4 518 B25R4.1549637 O=C(c1ccc2cccnc2n1)N3CCC3c4ccccc4 WXVL_AN3661SE0284 [0,0,0,1,0,1|2,0,0]=4 519 B25R4.1704821 O=C(NC1CCc2c1cccc2)c3ccc4cccnc4n3 WXVL_AK1156SE0284 [0,0,0,1,0,1|2,0,0]=4 520 B25R4.1704821 O=C(NC1CCc2c1cccc2)c3ccc4cccnc4n3 WXVL_AK1156SE0284 [0,0,0,1,0,1|2,0,0]=4 521 B25R4.1704821 O=C(N[C@H]1CCc2c1cccc2)c3ccc4cccnc4n3 WXVL_AK00474SE0284 [0,0,0,1,0,1|2,0,0]=4 522 B25R4.1704821 O=C(N[C@H]1CCc2c1cccc2)c3ccc4cccnc4n3 WXVL_AK00474SE0284 [0,0,0,1,0,1|2,0,0]=4 523 B25R4.4917548 O=C(Nc1nc2ccccc2[nH]1)[C@H]3CCCc4c3cccc4 WXVL_AF0204SB4181 [0,0,0,1,0,1|2,0,0]=4 524 B25R4.4917548 O=C(Nc1nc2ccccc2[nH]1)[C@H]3CCCc4c3cccc4 WXVL_AF0204SB4181 [0,0,0,1,0,1|2,0,0]=4 525 B25R4.4917548 O=C(Nc1nc2ccccc2s1)[C@H]3CCCc4c3cccc4 WXVL_AF0063SB4181 [0,0,0,1,0,1|1,1,0]=4 526 B25R4.4917548 O=C(Nc1nc2ccccc2s1)[C@H]3CCCc4c3cccc4 WXVL_AF0063SB4181 [0,0,0,1,0,1|1,1,0]=4 527 B25R4.4917548 O=C(Nc1nc2cccnc2s1)[C@H]3CCCc4c3cccc4 WXVL_AF2700SB4181 [0,0,0,1,0,1|2,0,0]=4 528 B25R4.4917548 O=C(Nc1nc2cccnc2s1)[C@H]3CCCc4c3cccc4 WXVL_AF2700SB4181 [0,0,0,1,0,1|2,0,0]=4 529 B25R4.1551014 O=C(c1cc2ccccc2o1)N3CCCC3c4ccccc4 WXVL_AN2347SE0105 [0,0,0,1,0,1|2,0,0]=4 530 B25R4.1551014 O=C(c1cc2ccccc2o1)N3CCCC3c4ccccc4 WXVL_AN2347SE0105 [0,0,0,1,0,1|2,0,0]=4 531 B25R4.1551014 O=C(c1cc2ccccc2o1)N3CCC[C@H]3c4ccccc4 WXVL_AN00549SE0105 [0,0,0,1,0,1|2,0,0]=4 532 B25R4.1551014 O=C(c1cc2cccnc2[nH]1)N3CCCC3c4ccccc4 WXVL_AN2347SE0450 [0,0,0,1,0,1|1,0,1]=4 533 B25R4.1551014 O=C(c1cc2cccnc2[nH]1)N3CCCC3c4ccccc4 WXVL_AN2347SE0450 [0,0,0,1,0,1|1,0,1]=4 534 B25R4.1551014 O=C(c1cc2cccnc2[nH]1)N3CCC[C@H]3c4ccccc4 WXVL_AN00549SE0450 [0,0,0,1,0,1|1,0,1]=4 535 B25R4.1551014 O=C(c1cc2cccnc2s1)N3CCCC3c4ccccc4 WXVL_AN2347SE0061 [0,0,0,1,0,1|2,0,0]=4 536 B25R4.1551014 O=C(c1cc2cccnc2s1)N3CCCC3c4ccccc4 WXVL_AN2347SE0061 [0,0,0,1,0,1|2,0,0]=4 537 B25R4.1551014 O=C(c1cc2cccnc2s1)N3CCC[C@H]3c4ccccc4 WXVL_AN00549SE0061 [0,0,0,1,0,1|2,0,0]=4 538 B25R4.1551014 O=C(c1cc2cccnn2n1)N3CCCC3c4ccccc4 WXVL_AN2347SC00097 [0,0,0,1,0,1|2,0,0]=4 539 B25R4.1551014 O=C(c1cc2cccnn2n1)N3CCCC3c4ccccc4 