0 B16R3.5925 C1=C(CCC1)c2cc3ccccc3[nH]2 271570a_100000089523_100010232065 [0,0,0,0,0,0|3,0,1]=4 1 B16R3.5925 C1=C(CCC1)c2nc3ccccc3[nH]2 271570a_100000089523_100009814255 [0,0,0,0,0,0|2,0,1]=3 2 B16R3.5925 C1=C(CCC1)c2nc3ccccc3s2 271570a_100000089523_100000751744 [0,0,0,0,0,0|3,0,1]=4 3 B16R3.5925 C1=C(CCO1)c2cc3ccccc3[nH]2 271570a_100000118173_100010232065 [0,0,0,0,0,0|4,0,0]=4 4 B16R3.5925 C1=C(CCO1)c2nc3ccccc3[nH]2 271570a_100000118173_100009814255 [0,0,0,0,0,0|3,0,0]=3 5 B16R3.5925 C1=C(CCO1)c2nc3ccccc3s2 271570a_100000118173_100000751744 [0,0,0,0,0,0|4,0,0]=4 6 B16R3.5925 C1=C(COC1)c2cc3ccccc3[nH]2 271570a_100009872500_100010232065 [0,0,0,0,0,0|3,0,1]=4 7 B16R3.5925 C1=C(COC1)c2nc3ccccc3[nH]2 271570a_100009872500_100009814255 [0,0,0,0,0,0|2,0,1]=3 8 B16R3.5925 C1=C(COC1)c2nc3ccccc3s2 271570a_100009872500_100000751744 [0,0,0,0,0,0|3,0,1]=4 9 B16R3.5925 C1=C(Cc2c1cccc2)c3c[nH]cn3 271570a_100010239756_100000756875 [0,0,0,0,0,0|4,0,0]=4 10 B16R3.5925 C1=C(Cc2c1cccc2)c3cc[nH]n3 271570a_100010239756_100000062575 [0,0,0,0,0,0|2,0,0]=2 11 B16R3.5925 C1=C(Cc2c1cccc2)c3ccco3 271570a_100010239756_100009814098 [0,0,0,0,0,0|4,0,0]=4 12 B16R3.5925 C1=C(Cc2c1cccc2)c3cccs3 271570a_100010239756_100011215356 [0,0,0,0,0,0|4,0,0]=4 13 B16R3.5925 C1=C(Cc2c1cccc2)c3ccoc3 271570a_100010239756_100011215275 [0,0,0,0,0,0|4,0,0]=4 14 B16R3.5925 C1=C(Cc2c1cccc2)c3ccsc3 271570a_100010239756_100000738268 [0,0,0,0,0,0|4,0,0]=4 15 B16R3.5925 C1=C(Cc2c1cccc2)c3ccsn3 271570a_100010239756_100009818082 [0,0,0,0,0,0|3,0,0]=3 16 B16R3.5925 C1=C(Cc2c1cccc2)c3cn[nH]c3 271570a_100010239756_100000238712 [0,0,0,0,0,0|4,0,0]=4 17 B16R3.5925 C1=C(Cc2c1cccc2)c3cscn3 271570a_100010239756_100000751502 [0,0,0,0,0,0|4,0,0]=4 18 B16R3.5925 C1=C(Cc2c1cccc2)c3nc[nH]n3 271570a_100010239756_100000761765 [0,0,0,0,0,0|3,0,0]=3 19 B16R3.5925 C1=C(Cc2c1cccc2)c3ncc[nH]3 271570a_100010239756_100025796157 [0,0,0,0,0,0|4,0,0]=4 20 B16R3.5925 C1=C(Cc2c1cccc2)c3ncco3 271570a_100010239756_100011787736 [0,0,0,0,0,0|4,0,0]=4 21 B16R3.5925 C1=C(Cc2c1cccc2)c3nccs3 271570a_100010239756_100000211983 [0,0,0,0,0,0|4,0,0]=4 22 B16R3.5925 C1=C(Cc2c1cccc2)c3nncs3 271570a_100010239756_100000739804 [0,0,0,0,0,0|3,0,1]=4 23 B16R3.5925 C1=CCN(C1)c2nc3ccccc3[nH]2 27a_100015195280_100009814255 [0,0,0,0,0,0|3,0,1]=4 24 B16R3.5925 c1ccc2[nH]c(cc2c1)c3c[nH]cn3 271570a_100010206980_100000756875 [0,0,0,0,0,0|3,0,0]=3 25 B16R3.5925 c1ccc2[nH]c(cc2c1)c3cc[nH]c3 271570a_100000102155_100010232065 [0,0,0,0,0,0|2,0,0]=2 26 B16R3.5925 c1ccc2[nH]c(cc2c1)c3cc[nH]n3 271570a_100000062414_100010232065 [0,0,0,0,0,0|1,0,0]=1 27 B16R3.5925 c1ccc2[nH]c(cc2c1)c3cc[nH]n3 271570a_100010206980_100000062575 [0,0,0,0,0,0|1,0,0]=1 28 B16R3.5925 c1ccc2[nH]c(cc2c1)c3ccoc3 271570a_100010206980_100011215275 [0,0,0,0,0,0|3,0,0]=3 29 B16R3.5925 c1ccc2[nH]c(cc2c1)c3ccoc3 271570a_100011218838_100010232065 [0,0,0,0,0,0|3,0,0]=3 30 B16R3.5925 c1ccc2[nH]c(cc2c1)c3ccsc3 271570a_100010206980_100000738268 [0,0,0,0,0,0|3,0,0]=3 31 B16R3.5925 c1ccc2[nH]c(cc2c1)c3ccsc3 271570a_100011934443_100010232065 [0,0,0,0,0,0|3,0,0]=3 32 B16R3.5925 c1ccc2[nH]c(cc2c1)c3ccsn3 271570a_100010206980_100009818082 [0,0,0,0,0,0|2,0,0]=2 33 B16R3.5925 c1ccc2[nH]c(cc2c1)c3cn[nH]c3 271570a_100000041997_100010232065 [0,0,0,0,0,0|3,0,0]=3 34 B16R3.5925 c1ccc2[nH]c(cc2c1)c3cn[nH]c3 271570a_100010206980_100000238712 [0,0,0,0,0,0|3,0,0]=3 35 B16R3.5925 c1ccc2[nH]c(cc2c1)c3cnco3 271570a_100010206980_100020591547 [0,0,0,0,0,0|3,0,1]=4 36 B16R3.5925 c1ccc2[nH]c(cc2c1)c3cncs3 271570a_100010206980_100011934649 [0,0,0,0,0,0|3,0,1]=4 37 B16R3.5925 c1ccc2[nH]c(cc2c1)c3cncs3 271570a_100010231675_100010232065 [0,0,0,0,0,0|3,0,1]=4 38 B16R3.5925 c1ccc2[nH]c(cc2c1)c3cnoc3 271570a_100010206980_100009815712 [0,0,0,0,0,0|3,0,1]=4 39 B16R3.5925 c1ccc2[nH]c(cc2c1)c3cnsc3 271570a_100010206980_100009815736 [0,0,0,0,0,0|3,0,1]=4 40 B16R3.5925 c1ccc2[nH]c(cc2c1)c3cscn3 271570a_100010206980_100000751502 [0,0,0,0,0,0|3,0,0]=3 41 B16R3.5925 c1ccc2[nH]c(cc2c1)c3nc[nH]n3 271570a_100010206980_100000761765 [0,0,0,0,0,0|2,0,0]=2 42 B16R3.5925 c1ccc2[nH]c(cc2c1)c3ncc[nH]3 271570a_100010206980_100025796157 [0,0,0,0,0,0|3,0,0]=3 43 B16R3.5925 c1ccc2[nH]c(cc2c1)c3ncc[nH]3 271570a_100016988920_100010232065 [0,0,0,0,0,0|3,0,0]=3 44 B16R3.5925 c1ccc2[nH]c(cc2c1)c3ncco3 271570a_100010206980_100011787736 [0,0,0,0,0,0|3,0,0]=3 45 B16R3.5925 c1ccc2[nH]c(cc2c1)c3nccs3 271570a_100010206980_100000211983 [0,0,0,0,0,0|3,0,0]=3 46 B16R3.5925 c1ccc2[nH]c(cc2c1)c3ncns3 271570a_100010206980_100000693119 [0,0,0,0,0,0|3,0,1]=4 47 B16R3.5925 c1ccc2[nH]c(cc2c1)c3nncs3 271570a_100010206980_100000739804 [0,0,0,0,0,0|2,0,1]=3 48 B16R3.5925 c1ccc2[nH]c(nc2c1)c3cc[nH]c3 271570a_100000102155_100009814255 [0,0,0,0,0,0|1,0,0]=1 49 B16R3.5925 c1ccc2[nH]c(nc2c1)c3cc[nH]n3 271570a_100000062414_100009814255 [0,0,0,0,0,0|0,0,0]=0 50 B16R3.5925 c1ccc2[nH]c(nc2c1)c3ccoc3 271570a_100011218838_100009814255 [0,0,0,0,0,0|2,0,0]=2 51 B16R3.5925 c1ccc2[nH]c(nc2c1)c3ccsc3 271570a_100011934443_100009814255 [0,0,0,0,0,0|2,0,0]=2 52 B16R3.5925 c1ccc2[nH]c(nc2c1)c3cn[nH]c3 271570a_100000041997_100009814255 [0,0,0,0,0,0|2,0,0]=2 53 B16R3.5925 c1ccc2[nH]c(nc2c1)c3cncs3 271570a_100010231675_100009814255 [0,0,0,0,0,0|2,0,1]=3 54 B16R3.5925 c1ccc2[nH]c(nc2c1)c3ncc[nH]3 271570a_100016988920_100009814255 [0,0,0,0,0,0|2,0,0]=2 55 B16R3.5925 c1ccc2oc(cc2c1)c3c[nH]cn3 271570a_100011328764_100000756875 [0,0,0,0,0,0|4,0,0]=4 56 B16R3.5925 c1ccc2oc(cc2c1)c3cc[nH]c3 271570a_100000102155_100010159458 [0,0,0,0,0,0|3,0,0]=3 57 B16R3.5925 c1ccc2oc(cc2c1)c3cc[nH]n3 271570a_100000062414_100010159458 [0,0,0,0,0,0|2,0,0]=2 58 B16R3.5925 c1ccc2oc(cc2c1)c3cc[nH]n3 271570a_100011328764_100000062575 [0,0,0,0,0,0|2,0,0]=2 59 B16R3.5925 c1ccc2oc(cc2c1)c3ccoc3 271570a_100011218838_100010159458 [0,0,0,0,0,0|4,0,0]=4 60 B16R3.5925 c1ccc2oc(cc2c1)c3ccoc3 271570a_100011328764_100011215275 [0,0,0,0,0,0|4,0,0]=4 61 B16R3.5925 c1ccc2oc(cc2c1)c3ccsc3 271570a_100011328764_100000738268 [0,0,0,0,0,0|4,0,0]=4 62 B16R3.5925 c1ccc2oc(cc2c1)c3ccsc3 271570a_100011934443_100010159458 [0,0,0,0,0,0|4,0,0]=4 63 B16R3.5925 c1ccc2oc(cc2c1)c3ccsn3 271570a_100011328764_100009818082 [0,0,0,0,0,0|3,0,0]=3 64 B16R3.5925 c1ccc2oc(cc2c1)c3cn[nH]c3 271570a_100000041997_100010159458 [0,0,0,0,0,0|4,0,0]=4 65 B16R3.5925 c1ccc2oc(cc2c1)c3cn[nH]c3 271570a_100011328764_100000238712 [0,0,0,0,0,0|4,0,0]=4 66 B16R3.5925 c1ccc2oc(cc2c1)c3cscn3 271570a_100011328764_100000751502 [0,0,0,0,0,0|4,0,0]=4 67 B16R3.5925 c1ccc2oc(cc2c1)c3nc[nH]n3 271570a_100011328764_100000761765 [0,0,0,0,0,0|3,0,0]=3 68 B16R3.5925 c1ccc2oc(cc2c1)c3ncc[nH]3 271570a_100011328764_100025796157 [0,0,0,0,0,0|4,0,0]=4 69 B16R3.5925 c1ccc2oc(cc2c1)c3ncc[nH]3 271570a_100016988920_100010159458 [0,0,0,0,0,0|4,0,0]=4 70 B16R3.5925 c1ccc2oc(cc2c1)c3ncco3 271570a_100011328764_100011787736 [0,0,0,0,0,0|4,0,0]=4 71 B16R3.5925 c1ccc2oc(cc2c1)c3nccs3 271570a_100011328764_100000211983 [0,0,0,0,0,0|4,0,0]=4 72 B16R3.5925 c1ccc2oc(cc2c1)c3nncs3 271570a_100011328764_100000739804 [0,0,0,0,0,0|3,0,1]=4 73 B16R3.5925 c1ccc2sc(cc2c1)c3c[nH]cn3 271570a_100000034353_100000756875 [0,0,0,0,0,0|4,0,0]=4 74 B16R3.5925 c1ccc2sc(cc2c1)c3cc[nH]c3 271570a_100000102155_100009816949 [0,0,0,0,0,0|3,0,0]=3 75 B16R3.5925 c1ccc2sc(cc2c1)c3cc[nH]n3 271570a_100000034353_100000062575 [0,0,0,0,0,0|2,0,0]=2 76 B16R3.5925 c1ccc2sc(cc2c1)c3cc[nH]n3 271570a_100000062414_100009816949 [0,0,0,0,0,0|2,0,0]=2 77 B16R3.5925 c1ccc2sc(cc2c1)c3ccoc3 271570a_100000034353_100011215275 [0,0,0,0,0,0|4,0,0]=4 78 B16R3.5925 c1ccc2sc(cc2c1)c3ccoc3 271570a_100011218838_100009816949 [0,0,0,0,0,0|4,0,0]=4 79 B16R3.5925 c1ccc2sc(cc2c1)c3ccsc3 271570a_100000034353_100000738268 [0,0,0,0,0,0|4,0,0]=4 80 B16R3.5925 c1ccc2sc(cc2c1)c3ccsc3 271570a_100011934443_100009816949 [0,0,0,0,0,0|4,0,0]=4 81 B16R3.5925 c1ccc2sc(cc2c1)c3ccsn3 271570a_100000034353_100009818082 [0,0,0,0,0,0|3,0,0]=3 82 B16R3.5925 c1ccc2sc(cc2c1)c3cn[nH]c3 271570a_100000034353_100000238712 [0,0,0,0,0,0|4,0,0]=4 83 B16R3.5925 c1ccc2sc(cc2c1)c3cn[nH]c3 271570a_100000041997_100009816949 [0,0,0,0,0,0|4,0,0]=4 84 B16R3.5925 c1ccc2sc(cc2c1)c3cscn3 271570a_100000034353_100000751502 [0,0,0,0,0,0|4,0,0]=4 85 B16R3.5925 c1ccc2sc(cc2c1)c3nc[nH]n3 271570a_100000034353_100000761765 [0,0,0,0,0,0|3,0,0]=3 86 B16R3.5925 c1ccc2sc(cc2c1)c3ncc[nH]3 271570a_100000034353_100025796157 [0,0,0,0,0,0|4,0,0]=4 87 B16R3.5925 c1ccc2sc(cc2c1)c3ncc[nH]3 271570a_100016988920_100009816949 [0,0,0,0,0,0|4,0,0]=4 88 B16R3.5925 c1ccc2sc(cc2c1)c3ncco3 271570a_100000034353_100011787736 [0,0,0,0,0,0|4,0,0]=4 89 B16R3.5925 c1ccc2sc(cc2c1)c3nccs3 271570a_100000034353_100000211983 [0,0,0,0,0,0|4,0,0]=4 90 B16R3.5925 c1ccc2sc(cc2c1)c3nncs3 271570a_100000034353_100000739804 [0,0,0,0,0,0|3,0,1]=4 91 B16R3.5925 c1ccc2sc(nc2c1)c3c[nH]cn3 271570a_200000082171_100000756875 [0,0,0,0,0,0|3,0,0]=3 92 B16R3.5925 c1ccc2sc(nc2c1)c3cc[nH]c3 271570a_100000102155_100000751744 [0,0,0,0,0,0|2,0,0]=2 93 B16R3.5925 c1ccc2sc(nc2c1)c3cc[nH]n3 271570a_100000062414_100000751744 [0,0,0,0,0,0|1,0,0]=1 94 B16R3.5925 c1ccc2sc(nc2c1)c3cc[nH]n3 271570a_200000082171_100000062575 [0,0,0,0,0,0|1,0,0]=1 95 B16R3.5925 c1ccc2sc(nc2c1)c3ccoc3 271570a_100011218838_100000751744 [0,0,0,0,0,0|3,0,0]=3 96 B16R3.5925 c1ccc2sc(nc2c1)c3ccoc3 271570a_200000082171_100011215275 [0,0,0,0,0,0|3,0,0]=3 97 B16R3.5925 c1ccc2sc(nc2c1)c3ccsc3 271570a_100011934443_100000751744 [0,0,0,0,0,0|3,0,0]=3 98 B16R3.5925 c1ccc2sc(nc2c1)c3ccsc3 271570a_200000082171_100000738268 [0,0,0,0,0,0|3,0,0]=3 99 B16R3.5925 c1ccc2sc(nc2c1)c3ccsn3 271570a_200000082171_100009818082 [0,0,0,0,0,0|2,0,0]=2 100 B16R3.5925 c1ccc2sc(nc2c1)c3cn[nH]c3 271570a_100000041997_100000751744 [0,0,0,0,0,0|3,0,0]=3 101 B16R3.5925 c1ccc2sc(nc2c1)c3cn[nH]c3 271570a_200000082171_100000238712 [0,0,0,0,0,0|3,0,0]=3 102 B16R3.5925 c1ccc2sc(nc2c1)c3cnco3 271570a_200000082171_100020591547 [0,0,0,0,0,0|3,0,1]=4 103 B16R3.5925 c1ccc2sc(nc2c1)c3cncs3 271570a_100010231675_100000751744 [0,0,0,0,0,0|3,0,1]=4 104 B16R3.5925 c1ccc2sc(nc2c1)c3cncs3 271570a_200000082171_100011934649 [0,0,0,0,0,0|3,0,1]=4 105 B16R3.5925 c1ccc2sc(nc2c1)c3cnoc3 271570a_200000082171_100009815712 [0,0,0,0,0,0|3,0,1]=4 106 B16R3.5925 c1ccc2sc(nc2c1)c3cnsc3 271570a_200000082171_100009815736 [0,0,0,0,0,0|3,0,1]=4 107 B16R3.5925 c1ccc2sc(nc2c1)c3cscn3 271570a_200000082171_100000751502 [0,0,0,0,0,0|3,0,0]=3 108 B16R3.5925 c1ccc2sc(nc2c1)c3nc[nH]n3 271570a_200000082171_100000761765 [0,0,0,0,0,0|2,0,0]=2 109 B16R3.5925 c1ccc2sc(nc2c1)c3ncc[nH]3 271570a_100016988920_100000751744 [0,0,0,0,0,0|3,0,0]=3 110 B16R3.5925 c1ccc2sc(nc2c1)c3ncc[nH]3 271570a_200000082171_100025796157 [0,0,0,0,0,0|3,0,0]=3 111 B16R3.5925 c1ccc2sc(nc2c1)c3ncco3 271570a_200000082171_100011787736 [0,0,0,0,0,0|3,0,0]=3 112 B16R3.5925 c1ccc2sc(nc2c1)c3nccs3 271570a_200000082171_100000211983 [0,0,0,0,0,0|3,0,0]=3 113 B16R3.5925 c1ccc2sc(nc2c1)c3ncns3 271570a_200000082171_100000693119 [0,0,0,0,0,0|3,0,1]=4 114 B16R3.5925 c1ccc2sc(nc2c1)c3nncs3 271570a_200000082171_100000739804 [0,0,0,0,0,0|2,0,1]=3 115 B16R3.5925 c1ccn2cc(nc2c1)c3cc[nH]c3 271570a_100000102155_100009819586 [0,0,0,0,0,0|3,0,0]=3 116 B16R3.5925 c1ccn2cc(nc2c1)c3cc[nH]n3 271570a_100000062414_100009819586 [0,0,0,0,0,0|2,0,0]=2 117 B16R3.5925 c1ccn2cc(nc2c1)c3ccoc3 271570a_100011218838_100009819586 [0,0,0,0,0,0|4,0,0]=4 118 B16R3.5925 c1ccn2cc(nc2c1)c3ccsc3 271570a_100011934443_100009819586 [0,0,0,0,0,0|4,0,0]=4 119 B16R3.5925 c1ccn2cc(nc2c1)c3cn[nH]c3 271570a_100000041997_100009819586 [0,0,0,0,0,0|4,0,0]=4 120 B16R3.5925 c1ccn2cc(nc2c1)c3ncc[nH]3 271570a_100016988920_100009819586 [0,0,0,0,0,0|4,0,0]=4 121 B16R3.5925 c1cn2nc(nc2cn1)c3cc[nH]c3 271570a_100000102155_100010748104 [0,0,0,0,0,0|3,0,1]=4 122 B16R3.5925 c1cn2nc(nc2cn1)c3cc[nH]n3 271570a_100000062414_100010748104 [0,0,0,0,0,0|2,0,1]=3 123 B16R3.5925 c1cnc2[nH]c(cc2c1)c3cc[nH]c3 271570a_100000102155_100010079843 [0,0,0,0,0,0|3,0,0]=3 124 B16R3.5925 c1cnc2[nH]c(cc2c1)c3cc[nH]n3 271570a_100000062414_100010079843 [0,0,0,0,0,0|2,0,0]=2 125 B16R3.5925 c1cnc2[nH]c(cc2c1)c3ccoc3 271570a_100011218838_100010079843 [0,0,0,0,0,0|4,0,0]=4 126 B16R3.5925 c1cnc2[nH]c(cc2c1)c3ccsc3 271570a_100011934443_100010079843 [0,0,0,0,0,0|4,0,0]=4 127 B16R3.5925 c1cnc2[nH]c(cc2c1)c3cn[nH]c3 271570a_100000041997_100010079843 [0,0,0,0,0,0|4,0,0]=4 128 B16R3.5925 c1cnc2[nH]c(cc2c1)c3ncc[nH]3 271570a_100016988920_100010079843 [0,0,0,0,0,0|4,0,0]=4 129 B16R3.5925 c1cnc2sc(nc2c1)c3cc[nH]c3 271570a_100000102155_100010188088 [0,0,0,0,0,0|3,0,0]=3 130 B16R3.5925 c1cnc2sc(nc2c1)c3cc[nH]n3 271570a_100000062414_100010188088 [0,0,0,0,0,0|2,0,0]=2 131 B16R3.5925 c1cnc2sc(nc2c1)c3ccoc3 271570a_100011218838_100010188088 [0,0,0,0,0,0|4,0,0]=4 132 B16R3.5925 c1cnc2sc(nc2c1)c3ccsc3 271570a_100011934443_100010188088 [0,0,0,0,0,0|4,0,0]=4 133 B16R3.5925 c1cnc2sc(nc2c1)c3cn[nH]c3 271570a_100000041997_100010188088 [0,0,0,0,0,0|4,0,0]=4 134 B16R3.5925 c1cnc2sc(nc2c1)c3ncc[nH]3 271570a_100016988920_100010188088 [0,0,0,0,0,0|4,0,0]=4 135 B16R3.5925 c1cnn2cc(nc2c1)c3cc[nH]c3 271570a_100000102155_200010296001 [0,0,0,0,0,0|4,0,0]=4 136 B16R3.5925 c1cnn2cc(nc2c1)c3cc[nH]n3 271570a_100000062414_200010296001 [0,0,0,0,0,0|3,0,0]=3 137 B16R3.5925 c1coc(c1)c2cc3ccccc3[nH]2 271570a_100000750936_100010232065 [0,0,0,0,0,0|3,0,0]=3 138 B16R3.5925 c1coc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_100009814098 [0,0,0,0,0,0|3,0,0]=3 139 B16R3.5925 c1coc(c1)c2cc3ccccc3o2 271570a_100000750936_100010159458 [0,0,0,0,0,0|4,0,0]=4 140 B16R3.5925 c1coc(c1)c2cc3ccccc3o2 271570a_100011328764_100009814098 [0,0,0,0,0,0|4,0,0]=4 141 B16R3.5925 c1coc(c1)c2cc3ccccc3s2 271570a_100000034353_100009814098 [0,0,0,0,0,0|4,0,0]=4 142 B16R3.5925 c1coc(c1)c2cc3ccccc3s2 271570a_100000750936_100009816949 [0,0,0,0,0,0|4,0,0]=4 143 B16R3.5925 c1coc(c1)c2cc3cccnc3[nH]2 271570a_100000750936_100010079843 [0,0,0,0,0,0|4,0,0]=4 144 B16R3.5925 c1coc(c1)c2cn3ccccc3n2 271570a_100000750936_100009819586 [0,0,0,0,0,0|4,0,0]=4 145 B16R3.5925 c1coc(c1)c2nc3ccccc3[nH]2 271570a_100000750936_100009814255 [0,0,0,0,0,0|2,0,0]=2 146 B16R3.5925 c1coc(c1)c2nc3ccccc3s2 271570a_100000750936_100000751744 [0,0,0,0,0,0|3,0,0]=3 147 B16R3.5925 c1coc(c1)c2nc3ccccc3s2 271570a_200000082171_100009814098 [0,0,0,0,0,0|3,0,0]=3 148 B16R3.5925 c1coc(c1)c2nc3cccnc3s2 