WXVL_AN2347SC00097 [0,0,0,1,0,1|2,0,0]=4 540 B25R4.1551014 O=C(c1cc2cccnn2n1)N3CCC[C@H]3c4ccccc4 WXVL_AN00549SC00097 [0,0,0,1,0,1|2,0,0]=4 541 B25R4.1551014 O=C(c1cc2ncccc2[nH]1)N3CCCC3c4ccccc4 WXVL_AN2347SE0680 [0,0,0,1,0,1|2,0,0]=4 542 B25R4.1551014 O=C(c1cc2ncccc2[nH]1)N3CCCC3c4ccccc4 WXVL_AN2347SE0680 [0,0,0,1,0,1|2,0,0]=4 543 B25R4.1551014 O=C(c1cc2ncccc2[nH]1)N3CCC[C@H]3c4ccccc4 WXVL_AN00549SE0680 [0,0,0,1,0,1|2,0,0]=4 544 B25R4.1551014 O=C(c1cn2cccnc2n1)N3CCCC3c4ccccc4 WXVL_AN2347SE0332 [0,0,0,1,0,1|2,0,0]=4 545 B25R4.1551014 O=C(c1cn2cccnc2n1)N3CCCC3c4ccccc4 WXVL_AN2347SE0332 [0,0,0,1,0,1|2,0,0]=4 546 B25R4.1551014 O=C(c1cn2cccnc2n1)N3CCC[C@H]3c4ccccc4 WXVL_AN00549SE0332 [0,0,0,1,0,1|2,0,0]=4 547 B25R4.1551014 O=C(c1nc2ccccc2[nH]1)N3CCCC3c4ccccc4 WXVL_AN2347SE0026 [0,0,0,1,0,1|2,0,0]=4 548 B25R4.1551014 O=C(c1nc2ccccc2[nH]1)N3CCCC3c4ccccc4 WXVL_AN2347SE0026 [0,0,0,1,0,1|2,0,0]=4 549 B25R4.1551014 O=C(c1nc2ccccc2[nH]1)N3CCC[C@H]3c4ccccc4 WXVL_AN00549SE0026 [0,0,0,1,0,1|2,0,0]=4 550 B25R4.1551014 O=C(c1nc2ccccc2o1)N3CCCC3c4ccccc4 WXVL_AN2347SE0704 [0,0,0,1,0,1|1,0,0]=3 551 B25R4.1551014 O=C(c1nc2ccccc2o1)N3CCCC3c4ccccc4 WXVL_AN2347SE0704 [0,0,0,1,0,1|1,0,0]=3 552 B25R4.1551014 O=C(c1nc2ccccc2o1)N3CCCC3c4ccncc4 WXVL_AN2387SE0704 [0,0,0,1,0,1|2,0,0]=4 553 B25R4.1551014 O=C(c1nc2ccccc2o1)N3CCC[C@H]3c4ccccc4 WXVL_AN00549SE0704 [0,0,0,1,0,1|1,0,0]=3 554 B25R4.1551014 O=C(c1nc2ccccc2o1)N3CCC[C@H]3c4cccnc4 WXVL_AN00571SE0704 [0,0,0,1,0,1|2,0,0]=4 555 B25R4.1551014 O=C(c1nc2ncccn2n1)N3CCCC3c4ccccc4 WXVL_AN2347SE0103 [0,0,0,1,0,1|2,0,0]=4 556 B25R4.1551014 O=C(c1nc2ncccn2n1)N3CCCC3c4ccccc4 WXVL_AN2347SE0103 [0,0,0,1,0,1|2,0,0]=4 557 B25R4.1551014 O=C(c1nc2ncccn2n1)N3CCC[C@H]3c4ccccc4 WXVL_AN00549SE0103 [0,0,0,1,0,1|2,0,0]=4 558 B25R4.441814131 O=C(NC1COCc2c1cccc2)c3nc4ccccc4o3 WXVL_AK3889SE0704 [0,0,0,1,0,1|2,0,0]=4 559 B25R4.441814131 O=C(NC1COCc2c1cccc2)c3nc4ccccc4o3 WXVL_AK3889SE0704 [0,0,0,1,0,1|2,0,0]=4 560 B25R4.441814131 O=C(N[C@@H]1CCCc2c1cccc2)c3cc4ccccc4o3 WXVL_AK0134SE0105 [0,0,0,1,0,1|2,0,0]=4 