271570a_100000750936_100010188088 [0,0,0,0,0,0|4,0,0]=4 149 B16R3.5925 c1csc(c1)c2cc3ccccc3[nH]2 271570a_100000742291_100010232065 [0,0,0,0,0,0|3,0,0]=3 150 B16R3.5925 c1csc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_100011215356 [0,0,0,0,0,0|3,0,0]=3 151 B16R3.5925 c1csc(c1)c2cc3ccccc3o2 271570a_100000742291_100010159458 [0,0,0,0,0,0|4,0,0]=4 152 B16R3.5925 c1csc(c1)c2cc3ccccc3o2 271570a_100011328764_100011215356 [0,0,0,0,0,0|4,0,0]=4 153 B16R3.5925 c1csc(c1)c2cc3ccccc3s2 271570a_100000034353_100011215356 [0,0,0,0,0,0|4,0,0]=4 154 B16R3.5925 c1csc(c1)c2cc3ccccc3s2 271570a_100000742291_100009816949 [0,0,0,0,0,0|4,0,0]=4 155 B16R3.5925 c1csc(c1)c2cc3cccnc3[nH]2 271570a_100000742291_100010079843 [0,0,0,0,0,0|4,0,0]=4 156 B16R3.5925 c1csc(c1)c2cn3ccccc3n2 271570a_100000742291_100009819586 [0,0,0,0,0,0|4,0,0]=4 157 B16R3.5925 c1csc(c1)c2nc3ccccc3[nH]2 271570a_100000742291_100009814255 [0,0,0,0,0,0|2,0,0]=2 158 B16R3.5925 c1csc(c1)c2nc3ccccc3s2 271570a_100000742291_100000751744 [0,0,0,0,0,0|3,0,0]=3 159 B16R3.5925 c1csc(c1)c2nc3ccccc3s2 271570a_200000082171_100011215356 [0,0,0,0,0,0|3,0,0]=3 160 B16R3.5925 c1csc(c1)c2nc3cccnc3s2 271570a_100000742291_100010188088 [0,0,0,0,0,0|4,0,0]=4 161 B17R3.3423 Cc1c(oc2c1cccc2)c3cc[nH]n3 271570a_100009874717_100000062575 [0,1,0,0,0,0|2,0,0]=3 162 B17R3.3423 Cc1c(oc2c1cccc2)c3ccsn3 271570a_100009874717_100009818082 [0,1,0,0,0,0|3,0,0]=4 163 B17R3.3423 Cc1c(oc2c1cccc2)c3nc[nH]n3 271570a_100009874717_100000761765 [0,1,0,0,0,0|3,0,0]=4 164 B17R3.3423 Cc1c(sc2c1cccc2)c3cc[nH]c3 271570a_100000102155_200010198769 [0,1,0,0,0,0|3,0,0]=4 165 B17R3.3423 Cc1c(sc2c1cccc2)c3cc[nH]n3 271570a_100000062414_200010198769 [0,1,0,0,0,0|2,0,0]=3 166 B17R3.3423 Cn1c(cc2c1cccc2)c3c[nH]cn3 271570a_100010171889_100000756875 [0,1,0,0,0,0|3,0,0]=4 167 B17R3.3423 Cn1c(cc2c1cccc2)c3cc[nH]n3 271570a_100010171889_100000062575 [0,1,0,0,0,0|1,0,0]=2 168 B17R3.3423 Cn1c(cc2c1cccc2)c3ccco3 271570a_100010171889_100009814098 [0,1,0,0,0,0|3,0,0]=4 169 B17R3.3423 Cn1c(cc2c1cccc2)c3cccs3 271570a_100010171889_100011215356 [0,1,0,0,0,0|3,0,0]=4 170 B17R3.3423 Cn1c(cc2c1cccc2)c3ccoc3 271570a_100010171889_100011215275 [0,1,0,0,0,0|3,0,0]=4 171 B17R3.3423 Cn1c(cc2c1cccc2)c3ccsc3 271570a_100010171889_100000738268 [0,1,0,0,0,0|3,0,0]=4 172 B17R3.3423 Cn1c(cc2c1cccc2)c3ccsn3 271570a_100010171889_100009818082 [0,1,0,0,0,0|2,0,0]=3 173 B17R3.3423 Cn1c(cc2c1cccc2)c3cn[nH]c3 271570a_100010171889_100000238712 [0,1,0,0,0,0|3,0,0]=4 174 B17R3.3423 Cn1c(cc2c1cccc2)c3cscn3 271570a_100010171889_100000751502 [0,1,0,0,0,0|3,0,0]=4 175 B17R3.3423 Cn1c(cc2c1cccc2)c3nc[nH]n3 271570a_100010171889_100000761765 [0,1,0,0,0,0|2,0,0]=3 176 B17R3.3423 Cn1c(cc2c1cccc2)c3ncc[nH]3 271570a_100010171889_100025796157 [0,1,0,0,0,0|3,0,0]=4 177 B17R3.3423 Cn1c(cc2c1cccc2)c3ncco3 271570a_100010171889_100011787736 [0,1,0,0,0,0|3,0,0]=4 178 B17R3.3423 Cn1c(cc2c1cccc2)c3nccs3 271570a_100010171889_100000211983 [0,1,0,0,0,0|3,0,0]=4 179 B17R3.3423 Cn1c(cc2c1cccc2)c3nncs3 271570a_100010171889_100000739804 [0,1,0,0,0,0|2,0,1]=4 180 B17R3.3423 Cn1c(nc2c1cccc2)C3=CCCC3 271570a_100000089523_200000239431 [0,1,0,0,0,0|2,0,1]=4 181 B17R3.3423 Cn1c(nc2c1cccc2)C3=CCOC3 271570a_100009872500_200000239431 [0,1,0,0,0,0|2,0,1]=4 182 B17R3.3423 Cn1c(nc2c1cccc2)C3=COCC3 271570a_100000118173_200000239431 [0,1,0,0,0,0|3,0,0]=4 183 B17R3.3423 Cn1c(nc2c1cccc2)c3cc[nH]c3 271570a_100000102155_200000239431 [0,1,0,0,0,0|1,0,0]=2 184 B17R3.3423 Cn1c(nc2c1cccc2)c3cc[nH]n3 271570a_100000062414_200000239431 [0,1,0,0,0,0|0,0,0]=1 185 B17R3.3423 Cn1c(nc2c1cccc2)c3ccco3 271570a_100000750936_200000239431 [0,1,0,0,0,0|2,0,0]=3 186 B17R3.3423 Cn1c(nc2c1cccc2)c3cccs3 271570a_100000742291_200000239431 [0,1,0,0,0,0|2,0,0]=3 187 B17R3.3423 Cn1c(nc2c1cccc2)c3ccoc3 271570a_100011218838_200000239431 [0,1,0,0,0,0|2,0,0]=3 188 B17R3.3423 Cn1c(nc2c1cccc2)c3ccsc3 271570a_100011934443_200000239431 [0,1,0,0,0,0|2,0,0]=3 189 B17R3.3423 Cn1c(nc2c1cccc2)c3cn[nH]c3 271570a_100000041997_200000239431 [0,1,0,0,0,0|2,0,0]=3 190 B17R3.3423 Cn1c(nc2c1cccc2)c3cncs3 271570a_100010231675_200000239431 [0,1,0,0,0,0|2,0,1]=4 191 B17R3.3423 Cn1c(nc2c1cccc2)c3ncc[nH]3 271570a_100016988920_200000239431 [0,1,0,0,0,0|2,0,0]=3 192 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3c[nH]cn3 271570a_200010246277_100000756875 [0,1,0,0,0,0|3,0,0]=4 193 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3cc[nH]c3 271570a_100000102155_100135389745 [0,1,0,0,0,0|2,0,0]=3 194 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3cc[nH]n3 271570a_100000062414_100135389745 [0,1,0,0,0,0|1,0,0]=2 195 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3cc[nH]n3 271570a_200010246277_100000062575 [0,1,0,0,0,0|1,0,0]=2 196 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3ccco3 271570a_100000750936_100135389745 [0,1,0,0,0,0|3,0,0]=4 197 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3ccco3 271570a_200010246277_100009814098 [0,1,0,0,0,0|3,0,0]=4 198 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3cccs3 271570a_100000742291_100135389745 [0,1,0,0,0,0|3,0,0]=4 199 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3cccs3 271570a_200010246277_100011215356 [0,1,0,0,0,0|3,0,0]=4 200 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3ccoc3 271570a_100011218838_100135389745 [0,1,0,0,0,0|3,0,0]=4 201 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3ccoc3 271570a_200010246277_100011215275 [0,1,0,0,0,0|3,0,0]=4 202 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3ccsc3 271570a_100011934443_100135389745 [0,1,0,0,0,0|3,0,0]=4 203 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3ccsc3 271570a_200010246277_100000738268 [0,1,0,0,0,0|3,0,0]=4 204 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3ccsn3 271570a_200010246277_100009818082 [0,1,0,0,0,0|2,0,0]=3 205 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3cn[nH]c3 271570a_100000041997_100135389745 [0,1,0,0,0,0|3,0,0]=4 206 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3cn[nH]c3 271570a_200010246277_100000238712 [0,1,0,0,0,0|3,0,0]=4 207 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3cscn3 271570a_200010246277_100000751502 [0,1,0,0,0,0|3,0,0]=4 208 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3nc[nH]n3 271570a_200010246277_100000761765 [0,1,0,0,0,0|2,0,0]=3 209 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3ncc[nH]3 271570a_100016988920_100135389745 [0,1,0,0,0,0|3,0,0]=4 210 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3ncc[nH]3 271570a_200010246277_100025796157 [0,1,0,0,0,0|3,0,0]=4 211 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3ncco3 271570a_200010246277_100011787736 [0,1,0,0,0,0|3,0,0]=4 212 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3nccs3 271570a_200010246277_100000211983 [0,1,0,0,0,0|3,0,0]=4 213 B17R3.4464 Brc1cccc2c1[nH]c(c2)c3nncs3 271570a_200010246277_100000739804 [0,1,0,0,0,0|2,0,1]=4 214 B17R3.4464 Cc1cccc2c1[nH]c(c2)c3c[nH]cn3 271570a_100010246273_100000756875 [0,1,0,0,0,0|3,0,0]=4 215 B17R3.4464 Cc1cccc2c1[nH]c(c2)c3cc[nH]n3 271570a_100010246273_100000062575 [0,1,0,0,0,0|1,0,0]=2 216 B17R3.4464 Cc1cccc2c1[nH]c(c2)c3ccco3 