561 B25R4.441814131 O=C(N[C@@H]1CCCc2c1cccc2)c3cc4ccccc4o3 WXVL_AK0134SE0105 [0,0,0,1,0,1|2,0,0]=4 562 B25R4.441814131 O=C(N[C@@H]1CCCc2c1cccc2)c3cc4cccnc4[nH]3 WXVL_AK0134SE0450 [0,0,0,1,0,1|1,0,1]=4 563 B25R4.441814131 O=C(N[C@@H]1CCCc2c1cccc2)c3cc4cccnc4[nH]3 WXVL_AK0134SE0450 [0,0,0,1,0,1|1,0,1]=4 564 B25R4.441814131 O=C(N[C@@H]1CCCc2c1cccc2)c3cc4cccnc4s3 WXVL_AK0134SE0061 [0,0,0,1,0,1|2,0,0]=4 565 B25R4.441814131 O=C(N[C@@H]1CCCc2c1cccc2)c3cc4cccnc4s3 WXVL_AK0134SE0061 [0,0,0,1,0,1|2,0,0]=4 566 B25R4.441814131 O=C(N[C@@H]1CCCc2c1cccc2)c3cc4cccnn4n3 WXVL_AK0134SC00097 [0,0,0,1,0,1|2,0,0]=4 567 B25R4.441814131 O=C(N[C@@H]1CCCc2c1cccc2)c3cc4cccnn4n3 WXVL_AK0134SC00097 [0,0,0,1,0,1|2,0,0]=4 568 B25R4.441814131 O=C(N[C@@H]1CCCc2c1cccc2)c3cc4ncccc4[nH]3 WXVL_AK0134SE0680 [0,0,0,1,0,1|2,0,0]=4 569 B25R4.441814131 O=C(N[C@@H]1CCCc2c1cccc2)c3cc4ncccc4[nH]3 WXVL_AK0134SE0680 [0,0,0,1,0,1|2,0,0]=4 570 B25R4.441814131 O=C(N[C@@H]1CCCc2c1cccc2)c3cn4cccnc4n3 WXVL_AK0134SE0332 [0,0,0,1,0,1|2,0,0]=4 571 B25R4.441814131 O=C(N[C@@H]1CCCc2c1cccc2)c3cn4cccnc4n3 WXVL_AK0134SE0332 [0,0,0,1,0,1|2,0,0]=4 572 B25R4.441814131 O=C(N[C@@H]1CCCc2c1cccc2)c3nc4ccccc4[nH]3 WXVL_AK0134SE0026 [0,0,0,1,0,1|2,0,0]=4 573 B25R4.441814131 O=C(N[C@@H]1CCCc2c1cccc2)c3nc4ccccc4[nH]3 WXVL_AK0134SE0026 [0,0,0,1,0,1|2,0,0]=4 574 B25R4.441814131 O=C(N[C@@H]1CCCc2c1cccc2)c3nc4ccccc4o3 WXVL_AK0134SE0704 [0,0,0,1,0,1|1,0,0]=3 575 B25R4.441814131 O=C(N[C@@H]1CCCc2c1cccc2)c3nc4ccccc4o3 WXVL_AK0134SE0704 [0,0,0,1,0,1|1,0,0]=3 576 B25R4.441814131 O=C(N[C@@H]1CCCc2c1cccc2)c3nc4ncccn4n3 WXVL_AK0134SE0103 [0,0,0,1,0,1|2,0,0]=4 577 B25R4.441814131 O=C(N[C@@H]1CCCc2c1cccc2)c3nc4ncccn4n3 WXVL_AK0134SE0103 [0,0,0,1,0,1|2,0,0]=4 578 B25R4.44533777 O=C(N[C@@H]1c2ccccc2C[C@@H]1O)c3nc4ccccc4o3 WXVL_AK0738SE0704 [0,1,0,1,0,0|2,0,0]=4 579 B25R4.44533777 O=C(N[C@@H]1c2ccccc2C[C@@H]1O)c3nc4ccccc4o3 WXVL_AK0738SE0704 [0,1,0,1,0,0|2,0,0]=4 580 B25R4.54390468 O=C(NCC1Cc2ccccc2C1)c3nc4ccccc4o3 WXVL_AK4882SE0704 [0,1,0,1,0,0|2,0,0]=4 581 B25R4.54390468 O=C(NCC1Cc2ccccc2C1)c3nc4ccccc4o3 WXVL_AK4882SE0704 [0,1,0,1,0,0|2,0,0]=4 582 B25R4.9295350 O=C(c1nc2ccccc2o1)N3CCC(C3)c4ccccc4 WXVL_AN00346SE0704 [0,1,0,1,0,0|2,0,0]=4 583 B25R4.9295350 O=C(c1nc2ccccc2o1)N3CCC(C3)c4ccccc4 WXVL_AN00346SE0704 [0,1,0,1,0,0|2,0,0]=4 584 B25R4.54465504 O=C(NC1CC(C1)c2ccccc2)c3nc4ccccc4o3 WXVL_AK2731SE0704 [0,1,0,1,0,0|2,0,0]=4 585 B25R4.54465504 O=C(NC1CC(C1)c2ccccc2)c3nc4ccccc4o3 WXVL_AK2731SE0704 [0,1,0,1,0,0|2,0,0]=4 586 B25R4.2321626 Cc1ccc2oc(cc2n1)C(=O)NC3CCc4c3cccc4 WXVL_AK1156SC00024 [0,1,0,1,0,0|2,0,0]=4 587 B25R4.2321626 Cc1ccc2oc(cc2n1)C(=O)NC3CCc4c3cccc4 WXVL_AK1156SC00024 [0,1,0,1,0,0|2,0,0]=4 588 B25R4.2321626 Cc1ccc2oc(cc2n1)C(=O)N[C@H]3CCc4c3cccc4 WXVL_AK00474SC00024 [0,1,0,1,0,0|2,0,0]=4 589 B25R4.2321626 Cc1ccc2oc(cc2n1)C(=O)N[C@H]3CCc4c3cccc4 WXVL_AK00474SC00024 [0,1,0,1,0,0|2,0,0]=4 590 B25R4.18927886 Cc1ccc2oc(cc2n1)C(=O)N3CCC3c4ccccc4 WXVL_AN3661SC00024 [0,1,0,1,0,0|2,0,0]=4 591 B25R4.6384223 O=C(c1nc2ccccc2o1)N3CCCc4ccccc4C3 WXVL_AN2963SE0704 [0,1,0,1,0,0|2,0,0]=4 592 B25R4.6384223 O=C(c1nc2ccccc2o1)N3CCCc4ccccc4C3 WXVL_AN2963SE0704 [0,1,0,1,0,0|2,0,0]=4 593 B25R4.43313204 O=C(N[C@H]1CCc2c1cccc2Br)c3nc4ccccc4o3 WXVL_AK00324SE0704 [0,1,0,1,0,0|2,0,0]=4 594 B25R4.43313204 O=C(N[C@H]1CCc2c1cccc2Br)c3nc4ccccc4o3 WXVL_AK00324SE0704 [0,1,0,1,0,0|2,0,0]=4 595 B25R4.54469131 O=C(NC1CCc2ccccc2C1)c3nc4ccccc4o3 WXVL_AK00343SE0704 [0,1,0,1,0,0|2,0,0]=4 596 B25R4.54469131 O=C(NC1CCc2ccccc2C1)c3nc4ccccc4o3 WXVL_AK00343SE0704 [0,1,0,1,0,0|2,0,0]=4 597 B25R4.65829374 O=C(NC1CC1c2ccc(cc2)Br)c3nc4ccccc4o3 WXVL_AK6624SE0704 [0,1,0,1,0,0|2,0,0]=4 598 B25R4.65829374 O=C(NC1CC1c2ccc(cc2)Br)c3nc4ccccc4o3 WXVL_AK6624SE0704 [0,1,0,1,0,0|2,0,0]=4 599 B25R4.251850039 O=C(NC1CCc2c1cc(cc2)Br)c3nc4ccccc4o3 WXVL_AK0489SE0704 [0,1,0,1,0,0|2,0,0]=4 600 B25R4.251850039 O=C(NC1CCc2c1cc(cc2)Br)c3nc4ccccc4o3 WXVL_AK0489SE0704 [0,1,0,1,0,0|2,0,0]=4 601 B25R4.251850039 O=C(NC1CCc2c1cc(cc2)Cl)c3nc4ccccc4o3 WXVL_AK2677SE0704 [0,1,0,1,0,0|2,0,0]=4 602 B25R4.251850039 O=C(NC1CCc2c1cc(cc2)Cl)c3nc4ccccc4o3 WXVL_AK2677SE0704 [0,1,0,1,0,0|2,0,0]=4 603 B25R4.251850039 O=C(N[C@@H]1CCc2c1cc(cc2)Br)c3nc4ccccc4o3 WXVL_AK00393SE0704 [0,1,0,1,0,0|2,0,0]=4 604 B25R4.251850039 O=C(N[C@@H]1CCc2c1cc(cc2)Br)c3nc4ccccc4o3 WXVL_AK00393SE0704 [0,1,0,1,0,0|2,0,0]=4 605 B21R2.142835 Cc1cccnc1NC(=O)CCCCc2ccccc2 WXVL_AF0013SB0460 [0,0,1,0,1,0|1,0,1]=4 606 B21R2.142835 Cc1cccnc1NC(=O)CCCCc2ccccc2 WXVL_AF0013SB0460 [0,0,1,0,1,0|1,0,1]=4 607 B21R2.142835 Cc1ncccc1NC(=O)CCCCc2ccccc2 WXVL_AF0055SB0460 [0,0,1,0,1,0|2,0,0]=4 608 B21R2.142835 Cc1ncccc1NC(=O)CCCCc2ccccc2 WXVL_AF0055SB0460 [0,0,1,0,1,0|2,0,0]=4 609 B21R2.142835 O=C(CCCCc1ccccc1)Nc2cccnc2Br WXVL_AF0399SB0460 [0,0,1,0,1,0|2,0,0]=4 610 B21R2.142835 O=C(CCCCc1ccccc1)Nc2cccnc2Br WXVL_AF0399SB0460 [0,0,1,0,1,0|2,0,0]=4 611 B21R2.142835 O=C(CCCCc1ccccc1)Nc2cccnc2Cl WXVL_AF0009SB0460 [0,0,1,0,1,0|2,0,0]=4 612 B21R2.142835 O=C(CCCCc1ccccc1)Nc2cccnc2Cl WXVL_AF0009SB0460 [0,0,1,0,1,0|2,0,0]=4 613 B21R2.142835 O=C(CCCCc1ccccc1)Nc2cccnc2F WXVL_AF0419SB0460 [0,0,1,0,1,0|2,0,0]=4 614 B21R2.142835 O=C(CCCCc1ccccc1)Nc2cccnc2F WXVL_AF0419SB0460 [0,0,1,0,1,0|2,0,0]=4 615 B21R2.142835 O=C(CCCCc1ccccc1)Nc2cccnc2I WXVL_AF0681SB0460 [0,0,1,0,1,0|2,0,0]=4 616 B21R2.142835 O=C(CCCCc1ccccc1)Nc2cccnc2I WXVL_AF0681SB0460 [0,0,1,0,1,0|2,0,0]=4 617 B21R2.142835 O=C(CCCCc1ccccc1)Nc2cccnc2O WXVL_AF0440SB0460 [0,0,1,0,1,0|2,0,0]=4 618 B21R2.142835 O=C(CCCCc1ccccc1)Nc2cccnc2O WXVL_AF0440SB0460 [0,0,1,0,1,0|2,0,0]=4 619 B21R2.142835 O=C(CCCCc1ccccc1)Nc2ncccc2Br WXVL_AF0053SB0460 [0,0,1,0,1,0|1,0,1]=4 620 B21R2.142835 O=C(CCCCc1ccccc1)Nc2ncccc2Br WXVL_AF0053SB0460 [0,0,1,0,1,0|1,0,1]=4 621 B21R2.142835 O=C(CCCCc1ccccc1)Nc2ncccc2Cl WXVL_AF1147SB0460 [0,0,1,0,1,0|1,0,1]=4 622 B21R2.142835 O=C(CCCCc1ccccc1)Nc2ncccc2Cl WXVL_AF1147SB0460 [0,0,1,0,1,0|1,0,1]=4 623 B21R2.142835 O=C(CCCCc1ccccc1)Nc2ncccc2F WXVL_AF0321SB0460 [0,0,1,0,1,0|1,0,1]=4 624 B21R2.142835 O=C(CCCCc1ccccc1)Nc2ncccc2F WXVL_AF0321SB0460 [0,0,1,0,1,0|1,0,1]=4 625 B21R2.142835 O=C(CCCCc1ccccc1)Nc2ncccc2I WXVL_AF0298SB0460 [0,0,1,0,1,0|1,0,1]=4 626 B21R2.142835 