271570a_100010246273_100009814098 [0,1,0,0,0,0|3,0,0]=4 217 B17R3.4464 Cc1cccc2c1[nH]c(c2)c3cccs3 271570a_100010246273_100011215356 [0,1,0,0,0,0|3,0,0]=4 218 B17R3.4464 Cc1cccc2c1[nH]c(c2)c3ccoc3 271570a_100010246273_100011215275 [0,1,0,0,0,0|3,0,0]=4 219 B17R3.4464 Cc1cccc2c1[nH]c(c2)c3ccsc3 271570a_100010246273_100000738268 [0,1,0,0,0,0|3,0,0]=4 220 B17R3.4464 Cc1cccc2c1[nH]c(c2)c3ccsn3 271570a_100010246273_100009818082 [0,1,0,0,0,0|2,0,0]=3 221 B17R3.4464 Cc1cccc2c1[nH]c(c2)c3cn[nH]c3 271570a_100010246273_100000238712 [0,1,0,0,0,0|3,0,0]=4 222 B17R3.4464 Cc1cccc2c1[nH]c(c2)c3cscn3 271570a_100010246273_100000751502 [0,1,0,0,0,0|3,0,0]=4 223 B17R3.4464 Cc1cccc2c1[nH]c(c2)c3nc[nH]n3 271570a_100010246273_100000761765 [0,1,0,0,0,0|2,0,0]=3 224 B17R3.4464 Cc1cccc2c1[nH]c(c2)c3ncc[nH]3 271570a_100010246273_100025796157 [0,1,0,0,0,0|3,0,0]=4 225 B17R3.4464 Cc1cccc2c1[nH]c(c2)c3ncco3 271570a_100010246273_100011787736 [0,1,0,0,0,0|3,0,0]=4 226 B17R3.4464 Cc1cccc2c1[nH]c(c2)c3nccs3 271570a_100010246273_100000211983 [0,1,0,0,0,0|3,0,0]=4 227 B17R3.4464 Cc1cccc2c1[nH]c(c2)c3nncs3 271570a_100010246273_100000739804 [0,1,0,0,0,0|2,0,1]=4 228 B17R3.4464 Cc1cccc2c1nc(s2)c3cc[nH]c3 271570a_100000102155_100010008827 [0,1,0,0,0,0|2,0,0]=3 229 B17R3.4464 Cc1cccc2c1nc(s2)c3cc[nH]n3 271570a_100000062414_100010008827 [0,1,0,0,0,0|1,0,0]=2 230 B17R3.4464 Cc1cccc2c1nc(s2)c3ccco3 271570a_100000750936_100010008827 [0,1,0,0,0,0|3,0,0]=4 231 B17R3.4464 Cc1cccc2c1nc(s2)c3cccs3 271570a_100000742291_100010008827 [0,1,0,0,0,0|3,0,0]=4 232 B17R3.4464 Cc1cccc2c1nc(s2)c3ccoc3 271570a_100011218838_100010008827 [0,1,0,0,0,0|3,0,0]=4 233 B17R3.4464 Cc1cccc2c1nc(s2)c3ccsc3 271570a_100011934443_100010008827 [0,1,0,0,0,0|3,0,0]=4 234 B17R3.4464 Cc1cccc2c1nc(s2)c3cn[nH]c3 271570a_100000041997_100010008827 [0,1,0,0,0,0|3,0,0]=4 235 B17R3.4464 Cc1cccc2c1nc(s2)c3ncc[nH]3 271570a_100016988920_100010008827 [0,1,0,0,0,0|3,0,0]=4 236 B17R3.4464 Clc1cccc2c1[nH]c(c2)c3c[nH]cn3 271570a_100015811879_100000756875 [0,1,0,0,0,0|3,0,0]=4 237 B17R3.4464 Clc1cccc2c1[nH]c(c2)c3cc[nH]n3 271570a_100015811879_100000062575 [0,1,0,0,0,0|1,0,0]=2 238 B17R3.4464 Clc1cccc2c1[nH]c(c2)c3ccco3 271570a_100015811879_100009814098 [0,1,0,0,0,0|3,0,0]=4 239 B17R3.4464 Clc1cccc2c1[nH]c(c2)c3cccs3 271570a_100015811879_100011215356 [0,1,0,0,0,0|3,0,0]=4 240 B17R3.4464 Clc1cccc2c1[nH]c(c2)c3ccoc3 271570a_100015811879_100011215275 [0,1,0,0,0,0|3,0,0]=4 241 B17R3.4464 Clc1cccc2c1[nH]c(c2)c3ccsc3 271570a_100015811879_100000738268 [0,1,0,0,0,0|3,0,0]=4 242 B17R3.4464 Clc1cccc2c1[nH]c(c2)c3ccsn3 271570a_100015811879_100009818082 [0,1,0,0,0,0|2,0,0]=3 243 B17R3.4464 Clc1cccc2c1[nH]c(c2)c3cn[nH]c3 271570a_100015811879_100000238712 [0,1,0,0,0,0|3,0,0]=4 244 B17R3.4464 Clc1cccc2c1[nH]c(c2)c3cscn3 271570a_100015811879_100000751502 [0,1,0,0,0,0|3,0,0]=4 245 B17R3.4464 Clc1cccc2c1[nH]c(c2)c3nc[nH]n3 271570a_100015811879_100000761765 [0,1,0,0,0,0|2,0,0]=3 246 B17R3.4464 Clc1cccc2c1[nH]c(c2)c3ncc[nH]3 271570a_100015811879_100025796157 [0,1,0,0,0,0|3,0,0]=4 247 B17R3.4464 Clc1cccc2c1[nH]c(c2)c3ncco3 271570a_100015811879_100011787736 [0,1,0,0,0,0|3,0,0]=4 248 B17R3.4464 Clc1cccc2c1[nH]c(c2)c3nccs3 271570a_100015811879_100000211983 [0,1,0,0,0,0|3,0,0]=4 249 B17R3.4464 Clc1cccc2c1[nH]c(c2)c3nncs3 271570a_100015811879_100000739804 [0,1,0,0,0,0|2,0,1]=4 250 B17R3.4464 Clc1cccc2c1cc([nH]2)c3c[nH]cn3 271570a_100010246266_100000756875 [0,1,0,0,0,0|3,0,0]=4 251 B17R3.4464 Clc1cccc2c1cc([nH]2)c3cc[nH]n3 271570a_100010246266_100000062575 [0,1,0,0,0,0|1,0,0]=2 252 B17R3.4464 Clc1cccc2c1cc([nH]2)c3ccco3 271570a_100010246266_100009814098 [0,1,0,0,0,0|3,0,0]=4 253 B17R3.4464 Clc1cccc2c1cc([nH]2)c3cccs3 271570a_100010246266_100011215356 [0,1,0,0,0,0|3,0,0]=4 254 B17R3.4464 Clc1cccc2c1cc([nH]2)c3ccoc3 271570a_100010246266_100011215275 [0,1,0,0,0,0|3,0,0]=4 255 B17R3.4464 Clc1cccc2c1cc([nH]2)c3ccsc3 271570a_100010246266_100000738268 [0,1,0,0,0,0|3,0,0]=4 256 B17R3.4464 Clc1cccc2c1cc([nH]2)c3ccsn3 271570a_100010246266_100009818082 [0,1,0,0,0,0|2,0,0]=3 257 B17R3.4464 Clc1cccc2c1cc([nH]2)c3cn[nH]c3 271570a_100010246266_100000238712 [0,1,0,0,0,0|3,0,0]=4 258 B17R3.4464 Clc1cccc2c1cc([nH]2)c3cscn3 271570a_100010246266_100000751502 [0,1,0,0,0,0|3,0,0]=4 259 B17R3.4464 Clc1cccc2c1cc([nH]2)c3nc[nH]n3 271570a_100010246266_100000761765 [0,1,0,0,0,0|2,0,0]=3 260 B17R3.4464 Clc1cccc2c1cc([nH]2)c3ncc[nH]3 271570a_100010246266_100025796157 [0,1,0,0,0,0|3,0,0]=4 261 B17R3.4464 Clc1cccc2c1cc([nH]2)c3ncco3 271570a_100010246266_100011787736 [0,1,0,0,0,0|3,0,0]=4 262 B17R3.4464 Clc1cccc2c1cc([nH]2)c3nccs3 271570a_100010246266_100000211983 [0,1,0,0,0,0|3,0,0]=4 263 B17R3.4464 Clc1cccc2c1cc([nH]2)c3nncs3 271570a_100010246266_100000739804 [0,1,0,0,0,0|2,0,1]=4 264 B17R3.4464 Clc1ccnc2c1cc([nH]2)c3cc[nH]c3 271570a_100000102155_100010234028 [0,1,0,0,0,0|3,0,0]=4 265 B17R3.4464 Clc1ccnc2c1cc([nH]2)c3cc[nH]n3 271570a_100000062414_100010234028 [0,1,0,0,0,0|2,0,0]=3 266 B17R3.4464 Clc1ccnc2c1sc(c2)c3cc[nH]n3 271570a_100000062414_100010192579 [0,1,0,0,0,0|3,0,0]=4 267 B17R3.4464 Fc1cccc2c1[nH]c(c2)c3c[nH]cn3 271570a_100010082618_100000756875 [0,1,0,0,0,0|3,0,0]=4 268 B17R3.4464 Fc1cccc2c1[nH]c(c2)c3cc[nH]n3 271570a_100010082618_100000062575 [0,1,0,0,0,0|1,0,0]=2 269 B17R3.4464 Fc1cccc2c1[nH]c(c2)c3ccco3 271570a_100010082618_100009814098 [0,1,0,0,0,0|3,0,0]=4 270 B17R3.4464 Fc1cccc2c1[nH]c(c2)c3cccs3 271570a_100010082618_100011215356 [0,1,0,0,0,0|3,0,0]=4 271 B17R3.4464 Fc1cccc2c1[nH]c(c2)c3ccoc3 271570a_100010082618_100011215275 [0,1,0,0,0,0|3,0,0]=4 272 B17R3.4464 Fc1cccc2c1[nH]c(c2)c3ccsc3 271570a_100010082618_100000738268 [0,1,0,0,0,0|3,0,0]=4 273 B17R3.4464 Fc1cccc2c1[nH]c(c2)c3ccsn3 271570a_100010082618_100009818082 [0,1,0,0,0,0|2,0,0]=3 274 B17R3.4464 Fc1cccc2c1[nH]c(c2)c3cn[nH]c3 271570a_100010082618_100000238712 [0,1,0,0,0,0|3,0,0]=4 275 B17R3.4464 Fc1cccc2c1[nH]c(c2)c3cscn3 271570a_100010082618_100000751502 [0,1,0,0,0,0|3,0,0]=4 276 B17R3.4464 Fc1cccc2c1[nH]c(c2)c3nc[nH]n3 271570a_100010082618_100000761765 [0,1,0,0,0,0|2,0,0]=3 277 B17R3.4464 Fc1cccc2c1[nH]c(c2)c3ncc[nH]3 271570a_100010082618_100025796157 [0,1,0,0,0,0|3,0,0]=4 278 B17R3.4464 Fc1cccc2c1[nH]c(c2)c3ncco3 271570a_100010082618_100011787736 [0,1,0,0,0,0|3,0,0]=4 279 B17R3.4464 Fc1cccc2c1[nH]c(c2)c3nccs3 271570a_100010082618_100000211983 [0,1,0,0,0,0|3,0,0]=4 280 B17R3.4464 Fc1cccc2c1[nH]c(c2)c3nncs3 271570a_100010082618_100000739804 [0,1,0,0,0,0|2,0,1]=4 281 B17R3.4464 Fc1cccc2c1cc([nH]2)c3c[nH]cn3 271570a_100010071326_100000756875 [0,1,0,0,0,0|3,0,0]=4 282 B17R3.4464 Fc1cccc2c1cc([nH]2)c3cc[nH]n3 271570a_100010071326_100000062575 [0,1,0,0,0,0|1,0,0]=2 283 B17R3.4464 Fc1cccc2c1cc([nH]2)c3ccco3 271570a_100010071326_100009814098 [0,1,0,0,0,0|3,0,0]=4 284 B17R3.4464 Fc1cccc2c1cc([nH]2)c3cccs3 271570a_100010071326_100011215356 [0,1,0,0,0,0|3,0,0]=4 285 B17R3.4464 Fc1cccc2c1cc([nH]2)c3ccoc3 271570a_100010071326_100011215275 [0,1,0,0,0,0|3,0,0]=4 286 B17R3.4464 Fc1cccc2c1cc([nH]2)c3ccsc3 271570a_100010071326_100000738268 [0,1,0,0,0,0|3,0,0]=4 287 B17R3.4464 Fc1cccc2c1cc([nH]2)c3ccsn3 271570a_100010071326_100009818082 [0,1,0,0,0,0|2,0,0]=3 288 B17R3.4464 Fc1cccc2c1cc([nH]2)c3cn[nH]c3 271570a_100010071326_100000238712 [0,1,0,0,0,0|3,0,0]=4 289 B17R3.4464 Fc1cccc2c1cc([nH]2)c3cscn3 271570a_100010071326_100000751502 [0,1,0,0,0,0|3,0,0]=4 290 B17R3.4464 Fc1cccc2c1cc([nH]2)c3nc[nH]n3 271570a_100010071326_100000761765 [0,1,0,0,0,0|2,0,0]=3 291 B17R3.4464 Fc1cccc2c1cc([nH]2)c3ncc[nH]3 271570a_100010071326_100025796157 [0,1,0,0,0,0|3,0,0]=4 292 B17R3.4464 Fc1cccc2c1cc([nH]2)c3ncco3 271570a_100010071326_100011787736 [0,1,0,0,0,0|3,0,0]=4 293 B17R3.4464 Fc1cccc2c1cc([nH]2)c3nccs3 271570a_100010071326_100000211983 [0,1,0,0,0,0|3,0,0]=4 294 B17R3.4464 Fc1cccc2c1cc([nH]2)c3nncs3 271570a_100010071326_100000739804 [0,1,0,0,0,0|2,0,1]=4 295 B17R3.4464 Fc1cccc2c1cc(o2)c3cc[nH]n3 271570a_200011102740_100000062575 [0,1,0,0,0,0|2,0,0]=3 296 B17R3.4464 Fc1cccc2c1cc(o2)c3ccsn3 271570a_200011102740_100009818082 [0,1,0,0,0,0|3,0,0]=4 297 B17R3.4464 Fc1cccc2c1cc(o2)c3nc[nH]n3 271570a_200011102740_100000761765 [0,1,0,0,0,0|3,0,0]=4 298 B17R3.4464 Fc1cccc2c1nc(s2)c3cc[nH]c3 271570a_100000102155_100010008856 [0,1,0,0,0,0|2,0,0]=3 299 B17R3.4464 Fc1cccc2c1nc(s2)c3cc[nH]n3 271570a_100000062414_100010008856 [0,1,0,0,0,0|1,0,0]=2 300 B17R3.4464 Fc1cccc2c1nc(s2)c3ccco3 271570a_100000750936_100010008856 [0,1,0,0,0,0|3,0,0]=4 301 B17R3.4464 Fc1cccc2c1nc(s2)c3cccs3 271570a_100000742291_100010008856 [0,1,0,0,0,0|3,0,0]=4 302 B17R3.4464 Fc1cccc2c1nc(s2)c3ccoc3 271570a_100011218838_100010008856 [0,1,0,0,0,0|3,0,0]=4 303 B17R3.4464 Fc1cccc2c1nc(s2)c3ccsc3 271570a_100011934443_100010008856 [0,1,0,0,0,0|3,0,0]=4 304 B17R3.4464 Fc1cccc2c1nc(s2)c3cn[nH]c3 271570a_100000041997_100010008856 [0,1,0,0,0,0|3,0,0]=4 305 B17R3.4464 Fc1cccc2c1nc(s2)c3ncc[nH]3 271570a_100016988920_100010008856 [0,1,0,0,0,0|3,0,0]=4 306 B17R3.4464 Nc1ncnc2c1[nH]c(n2)c3cc[nH]c3 271570a_100000102155_100009817290 [0,1,0,0,0,0|3,0,0]=4 307 B17R3.4464 Nc1ncnc2c1[nH]c(n2)c3cc[nH]n3 271570a_100000062414_100009817290 [0,1,0,0,0,0|2,0,0]=3 308 B17R3.4464 Oc1nccc2c1cc(s2)c3cc[nH]n3 271570a_100000062414_100010116216 [0,1,0,0,0,0|3,0,0]=4 309 B17R3.17530 Brc1cc([nH]n1)c2cc3ccccc3[nH]2 271570a_100010206980_100160470719 [0,1,0,0,0,0|1,0,2]=4 310 B17R3.17530 Brc1cc([nH]n1)c2nc3ccccc3s2 271570a_200000082171_100160470719 [0,1,0,0,0,0|1,0,2]=4 311 B17R3.17530 Brc1ccc(s1)c2cc3ccccc3[nH]2 271570a_100010206980_100010197418 [0,1,0,0,0,0|3,0,0]=4 312 B17R3.17530 Brc1ccc(s1)c2nc3ccccc3s2 271570a_200000082171_100010197418 [0,1,0,0,0,0|3,0,0]=4 313 B17R3.17530 Brc1csc(n1)c2cc3ccccc3[nH]2 271570a_100010206980_200016082925 [0,1,0,0,0,0|3,0,0]=4 314 B17R3.17530 Brc1csc(n1)c2nc3ccccc3s2 271570a_200000082171_200016082925 [0,1,0,0,0,0|3,0,0]=4 315 B17R3.17530 Cc1c[nH]c(n1)c2cc3ccccc3[nH]2 271570a_100010206980_100161115468 [0,1,0,0,0,0|3,0,0]=4 316 B17R3.17530 Cc1c[nH]c(n1)c2nc3ccccc3s2 271570a_200000082171_100161115468 [0,1,0,0,0,0|3,0,0]=4 317 B17R3.17530 Cc1cc(cs1)c2cc3ccccc3[nH]2 271570a_100000699828_100010232065 [0,1,0,0,0,0|3,0,0]=4 318 B17R3.17530 Cc1cc(cs1)c2cc3ccccc3[nH]2 271570a_100010206980_100000759034 [0,1,0,0,0,0|3,0,0]=4 319 B17R3.17530 Cc1cc(cs1)c2nc3ccccc3[nH]2 271570a_100000699828_100009814255 [0,1,0,0,0,0|2,0,0]=3 320 B17R3.17530 Cc1cc(cs1)c2nc3ccccc3s2 271570a_100000699828_100000751744 [0,1,0,0,0,0|3,0,0]=4 321 B17R3.17530 Cc1cc(cs1)c2nc3ccccc3s2 271570a_200000082171_100000759034 [0,1,0,0,0,0|3,0,0]=4 322 B17R3.17530 Cc1cc(n[nH]1)C2=Cc3ccccc3C2 271570a_100010239756_100015199547 [0,1,0,0,0,0|2,0,0]=3 323 B17R3.17530 Cc1cc(n[nH]1)c2cc3ccccc3[nH]2 271570a_100009872134_100010232065 [0,1,0,0,0,0|1,0,0]=2 324 B17R3.17530 Cc1cc(n[nH]1)c2cc3ccccc3[nH]2 271570a_100010206980_100015199547 [0,1,0,0,0,0|1,0,0]=2 325 B17R3.17530 Cc1cc(n[nH]1)c2cc3ccccc3o2 271570a_100009872134_100010159458 [0,1,0,0,0,0|2,0,0]=3 326 B17R3.17530 Cc1cc(n[nH]1)c2cc3ccccc3o2 271570a_100011328764_100015199547 [0,1,0,0,0,0|2,0,0]=3 327 B17R3.17530 Cc1cc(n[nH]1)c2cc3ccccc3s2 271570a_100000034353_100015199547 [0,1,0,0,0,0|2,0,0]=3 328 B17R3.17530 Cc1cc(n[nH]1)c2cc3ccccc3s2 271570a_100009872134_100009816949 [0,1,0,0,0,0|2,0,0]=3 329 B17R3.17530 Cc1cc(n[nH]1)c2cc3cccnc3[nH]2 271570a_100009872134_100010079843 [0,1,0,0,0,0|2,0,0]=3 330 B17R3.17530 Cc1cc(n[nH]1)c2cn3ccccc3n2 271570a_100009872134_100009819586 [0,1,0,0,0,0|2,0,0]=3 331 B17R3.17530 Cc1cc(n[nH]1)c2cn3ncccc3n2 271570a_100009872134_200010296001 [0,1,0,0,0,0|3,0,0]=4 332 B17R3.17530 Cc1cc(n[nH]1)c2nc3ccccc3[nH]2 271570a_100009872134_100009814255 [0,1,0,0,0,0|0,0,0]=1 333 B17R3.17530 Cc1cc(n[nH]1)c2nc3ccccc3s2 271570a_100009872134_100000751744 [0,1,0,0,0,0|1,0,0]=2 334 B17R3.17530 Cc1cc(n[nH]1)c2nc3ccccc3s2 271570a_200000082171_100015199547 [0,1,0,0,0,0|1,0,0]=2 335 B17R3.17530 Cc1cc(n[nH]1)c2nc3cccnc3s2 271570a_100009872134_100010188088 [0,1,0,0,0,0|2,0,0]=3 336 B17R3.17530 Cc1cc(n[nH]1)c2nc3cnccn3n2 271570a_100009872134_100010748104 [0,1,0,0,0,0|2,0,1]=4 337 B17R3.17530 Cc1cc(sn1)c2cc3ccccc3[nH]2 271570a_100010206980_100009815735 [0,1,0,0,0,0|2,0,1]=4 338 B17R3.17530 Cc1cc(sn1)c2nc3ccccc3s2 271570a_200000082171_100009815735 [0,1,0,0,0,0|2,0,1]=4 339 B17R3.17530 Cc1ccc(o1)c2cc3ccccc3[nH]2 271570a_100000061910_100010232065 [0,1,0,0,0,0|3,0,0]=4 340 B17R3.17530 Cc1ccc(o1)c2nc3ccccc3[nH]2 271570a_100000061910_100009814255 [0,1,0,0,0,0|2,0,0]=3 341 B17R3.17530 Cc1ccc(o1)c2nc3ccccc3s2 271570a_100000061910_100000751744 [0,1,0,0,0,0|3,0,0]=4 342 B17R3.17530 Cc1ccc(s1)c2cc3ccccc3[nH]2 271570a_100010206980_100000761539 [0,1,0,0,0,0|3,0,0]=4 343 B17R3.17530 Cc1ccc(s1)c2cc3ccccc3[nH]2 271570a_100011934456_100010232065 [0,1,0,0,0,0|3,0,0]=4 344 B17R3.17530 Cc1ccc(s1)c2nc3ccccc3[nH]2 271570a_100011934456_100009814255 [0,1,0,0,0,0|2,0,0]=3 345 B17R3.17530 Cc1ccc(s1)c2nc3ccccc3s2 271570a_100011934456_100000751744 [0,1,0,0,0,0|3,0,0]=4 346 B17R3.17530 Cc1ccc(s1)c2nc3ccccc3s2 271570a_200000082171_100000761539 [0,1,0,0,0,0|3,0,0]=4 347 B17R3.17530 Cc1cnc(s1)c2cc3ccccc3[nH]2 271570a_100010206980_100000690809 [0,1,0,0,0,0|3,0,0]=4 348 B17R3.17530 Cc1cnc(s1)c2nc3ccccc3s2 271570a_200000082171_100000690809 [0,1,0,0,0,0|3,0,0]=4 349 B17R3.17530 Cc1csc(c1)c2cc3ccccc3[nH]2 271570a_100000038307_100010232065 [0,1,0,0,0,0|3,0,0]=4 350 B17R3.17530 Cc1csc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_100009876951 [0,1,0,0,0,0|3,0,0]=4 351 B17R3.17530 Cc1csc(c1)c2nc3ccccc3[nH]2 271570a_100000038307_100009814255 [0,1,0,0,0,0|2,0,0]=3 352 B17R3.17530 Cc1csc(c1)c2nc3ccccc3s2 271570a_100000038307_100000751744 [0,1,0,0,0,0|3,0,0]=4 353 B17R3.17530 Cc1csc(c1)c2nc3ccccc3s2 271570a_200000082171_100009876951 [0,1,0,0,0,0|3,0,0]=4 354 B17R3.17530 Cc1csc(n1)c2cc3ccccc3[nH]2 271570a_100010206980_100011291629 [0,1,0,0,0,0|3,0,0]=4 355 B17R3.17530 Cc1csc(n1)c2nc3ccccc3s2 271570a_200000082171_100011291629 [0,1,0,0,0,0|3,0,0]=4 356 B17R3.17530 Cc1nc(c[nH]1)c2cc3ccccc3[nH]2 271570a_100010206980_100009814057 [0,1,0,0,0,0|3,0,0]=4 357 B17R3.17530 Cc1nc(c[nH]1)c2nc3ccccc3s2 271570a_200000082171_100009814057 [0,1,0,0,0,0|3,0,0]=4 358 B17R3.17530 Cc1nc(cs1)c2cc3ccccc3[nH]2 271570a_100010206980_100011934587 [0,1,0,0,0,0|3,0,0]=4 359 B17R3.17530 Cc1nc(cs1)c2nc3ccccc3s2 271570a_200000082171_100011934587 [0,1,0,0,0,0|3,0,0]=4 