O=C(CCCCc1ccccc1)Nc2ncccc2I WXVL_AF0298SB0460 [0,0,1,0,1,0|1,0,1]=4 627 B21R2.142835 O=C(CCCCc1ccccc1)Nc2ncccc2O WXVL_AF0347SB0460 [0,0,1,0,1,0|0,0,1]=3 628 B21R2.142835 O=C(CCCCc1ccccc1)Nc2ncccc2O WXVL_AF0347SB0460 [0,0,1,0,1,0|0,0,1]=3 629 B21R3.2280253 O=C(NCc1ccccc1)c2nc3ccccc3o2 WXVL_AK00502SE0704 [0,0,0,0,2,0|2,0,0]=4 630 B21R3.2280253 O=C(NCc1ccccc1)c2nc3ccccc3o2 WXVL_AK00502SE0704 [0,0,0,0,2,0|2,0,0]=4 631 B23R2.477864 C/C(=C\c1cccnc1)/C(=O)NCCCCc2ccccc2 WXVL_AK00516SA1933 [0,0,1,0,0,1|2,0,0]=4 632 B23R2.477864 C/C(=C\c1cccnc1)/C(=O)NCCCCc2ccccc2 WXVL_AK00516SA1933 [0,0,1,0,0,1|2,0,0]=4 633 B23R3.19444863 O=C(CCCCc1ccccc1)Nc2nc3sccc3s2 WXVL_AF00158SB0460 [0,0,0,0,1,1|1,1,0]=4 634 B23R3.19444863 O=C(CCCCc1ccccc1)Nc2nc3sccc3s2 WXVL_AF00158SB0460 [0,0,0,0,1,1|1,1,0]=4 635 B23R3.938284 O=C(NCCc1ccccc1)c2ccc3cccnc3n2 WXVL_AK00498SE0284 [0,0,0,0,1,1|2,0,0]=4 636 B23R3.938284 O=C(NCCc1ccccc1)c2ccc3cccnc3n2 WXVL_AK00498SE0284 [0,0,0,0,1,1|2,0,0]=4 637 B25R3.3979048 O=C(NCCCCc1ccccc1)c2cc3ccccc3cn2 WXVL_AK00516SE0464 [0,0,0,0,0,2|2,0,0]=4 638 B25R3.3979048 O=C(NCCCCc1ccccc1)c2cc3ccccc3cn2 WXVL_AK00516SE0464 [0,0,0,0,0,2|2,0,0]=4 639 B25R3.3979048 O=C(NCCCCc1ccccc1)c2ccc3ccccc3n2 WXVL_AK00516SE0005 [0,0,0,0,0,2|2,0,0]=4 640 B25R3.3979048 O=C(NCCCCc1ccccc1)c2ccc3ccccc3n2 WXVL_AK00516SE0005 [0,0,0,0,0,2|2,0,0]=4 641 B25R3.3979048 O=C(NCCCCc1ccccc1)c2ccc3cccnc3c2 WXVL_AK00516SE0111 [0,0,0,0,0,2|2,0,0]=4 642 B25R3.3979048 O=C(NCCCCc1ccccc1)c2ccc3cccnc3c2 WXVL_AK00516SE0111 [0,0,0,0,0,2|2,0,0]=4 643 B25R3.3979048 O=C(NCCCCc1ccccc1)c2ccc3cccnc3n2 WXVL_AK00516SE0284 [0,0,0,0,0,2|1,0,0]=3 644 B25R3.3979048 O=C(NCCCCc1ccccc1)c2ccc3cccnc3n2 WXVL_AK00516SE0284 [0,0,0,0,0,2|1,0,0]=3 645 B25R3.3979048 O=C(NCCCCc1ccccc1)c2ccc3ncccc3c2 WXVL_AK00516SE0022 [0,0,0,0,0,2|2,0,0]=4 646 B25R3.3979048 O=C(NCCCCc1ccccc1)c2ccc3ncccc3c2 WXVL_AK00516SE0022 [0,0,0,0,0,2|2,0,0]=4 647 B25R3.3979048 O=C(NCCCCc1ccccc1)c2cnc3ccccc3c2 WXVL_AK00516SE0006 [0,0,0,0,0,2|2,0,0]=4 648 B25R3.3979048 O=C(NCCCCc1ccccc1)c2cnc3ccccc3c2 WXVL_AK00516SE0006 [0,0,0,0,0,2|2,0,0]=4 649 B25R3.3979048 O=C(NCCCCc1ccccc1)c2cnc3ccccc3n2 WXVL_AK00516SE0009 [0,0,0,0,0,2|2,0,0]=4 650 B25R3.3979048 O=C(NCCCCc1ccccc1)c2cnc3ccccc3n2 WXVL_AK00516SE0009 [0,0,0,0,0,2|2,0,0]=4 651 B25R3.3979048 O=C(NCCCOc1ccccc1)c2ccc3cccnc3n2 WXVL_AK2366SE0284 [0,0,0,0,0,2|2,0,0]=4 652 B25R3.3979048 O=C(NCCCOc1ccccc1)c2ccc3cccnc3n2 WXVL_AK2366SE0284 [0,0,0,0,0,2|2,0,0]=4 653 B25R3.3979048 O=C(NCCOCc1ccccc1)c2ccc3cccnc3n2 WXVL_AK1105SE0284 [0,0,0,0,0,2|2,0,0]=4 654 B25R3.3979048 O=C(NCCOCc1ccccc1)c2ccc3cccnc3n2 WXVL_AK1105SE0284 [0,0,0,0,0,2|2,0,0]=4 655 B25R3.32600701 O=C(CCCCc1ccccc1)Nc2cc3ccccc3cn2 WXVL_AF0786SB0460 [0,0,0,0,0,2|2,0,0]=4 656 B25R3.32600701 O=C(CCCCc1ccccc1)Nc2cc3ccccc3cn2 WXVL_AF0786SB0460 [0,0,0,0,0,2|2,0,0]=4 657 B25R3.32600701 O=C(CCCCc1ccccc1)Nc2ccc3ccccc3n2 WXVL_AF0062SB0460 [0,0,0,0,0,2|2,0,0]=4 658 B25R3.32600701 O=C(CCCCc1ccccc1)Nc2ccc3ccccc3n2 WXVL_AF0062SB0460 [0,0,0,0,0,2|2,0,0]=4 659 B25R3.32600701 O=C(CCCCc1ccccc1)Nc2ccc3cccnc3c2 WXVL_AG00053SB0460 [0,0,0,0,0,2|2,0,0]=4 660 B25R3.32600701 O=C(CCCCc1ccccc1)Nc2ccc3cccnc3c2 WXVL_AG00053SB0460 [0,0,0,0,0,2|2,0,0]=4 661 B25R3.32600701 O=C(CCCCc1ccccc1)Nc2ccc3ncccc3c2 WXVL_AG0010SB0460 [0,0,0,0,0,2|2,0,0]=4 662 B25R3.32600701 O=C(CCCCc1ccccc1)Nc2ccc3ncccc3c2 WXVL_AG0010SB0460 [0,0,0,0,0,2|2,0,0]=4 663 B25R3.32600701 O=C(CCCCc1ccccc1)Nc2cnc3ccccc3n2 WXVL_AF1307SB0460 [0,0,0,0,0,2|2,0,0]=4 664 B25R3.32600701 O=C(CCCCc1ccccc1)Nc2cnc3ccccc3n2 WXVL_AF1307SB0460 [0,0,0,0,0,2|2,0,0]=4 665 B25R3.32600701 O=C(CCCCc1ccccc1)Nc2cnc3cccnc3c2 WXVL_AF4340SB0460 [0,0,0,0,0,2|2,0,0]=4 666 B25R3.32600701 O=C(CCCCc1ccccc1)Nc2cnc3cccnc3c2 WXVL_AF4340SB0460 [0,0,0,0,0,2|2,0,0]=4 667 B25R3.32600701 O=C(CCCCc1ccccc1)Nc2ncc3ccccc3n2 WXVL_AF0170SB0460 [0,0,0,0,0,2|2,0,0]=4 668 B25R3.32600701 O=C(CCCCc1ccccc1)Nc2ncc3ccccc3n2 WXVL_AF0170SB0460 [0,0,0,0,0,2|2,0,0]=4 669 B25R3.32599566 O=C(CCCCc1ccccc1)NCc2cc3ccccc3o2 WXVL_AK2469SB0460 [0,0,0,0,0,2|2,0,0]=4 670 B25R3.32599566 O=C(CCCCc1ccccc1)NCc2cc3ccccc3o2 WXVL_AK2469SB0460 [0,0,0,0,0,2|2,0,0]=4 671 