360 B17R3.17530 Cc1nc(n[nH]1)C2=Cc3ccccc3C2 271570a_100010239756_100000732540 [0,1,0,0,0,0|3,0,0]=4 361 B17R3.17530 Cc1nc(n[nH]1)c2cc3ccccc3[nH]2 271570a_100010206980_100000732540 [0,1,0,0,0,0|2,0,0]=3 362 B17R3.17530 Cc1nc(n[nH]1)c2cc3ccccc3o2 271570a_100011328764_100000732540 [0,1,0,0,0,0|3,0,0]=4 363 B17R3.17530 Cc1nc(n[nH]1)c2cc3ccccc3s2 271570a_100000034353_100000732540 [0,1,0,0,0,0|3,0,0]=4 364 B17R3.17530 Cc1nc(n[nH]1)c2nc3ccccc3s2 271570a_200000082171_100000732540 [0,1,0,0,0,0|2,0,0]=3 365 B17R3.17530 Cc1nc(no1)c2cc3ccccc3[nH]2 270196a_100009861029_100000070787 [0,1,0,0,0,0|3,0,0]=4 366 B17R3.17530 Cc1nc(no1)c2cc3ccccc3[nH]2 271570a_100010206980_100012003639 [0,1,0,0,0,0|3,0,0]=4 367 B17R3.17530 Cc1nc(no1)c2nc3ccccc3s2 270196a_100000090373_100000070787 [0,1,0,0,0,0|3,0,0]=4 368 B17R3.17530 Cc1nc(no1)c2nc3ccccc3s2 271570a_200000082171_100012003639 [0,1,0,0,0,0|3,0,0]=4 369 B17R3.17530 Cc1ncc(s1)c2nc3ccccc3[nH]2 271570a_100000696845_100009814255 [0,1,0,0,0,0|2,0,1]=4 370 B17R3.17530 Cc1nnc(o1)c2cc3ccccc3[nH]2 271570a_100010206980_100000708914 [0,1,0,0,0,0|2,0,1]=4 371 B17R3.17530 Cc1nnc(o1)c2nc3ccccc3s2 271570a_200000082171_100000708914 [0,1,0,0,0,0|2,0,1]=4 372 B17R3.17530 Cc1nnc(s1)c2cc3ccccc3[nH]2 271570a_100010206980_100000686958 [0,1,0,0,0,0|2,0,1]=4 373 B17R3.17530 Cc1nnc(s1)c2nc3ccccc3s2 271570a_200000082171_100000686958 [0,1,0,0,0,0|2,0,1]=4 374 B17R3.17530 Clc1ccc(s1)c2cc3ccccc3[nH]2 271570a_100000708867_100010232065 [0,1,0,0,0,0|3,0,0]=4 375 B17R3.17530 Clc1ccc(s1)c2nc3ccccc3[nH]2 271570a_100000708867_100009814255 [0,1,0,0,0,0|2,0,0]=3 376 B17R3.17530 Clc1ccc(s1)c2nc3ccccc3s2 271570a_100000708867_100000751744 [0,1,0,0,0,0|3,0,0]=4 377 B17R3.17530 Cn1cc(cn1)c2cc3ccccc3[nH]2 271570a_100000685319_100010232065 [0,1,0,0,0,0|3,0,0]=4 378 B17R3.17530 Cn1cc(cn1)c2cc3ccccc3[nH]2 271570a_100010206980_100000748075 [0,1,0,0,0,0|3,0,0]=4 379 B17R3.17530 Cn1cc(cn1)c2nc3ccccc3[nH]2 271570a_100000685319_100009814255 [0,1,0,0,0,0|2,0,0]=3 380 B17R3.17530 Cn1cc(cn1)c2nc3ccccc3s2 271570a_100000685319_100000751744 [0,1,0,0,0,0|3,0,0]=4 381 B17R3.17530 Cn1cc(cn1)c2nc3ccccc3s2 271570a_200000082171_100000748075 [0,1,0,0,0,0|3,0,0]=4 382 B17R3.17530 Cn1cc(nn1)c2cc3ccccc3[nH]2 271570a_100010206980_100000760339 [0,1,0,0,0,0|2,0,1]=4 383 B17R3.17530 Cn1cc(nn1)c2nc3ccccc3s2 271570a_200000082171_100000760339 [0,1,0,0,0,0|2,0,1]=4 384 B17R3.17530 Cn1ccc(c1)c2cc3ccccc3[nH]2 271570a_100010172022_100010232065 [0,1,0,0,0,0|2,0,0]=3 385 B17R3.17530 Cn1ccc(c1)c2cc3ccccc3o2 271570a_100010172022_100010159458 [0,1,0,0,0,0|3,0,0]=4 386 B17R3.17530 Cn1ccc(c1)c2cc3ccccc3s2 271570a_100010172022_100009816949 [0,1,0,0,0,0|3,0,0]=4 387 B17R3.17530 Cn1ccc(c1)c2cc3cccnc3[nH]2 271570a_100010172022_100010079843 [0,1,0,0,0,0|3,0,0]=4 388 B17R3.17530 Cn1ccc(c1)c2cn3ccccc3n2 271570a_100010172022_100009819586 [0,1,0,0,0,0|3,0,0]=4 389 B17R3.17530 Cn1ccc(c1)c2nc3ccccc3[nH]2 271570a_100010172022_100009814255 [0,1,0,0,0,0|1,0,0]=2 390 B17R3.17530 Cn1ccc(c1)c2nc3ccccc3s2 271570a_100010172022_100000751744 [0,1,0,0,0,0|2,0,0]=3 391 B17R3.17530 Cn1ccc(c1)c2nc3cccnc3s2 271570a_100010172022_100010188088 [0,1,0,0,0,0|3,0,0]=4 392 B17R3.17530 Cn1ccc(n1)C2=Cc3ccccc3C2 271570a_100010239756_100000752436 [0,1,0,0,0,0|2,0,0]=3 393 B17R3.17530 Cn1ccc(n1)c2cc3ccccc3[nH]2 271570a_100010206980_100000752436 [0,1,0,0,0,0|1,0,0]=2 394 B17R3.17530 Cn1ccc(n1)c2cc3ccccc3[nH]2 271570a_100012348833_100010232065 [0,1,0,0,0,0|1,0,0]=2 395 B17R3.17530 Cn1ccc(n1)c2cc3ccccc3o2 271570a_100011328764_100000752436 [0,1,0,0,0,0|2,0,0]=3 396 B17R3.17530 Cn1ccc(n1)c2cc3ccccc3o2 271570a_100012348833_100010159458 [0,1,0,0,0,0|2,0,0]=3 397 B17R3.17530 Cn1ccc(n1)c2cc3ccccc3s2 271570a_100000034353_100000752436 [0,1,0,0,0,0|2,0,0]=3 398 B17R3.17530 Cn1ccc(n1)c2cc3ccccc3s2 271570a_100012348833_100009816949 [0,1,0,0,0,0|2,0,0]=3 399 B17R3.17530 Cn1ccc(n1)c2cc3cccnc3[nH]2 271570a_100012348833_100010079843 [0,1,0,0,0,0|2,0,0]=3 400 B17R3.17530 Cn1ccc(n1)c2cn3ccccc3n2 271570a_100012348833_100009819586 [0,1,0,0,0,0|2,0,0]=3 401 B17R3.17530 Cn1ccc(n1)c2cn3ncccc3n2 271570a_100012348833_200010296001 [0,1,0,0,0,0|3,0,0]=4 402 B17R3.17530 Cn1ccc(n1)c2nc3ccccc3[nH]2 271570a_100012348833_100009814255 [0,1,0,0,0,0|0,0,0]=1 403 B17R3.17530 Cn1ccc(n1)c2nc3ccccc3s2 271570a_100012348833_100000751744 [0,1,0,0,0,0|1,0,0]=2 404 B17R3.17530 Cn1ccc(n1)c2nc3ccccc3s2 271570a_200000082171_100000752436 [0,1,0,0,0,0|1,0,0]=2 405 B17R3.17530 Cn1ccc(n1)c2nc3cccnc3s2 271570a_100012348833_100010188088 [0,1,0,0,0,0|2,0,0]=3 406 B17R3.17530 Cn1ccc(n1)c2nc3cnccn3n2 271570a_100012348833_100010748104 [0,1,0,0,0,0|2,0,1]=4 407 B17R3.17530 Cn1cnc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_100000040308 [0,1,0,0,0,0|3,0,0]=4 408 B17R3.17530 Cn1cnc(c1)c2nc3ccccc3s2 271570a_200000082171_100000040308 [0,1,0,0,0,0|3,0,0]=4 409 B17R3.17530 Cn1cnc(n1)C2=Cc3ccccc3C2 271570a_100010239756_100009819955 [0,1,0,0,0,0|3,0,0]=4 410 B17R3.17530 Cn1cnc(n1)c2cc3ccccc3[nH]2 271570a_100010206980_100009819955 [0,1,0,0,0,0|2,0,0]=3 411 B17R3.17530 Cn1cnc(n1)c2cc3ccccc3o2 271570a_100011328764_100009819955 [0,1,0,0,0,0|3,0,0]=4 412 B17R3.17530 Cn1cnc(n1)c2cc3ccccc3s2 271570a_100000034353_100009819955 [0,1,0,0,0,0|3,0,0]=4 413 B17R3.17530 Cn1cnc(n1)c2nc3ccccc3s2 271570a_200000082171_100009819955 [0,1,0,0,0,0|2,0,0]=3 414 B17R3.17530 Cn1ncc(n1)C2=Cc3ccccc3C2 271570a_100010239756_100000733932 [0,1,0,0,0,0|3,0,0]=4 415 B17R3.17530 Cn1ncc(n1)c2cc3ccccc3[nH]2 271570a_100010206980_100000733932 [0,1,0,0,0,0|2,0,0]=3 416 B17R3.17530 Cn1ncc(n1)c2cc3ccccc3o2 271570a_100011328764_100000733932 [0,1,0,0,0,0|3,0,0]=4 417 B17R3.17530 Cn1ncc(n1)c2cc3ccccc3s2 271570a_100000034353_100000733932 [0,1,0,0,0,0|3,0,0]=4 418 B17R3.17530 Cn1ncc(n1)c2nc3ccccc3s2 271570a_200000082171_100000733932 [0,1,0,0,0,0|2,0,0]=3 419 B17R3.17530 Cn1nnc(n1)c2cc3ccccc3[nH]2 271570a_100010206980_200009870515 [0,1,0,0,0,0|3,0,0]=4 420 B17R3.17530 Cn1nnc(n1)c2nc3ccccc3s2 271570a_200000082171_200009870515 [0,1,0,0,0,0|3,0,0]=4 421 B17R3.17530 Nc1cc(n[nH]1)C2=Cc3ccccc3C2 271570a_100010239756_100009822546 [0,1,0,0,0,0|2,0,0]=3 422 B17R3.17530 Nc1cc(n[nH]1)c2cc3ccccc3[nH]2 271570a_100010206980_100009822546 [0,1,0,0,0,0|1,0,0]=2 423 B17R3.17530 Nc1cc(n[nH]1)c2cc3ccccc3o2 271570a_100011328764_100009822546 [0,1,0,0,0,0|2,0,0]=3 424 B17R3.17530 Nc1cc(n[nH]1)c2cc3ccccc3s2 271570a_100000034353_100009822546 [0,1,0,0,0,0|2,0,0]=3 425 B17R3.17530 Nc1cc(n[nH]1)c2nc3ccccc3s2 271570a_200000082171_100009822546 [0,1,0,0,0,0|1,0,0]=2 426 B17R3.17530 Nc1csc(n1)c2cc3ccccc3[nH]2 271570a_100010206980_200015188442 [0,1,0,0,0,0|3,0,0]=4 427 B17R3.17530 Nc1csc(n1)c2nc3ccccc3s2 271570a_200000082171_200015188442 [0,1,0,0,0,0|3,0,0]=4 428 B17R3.17530 Nc1nc(cs1)c2cc3ccccc3[nH]2 271570a_100010206980_100011998049 [0,1,0,0,0,0|3,0,0]=4 429 B17R3.17530 Nc1nc(cs1)c2nc3ccccc3s2 271570a_200000082171_100011998049 [0,1,0,0,0,0|3,0,0]=4 430 B17R3.17530 Nc1nc(n[nH]1)C2=Cc3ccccc3C2 271570a_100010239756_100015184587 [0,1,0,0,0,0|3,0,0]=4 431 B17R3.17530 Nc1nc(n[nH]1)c2cc3ccccc3[nH]2 271570a_100010206980_100015184587 [0,1,0,0,0,0|2,0,0]=3 432 B17R3.17530 Nc1nc(n[nH]1)c2cc3ccccc3o2 271570a_100011328764_100015184587 [0,1,0,0,0,0|3,0,0]=4 433 B17R3.17530 Nc1nc(n[nH]1)c2cc3ccccc3s2 271570a_100000034353_100015184587 [0,1,0,0,0,0|3,0,0]=4 434 B17R3.17530 Nc1nc(n[nH]1)c2nc3ccccc3s2 271570a_200000082171_100015184587 [0,1,0,0,0,0|2,0,0]=3 435 B17R3.17530 Nc1nnc(s1)c2cc3ccccc3[nH]2 271570a_100010206980_100000738278 [0,1,0,0,0,0|2,0,1]=4 436 B17R3.17530 Nc1nnc(s1)c2nc3ccccc3s2 271570a_200000082171_100000738278 [0,1,0,0,0,0|2,0,1]=4 437 B17R3.17530 O=C1C=C(CC1)c2cc3ccccc3[nH]2 271570a_100010737933_100010232065 [0,1,0,0,0,0|3,0,0]=4 438 B17R3.17530 O=C1C=C(CC1)c2nc3ccccc3[nH]2 271570a_100010737933_100009814255 [0,1,0,0,0,0|2,0,0]=3 439 B17R3.17530 O=C1C=C(CC1)c2nc3ccccc3s2 271570a_100010737933_100000751744 [0,1,0,0,0,0|3,0,0]=4 440 B17R3.17530 O=C1CN(CN1)c2nc3ccccc3[nH]2 27a_200000708111_100009814255 [0,1,0,0,0,0|2,0,1]=4 441 B17R3.17530 Oc1nc(no1)c2cc3ccccc3[nH]2 270196a_100009861029_100015183105 [0,1,0,0,0,0|3,0,0]=4 442 B17R3.17530 Oc1nc(no1)c2nc3ccccc3s2 270196a_100000090373_100015183105 [0,1,0,0,0,0|3,0,0]=4 443 B17R3.24914 Brc1c[nH]nc1C2=Cc3ccccc3C2 271570a_100010239756_100015839836 [0,1,0,0,0,0|2,0,0]=3 444 B17R3.24914 Brc1c[nH]nc1c2cc3ccccc3[nH]2 271570a_100010206980_100015839836 [0,1,0,0,0,0|1,0,0]=2 445 B17R3.24914 Brc1c[nH]nc1c2cc3ccccc3o2 271570a_100011328764_100015839836 [0,1,0,0,0,0|2,0,0]=3 446 B17R3.24914 Brc1c[nH]nc1c2cc3ccccc3s2 271570a_100000034353_100015839836 [0,1,0,0,0,0|2,0,0]=3 447 B17R3.24914 Brc1c[nH]nc1c2nc3ccccc3s2 271570a_200000082171_100015839836 [0,1,0,0,0,0|1,0,0]=2 448 B17R3.24914 Brc1ccsc1c2cc3ccccc3[nH]2 271570a_100010206980_100012361411 [0,1,0,0,0,0|3,0,0]=4 449 B17R3.24914 Brc1ccsc1c2nc3ccccc3s2 271570a_200000082171_100012361411 [0,1,0,0,0,0|3,0,0]=4 450 B17R3.24914 Brc1cscc1c2cc3ccccc3[nH]2 271570a_100010206980_100010143727 [0,1,0,0,0,0|3,0,0]=4 451 B17R3.24914 Brc1cscc1c2nc3ccccc3s2 271570a_200000082171_100010143727 [0,1,0,0,0,0|3,0,0]=4 452 B17R3.24914 Brc1n[nH]cc1c2cc3ccccc3[nH]2 271570a_100010206980_100011012988 [0,1,0,0,0,0|3,0,0]=4 453 B17R3.24914 Brc1n[nH]cc1c2nc3ccccc3s2 271570a_200000082171_100011012988 [0,1,0,0,0,0|3,0,0]=4 454 B17R3.24914 Cc1[nH]cnc1c2cc3ccccc3[nH]2 271570a_100010206980_100009816806 [0,1,0,0,0,0|3,0,0]=4 455 B17R3.24914 Cc1[nH]cnc1c2nc3ccccc3s2 271570a_200000082171_100009816806 [0,1,0,0,0,0|3,0,0]=4 456 B17R3.24914 Cc1c[nH]nc1C2=Cc3ccccc3C2 271570a_100010239756_100009871783 [0,1,0,0,0,0|2,0,0]=3 457 B17R3.24914 Cc1c[nH]nc1c2cc3ccccc3[nH]2 271570a_100010206980_100009871783 [0,1,0,0,0,0|1,0,0]=2 458 B17R3.24914 Cc1c[nH]nc1c2cc3ccccc3[nH]2 271570a_100102527747_100010232065 [0,1,0,0,0,0|1,0,0]=2 459 B17R3.24914 Cc1c[nH]nc1c2cc3ccccc3o2 271570a_100011328764_100009871783 [0,1,0,0,0,0|2,0,0]=3 460 B17R3.24914 Cc1c[nH]nc1c2cc3ccccc3o2 271570a_100102527747_100010159458 [0,1,0,0,0,0|2,0,0]=3 461 B17R3.24914 Cc1c[nH]nc1c2cc3ccccc3s2 271570a_100000034353_100009871783 [0,1,0,0,0,0|2,0,0]=3 462 B17R3.24914 Cc1c[nH]nc1c2cc3ccccc3s2 271570a_100102527747_100009816949 [0,1,0,0,0,0|2,0,0]=3 463 B17R3.24914 Cc1c[nH]nc1c2cc3cccnc3[nH]2 271570a_100102527747_100010079843 [0,1,0,0,0,0|2,0,0]=3 464 B17R3.24914 Cc1c[nH]nc1c2cn3ccccc3n2 271570a_100102527747_100009819586 [0,1,0,0,0,0|2,0,0]=3 465 B17R3.24914 Cc1c[nH]nc1c2cn3ncccc3n2 271570a_100102527747_200010296001 [0,1,0,0,0,0|3,0,0]=4 466 B17R3.24914 Cc1c[nH]nc1c2nc3ccccc3[nH]2 271570a_100102527747_100009814255 [0,1,0,0,0,0|0,0,0]=1 467 B17R3.24914 Cc1c[nH]nc1c2nc3ccccc3s2 271570a_100102527747_100000751744 [0,1,0,0,0,0|1,0,0]=2 468 B17R3.24914 Cc1c[nH]nc1c2nc3ccccc3s2 271570a_200000082171_100009871783 [0,1,0,0,0,0|1,0,0]=2 469 B17R3.24914 Cc1c[nH]nc1c2nc3cccnc3s2 271570a_100102527747_100010188088 [0,1,0,0,0,0|2,0,0]=3 470 B17R3.24914 Cc1c[nH]nc1c2nc3cnccn3n2 271570a_100102527747_100010748104 [0,1,0,0,0,0|2,0,1]=4 471 B17R3.24914 Cc1ccsc1c2cc3ccccc3[nH]2 271570a_100000734444_100010232065 [0,1,0,0,0,0|3,0,0]=4 472 B17R3.24914 Cc1ccsc1c2cc3ccccc3[nH]2 271570a_100010206980_100000742657 [0,1,0,0,0,0|3,0,0]=4 473 B17R3.24914 Cc1ccsc1c2nc3ccccc3[nH]2 271570a_100000734444_100009814255 [0,1,0,0,0,0|2,0,0]=3 474 B17R3.24914 Cc1ccsc1c2nc3ccccc3s2 271570a_100000734444_100000751744 [0,1,0,0,0,0|3,0,0]=4 475 B17R3.24914 Cc1ccsc1c2nc3ccccc3s2 271570a_200000082171_100000742657 [0,1,0,0,0,0|3,0,0]=4 476 B17R3.24914 Cc1cscc1c2cc3ccccc3[nH]2 271570a_100000069996_100010232065 [0,1,0,0,0,0|3,0,0]=4 477 B17R3.24914 Cc1cscc1c2cc3ccccc3[nH]2 271570a_100010206980_100000759966 [0,1,0,0,0,0|3,0,0]=4 478 B17R3.24914 Cc1cscc1c2nc3ccccc3[nH]2 271570a_100000069996_100009814255 [0,1,0,0,0,0|2,0,0]=3 479 B17R3.24914 Cc1cscc1c2nc3ccccc3s2 271570a_100000069996_100000751744 [0,1,0,0,0,0|3,0,0]=4 480 B17R3.24914 Cc1cscc1c2nc3ccccc3s2 271570a_200000082171_100000759966 [0,1,0,0,0,0|3,0,0]=4 481 B17R3.24914 Cc1n[nH]cc1c2cc3ccccc3[nH]2 271570a_100000069033_100010232065 [0,1,0,0,0,0|3,0,0]=4 482 B17R3.24914 Cc1n[nH]cc1c2cc3ccccc3[nH]2 271570a_100010206980_100011912673 [0,1,0,0,0,0|3,0,0]=4 483 B17R3.24914 Cc1n[nH]cc1c2nc3ccccc3[nH]2 271570a_100000069033_100009814255 [0,1,0,0,0,0|2,0,0]=3 484 B17R3.24914 Cc1n[nH]cc1c2nc3ccccc3s2 271570a_100000069033_100000751744 [0,1,0,0,0,0|3,0,0]=4 485 B17R3.24914 Cc1n[nH]cc1c2nc3ccccc3s2 271570a_200000082171_100011912673 [0,1,0,0,0,0|3,0,0]=4 486 B17R3.24914 Cc1ncsc1c2nc3ccccc3[nH]2 271570a_100010115231_100009814255 [0,1,0,0,0,0|2,0,1]=4 487 B17R3.24914 Cc1occc1c2cc3ccccc3[nH]2 271570a_100000070625_100010232065 [0,1,0,0,0,0|3,0,0]=4 488 B17R3.24914 Cc1occc1c2nc3ccccc3[nH]2 271570a_100000070625_100009814255 [0,1,0,0,0,0|2,0,0]=3 489 B17R3.24914 Cc1occc1c2nc3ccccc3s2 271570a_100000070625_100000751744 [0,1,0,0,0,0|3,0,0]=4 490 B17R3.24914 Cc1oncc1c2nc3ccccc3[nH]2 271570a_100000723675_100009814255 [0,1,0,0,0,0|2,0,1]=4 491 B17R3.24914 Cc1sccc1c2cc3ccccc3[nH]2 271570a_100010206980_100000684487 [0,1,0,0,0,0|3,0,0]=4 492 B17R3.24914 Cc1sccc1c2cc3ccccc3[nH]2 271570a_100012356473_100010232065 [0,1,0,0,0,0|3,0,0]=4 493 B17R3.24914 Cc1sccc1c2nc3ccccc3[nH]2 271570a_100012356473_100009814255 [0,1,0,0,0,0|2,0,0]=3 494 B17R3.24914 Cc1sccc1c2nc3ccccc3s2 271570a_100012356473_100000751744 [0,1,0,0,0,0|3,0,0]=4 495 B17R3.24914 Cc1sccc1c2nc3ccccc3s2 271570a_200000082171_100000684487 [0,1,0,0,0,0|3,0,0]=4 496 B17R3.24914 Cc1scnc1c2cc3ccccc3[nH]2 271570a_100010206980_100000732656 [0,1,0,0,0,0|3,0,0]=4 497 B17R3.24914 Cc1scnc1c2nc3ccccc3s2 271570a_200000082171_100000732656 [0,1,0,0,0,0|3,0,0]=4 498 B17R3.24914 Clc1sccc1c2cc3ccccc3[nH]2 271570a_100000117213_100010232065 [0,1,0,0,0,0|3,0,0]=4 499 B17R3.24914 Clc1sccc1c2nc3ccccc3[nH]2 271570a_100000117213_100009814255 [0,1,0,0,0,0|2,0,0]=3 500 B17R3.24914 Clc1sccc1c2nc3ccccc3s2 271570a_100000117213_100000751744 [0,1,0,0,0,0|3,0,0]=4 501 B17R3.24914 Cn1cccc1c2cc3ccccc3[nH]2 271570a_100000068268_100010232065 [0,1,0,0,0,0|2,0,1]=4 502 B17R3.24914 Cn1cccc1c2nc3ccccc3[nH]2 271570a_100000068268_100009814255 [0,1,0,0,0,0|1,0,1]=3 503 B17R3.24914 Cn1cccc1c2nc3ccccc3s2 271570a_100000068268_100000751744 [0,1,0,0,0,0|2,0,1]=4 504 B17R3.24914 Cn1ccnc1c2cc3ccccc3[nH]2 271570a_100010206980_100000707724 [0,1,0,0,0,0|3,0,0]=4 505 B17R3.24914 Cn1ccnc1c2nc3ccccc3s2 