B25R3.32599566 O=C(CCCCc1ccccc1)NCc2nc3ccccc3[nH]2 WXVL_AK00465SB0460 [0,0,0,0,0,2|2,0,0]=4 672 B25R3.32599566 O=C(CCCCc1ccccc1)NCc2nc3ccccc3[nH]2 WXVL_AK00465SB0460 [0,0,0,0,0,2|2,0,0]=4 673 B25R3.32599566 O=C(CCCCc1ccccc1)NCc2nc3ccccc3s2 WXVL_AK0426SB0460 [0,0,0,0,0,2|1,1,0]=4 674 B25R3.32599566 O=C(CCCCc1ccccc1)NCc2nc3ccccc3s2 WXVL_AK0426SB0460 [0,0,0,0,0,2|1,1,0]=4 675 B25R3.32645266 O=C(NCCCOCc1ccccc1)c2cc3ccccc3o2 WXVL_AK2136SE0105 [0,0,0,0,0,2|2,0,0]=4 676 B25R3.32645266 O=C(NCCCOCc1ccccc1)c2cc3ccccc3o2 WXVL_AK2136SE0105 [0,0,0,0,0,2|2,0,0]=4 677 B25R3.32645266 O=C(NCCCOCc1ccccc1)c2cc3cccnc3[nH]2 WXVL_AK2136SE0450 [0,0,0,0,0,2|1,0,1]=4 678 B25R3.32645266 O=C(NCCCOCc1ccccc1)c2cc3cccnc3[nH]2 WXVL_AK2136SE0450 [0,0,0,0,0,2|1,0,1]=4 679 B25R3.32645266 O=C(NCCCOCc1ccccc1)c2cc3cccnc3s2 WXVL_AK2136SE0061 [0,0,0,0,0,2|2,0,0]=4 680 B25R3.32645266 O=C(NCCCOCc1ccccc1)c2cc3cccnc3s2 WXVL_AK2136SE0061 [0,0,0,0,0,2|2,0,0]=4 681 B25R3.32645266 O=C(NCCCOCc1ccccc1)c2cc3cccnn3n2 WXVL_AK2136SC00097 [0,0,0,0,0,2|2,0,0]=4 682 B25R3.32645266 O=C(NCCCOCc1ccccc1)c2cc3cccnn3n2 WXVL_AK2136SC00097 [0,0,0,0,0,2|2,0,0]=4 683 B25R3.32645266 O=C(NCCCOCc1ccccc1)c2cc3ncccc3[nH]2 WXVL_AK2136SE0680 [0,0,0,0,0,2|2,0,0]=4 684 B25R3.32645266 O=C(NCCCOCc1ccccc1)c2cc3ncccc3[nH]2 WXVL_AK2136SE0680 [0,0,0,0,0,2|2,0,0]=4 685 B25R3.32645266 O=C(NCCCOCc1ccccc1)c2cn3cccnc3n2 WXVL_AK2136SE0332 [0,0,0,0,0,2|2,0,0]=4 686 B25R3.32645266 O=C(NCCCOCc1ccccc1)c2cn3cccnc3n2 WXVL_AK2136SE0332 [0,0,0,0,0,2|2,0,0]=4 687 B25R3.32645266 O=C(NCCCOCc1ccccc1)c2nc3ccccc3[nH]2 WXVL_AK2136SE0026 [0,0,0,0,0,2|2,0,0]=4 688 B25R3.32645266 O=C(NCCCOCc1ccccc1)c2nc3ccccc3[nH]2 WXVL_AK2136SE0026 [0,0,0,0,0,2|2,0,0]=4 689 B25R3.32645266 O=C(NCCCOCc1ccccc1)c2nc3ccccc3o2 WXVL_AK2136SE0704 [0,0,0,0,0,2|1,0,0]=3 690 B25R3.32645266 O=C(NCCCOCc1ccccc1)c2nc3ccccc3o2 WXVL_AK2136SE0704 [0,0,0,0,0,2|1,0,0]=3 691 B25R3.32645266 O=C(NCCCOCc1ccccc1)c2nc3ncccn3n2 WXVL_AK2136SE0103 [0,0,0,0,0,2|2,0,0]=4 692 B25R3.32645266 O=C(NCCCOCc1ccccc1)c2nc3ncccn3n2 WXVL_AK2136SE0103 [0,0,0,0,0,2|2,0,0]=4