271570a_200000082171_100000707724 [0,1,0,0,0,0|3,0,0]=4 506 B17R3.24914 Cn1cncc1c2nc3ccccc3[nH]2 271570a_100009892668_100009814255 [0,1,0,0,0,0|2,0,1]=4 507 B17R3.24914 Cn1nccc1c2cc3ccccc3[nH]2 271570a_100000707534_100010232065 [0,1,0,0,0,0|1,0,2]=4 508 B17R3.24914 Cn1nccc1c2cc3ccccc3[nH]2 271570a_100010206980_100000688441 [0,1,0,0,0,0|1,0,2]=4 509 B17R3.24914 Cn1nccc1c2nc3ccccc3[nH]2 271570a_100000707534_100009814255 [0,1,0,0,0,0|0,0,2]=3 510 B17R3.24914 Cn1nccc1c2nc3ccccc3s2 271570a_100000707534_100000751744 [0,1,0,0,0,0|1,0,2]=4 511 B17R3.24914 Cn1nccc1c2nc3ccccc3s2 271570a_200000082171_100000688441 [0,1,0,0,0,0|1,0,2]=4 512 B17R3.24914 Fc1n[nH]cc1c2cc3ccccc3[nH]2 271570a_100010206980_100015597042 [0,1,0,0,0,0|3,0,0]=4 513 B17R3.24914 Fc1n[nH]cc1c2nc3ccccc3s2 271570a_200000082171_100015597042 [0,1,0,0,0,0|3,0,0]=4 514 B17R3.24914 Nc1c[nH]nc1C2=Cc3ccccc3C2 271570a_100010239756_100010894806 [0,1,0,0,0,0|2,0,0]=3 515 B17R3.24914 Nc1c[nH]nc1c2cc3ccccc3[nH]2 271570a_100010206980_100010894806 [0,1,0,0,0,0|1,0,0]=2 516 B17R3.24914 Nc1c[nH]nc1c2cc3ccccc3o2 271570a_100011328764_100010894806 [0,1,0,0,0,0|2,0,0]=3 517 B17R3.24914 Nc1c[nH]nc1c2cc3ccccc3s2 271570a_100000034353_100010894806 [0,1,0,0,0,0|2,0,0]=3 518 B17R3.24914 Nc1c[nH]nc1c2nc3ccccc3s2 271570a_200000082171_100010894806 [0,1,0,0,0,0|1,0,0]=2 519 B17R3.24914 Nc1n[nH]cc1c2cc3ccccc3[nH]2 271570a_100010206980_100000717100 [0,1,0,0,0,0|3,0,0]=4 520 B17R3.24914 Nc1n[nH]cc1c2nc3ccccc3s2 271570a_200000082171_100000717100 [0,1,0,0,0,0|3,0,0]=4 521 B17R3.30918 Brc1ccc2[nH]c(cc2c1)c3cc[nH]c3 271570a_100000102155_100011012855 [0,1,0,0,0,0|2,0,0]=3 522 B17R3.30918 Brc1ccc2[nH]c(cc2c1)c3cc[nH]n3 271570a_100000062414_100011012855 [0,1,0,0,0,0|1,0,0]=2 523 B17R3.30918 Brc1ccc2[nH]c(cc2c1)c3ccco3 271570a_100000750936_100011012855 [0,1,0,0,0,0|3,0,0]=4 524 B17R3.30918 Brc1ccc2[nH]c(cc2c1)c3cccs3 271570a_100000742291_100011012855 [0,1,0,0,0,0|3,0,0]=4 525 B17R3.30918 Brc1ccc2[nH]c(cc2c1)c3ccoc3 271570a_100011218838_100011012855 [0,1,0,0,0,0|3,0,0]=4 526 B17R3.30918 Brc1ccc2[nH]c(cc2c1)c3ccsc3 271570a_100011934443_100011012855 [0,1,0,0,0,0|3,0,0]=4 527 B17R3.30918 Brc1ccc2[nH]c(cc2c1)c3cn[nH]c3 271570a_100000041997_100011012855 [0,1,0,0,0,0|3,0,0]=4 528 B17R3.30918 Brc1ccc2[nH]c(cc2c1)c3ncc[nH]3 271570a_100016988920_100011012855 [0,1,0,0,0,0|3,0,0]=4 529 B17R3.30918 Brc1ccc2cc([nH]c2c1)c3c[nH]cn3 271570a_200010246288_100000756875 [0,1,0,0,0,0|3,0,0]=4 530 B17R3.30918 Brc1ccc2cc([nH]c2c1)c3cc[nH]n3 271570a_200010246288_100000062575 [0,1,0,0,0,0|1,0,0]=2 531 B17R3.30918 Brc1ccc2cc([nH]c2c1)c3ccco3 271570a_200010246288_100009814098 [0,1,0,0,0,0|3,0,0]=4 532 B17R3.30918 Brc1ccc2cc([nH]c2c1)c3cccs3 271570a_200010246288_100011215356 [0,1,0,0,0,0|3,0,0]=4 533 B17R3.30918 Brc1ccc2cc([nH]c2c1)c3ccoc3 271570a_200010246288_100011215275 [0,1,0,0,0,0|3,0,0]=4 534 B17R3.30918 Brc1ccc2cc([nH]c2c1)c3ccsc3 271570a_200010246288_100000738268 [0,1,0,0,0,0|3,0,0]=4 535 B17R3.30918 Brc1ccc2cc([nH]c2c1)c3ccsn3 271570a_200010246288_100009818082 [0,1,0,0,0,0|2,0,0]=3 536 B17R3.30918 Brc1ccc2cc([nH]c2c1)c3cn[nH]c3 271570a_200010246288_100000238712 [0,1,0,0,0,0|3,0,0]=4 537 B17R3.30918 Brc1ccc2cc([nH]c2c1)c3cscn3 271570a_200010246288_100000751502 [0,1,0,0,0,0|3,0,0]=4 538 B17R3.30918 Brc1ccc2cc([nH]c2c1)c3nc[nH]n3 271570a_200010246288_100000761765 [0,1,0,0,0,0|2,0,0]=3 539 B17R3.30918 Brc1ccc2cc([nH]c2c1)c3ncc[nH]3 271570a_200010246288_100025796157 [0,1,0,0,0,0|3,0,0]=4 540 B17R3.30918 Brc1ccc2cc([nH]c2c1)c3ncco3 271570a_200010246288_100011787736 [0,1,0,0,0,0|3,0,0]=4 541 B17R3.30918 Brc1ccc2cc([nH]c2c1)c3nccs3 271570a_200010246288_100000211983 [0,1,0,0,0,0|3,0,0]=4 542 B17R3.30918 Brc1ccc2cc([nH]c2c1)c3nncs3 271570a_200010246288_100000739804 [0,1,0,0,0,0|2,0,1]=4 543 B17R3.30918 Brc1ccc2cc(sc2c1)c3cc[nH]n3 271570a_100015653926_100000062575 [0,1,0,0,0,0|2,0,0]=3 544 B17R3.30918 Brc1ccc2cc(sc2c1)c3ccsn3 271570a_100015653926_100009818082 [0,1,0,0,0,0|3,0,0]=4 545 B17R3.30918 Brc1ccc2cc(sc2c1)c3nc[nH]n3 271570a_100015653926_100000761765 [0,1,0,0,0,0|3,0,0]=4 546 B17R3.30918 Brc1ccc2oc(cc2c1)c3cc[nH]n3 271570a_100010176198_100000062575 [0,1,0,0,0,0|2,0,0]=3 547 B17R3.30918 Brc1ccc2oc(cc2c1)c3ccsn3 271570a_100010176198_100009818082 [0,1,0,0,0,0|3,0,0]=4 548 B17R3.30918 Brc1ccc2oc(cc2c1)c3nc[nH]n3 271570a_100010176198_100000761765 [0,1,0,0,0,0|3,0,0]=4 549 B17R3.30918 Brc1ccc2sc(cc2c1)c3cc[nH]c3 271570a_100000102155_200010198765 [0,1,0,0,0,0|3,0,0]=4 550 B17R3.30918 Brc1ccc2sc(cc2c1)c3cc[nH]n3 271570a_100000062414_200010198765 [0,1,0,0,0,0|2,0,0]=3 551 B17R3.30918 Cc1ccc2cc([nH]c2c1)c3c[nH]cn3 271570a_100010246276_100000756875 [0,1,0,0,0,0|3,0,0]=4 552 B17R3.30918 Cc1ccc2cc([nH]c2c1)c3cc[nH]n3 271570a_100010246276_100000062575 [0,1,0,0,0,0|1,0,0]=2 553 B17R3.30918 Cc1ccc2cc([nH]c2c1)c3ccco3 271570a_100010246276_100009814098 [0,1,0,0,0,0|3,0,0]=4 554 B17R3.30918 Cc1ccc2cc([nH]c2c1)c3cccs3 271570a_100010246276_100011215356 [0,1,0,0,0,0|3,0,0]=4 555 B17R3.30918 Cc1ccc2cc([nH]c2c1)c3ccoc3 271570a_100010246276_100011215275 [0,1,0,0,0,0|3,0,0]=4 556 B17R3.30918 Cc1ccc2cc([nH]c2c1)c3ccsc3 271570a_100010246276_100000738268 [0,1,0,0,0,0|3,0,0]=4 557 B17R3.30918 Cc1ccc2cc([nH]c2c1)c3ccsn3 271570a_100010246276_100009818082 [0,1,0,0,0,0|2,0,0]=3 558 B17R3.30918 Cc1ccc2cc([nH]c2c1)c3cn[nH]c3 271570a_100010246276_100000238712 [0,1,0,0,0,0|3,0,0]=4 559 B17R3.30918 Cc1ccc2cc([nH]c2c1)c3cscn3 271570a_100010246276_100000751502 [0,1,0,0,0,0|3,0,0]=4 560 B17R3.30918 Cc1ccc2cc([nH]c2c1)c3nc[nH]n3 271570a_100010246276_100000761765 [0,1,0,0,0,0|2,0,0]=3 561 B17R3.30918 Cc1ccc2cc([nH]c2c1)c3ncc[nH]3 271570a_100010246276_100025796157 [0,1,0,0,0,0|3,0,0]=4 562 B17R3.30918 Cc1ccc2cc([nH]c2c1)c3ncco3 271570a_100010246276_100011787736 [0,1,0,0,0,0|3,0,0]=4 563 B17R3.30918 Cc1ccc2cc([nH]c2c1)c3nccs3 271570a_100010246276_100000211983 [0,1,0,0,0,0|3,0,0]=4 564 B17R3.30918 Cc1ccc2cc([nH]c2c1)c3nncs3 271570a_100010246276_100000739804 [0,1,0,0,0,0|2,0,1]=4 565 B17R3.30918 Cc1ccc2nc(sc2c1)c3cc[nH]c3 271570a_100000102155_100010186437 [0,1,0,0,0,0|2,0,0]=3 566 B17R3.30918 Cc1ccc2nc(sc2c1)c3cc[nH]n3 271570a_100000062414_100010186437 [0,1,0,0,0,0|1,0,0]=2 567 B17R3.30918 Cc1ccc2nc(sc2c1)c3ccco3 271570a_100000750936_100010186437 [0,1,0,0,0,0|3,0,0]=4 568 B17R3.30918 Cc1ccc2nc(sc2c1)c3cccs3 271570a_100000742291_100010186437 [0,1,0,0,0,0|3,0,0]=4 569 B17R3.30918 Cc1ccc2nc(sc2c1)c3ccoc3 271570a_100011218838_100010186437 [0,1,0,0,0,0|3,0,0]=4 570 B17R3.30918 Cc1ccc2nc(sc2c1)c3ccsc3 271570a_100011934443_100010186437 [0,1,0,0,0,0|3,0,0]=4 571 B17R3.30918 Cc1ccc2nc(sc2c1)c3cn[nH]c3 271570a_100000041997_100010186437 [0,1,0,0,0,0|3,0,0]=4 572 B17R3.30918 Cc1ccc2nc(sc2c1)c3ncc[nH]3 271570a_100016988920_100010186437 [0,1,0,0,0,0|3,0,0]=4 573 B17R3.30918 Cc1ccc2oc(cc2c1)c3cc[nH]n3 271570a_200013722915_100000062575 [0,1,0,0,0,0|2,0,0]=3 574 B17R3.30918 Cc1ccc2oc(cc2c1)c3ccsn3 271570a_200013722915_100009818082 [0,1,0,0,0,0|3,0,0]=4 575 B17R3.30918 Cc1ccc2oc(cc2c1)c3nc[nH]n3 271570a_200013722915_100000761765 [0,1,0,0,0,0|3,0,0]=4 576 B17R3.30918 Cc1ccc2sc(cc2c1)c3cc[nH]n3 271570a_100000057607_100000062575 [0,1,0,0,0,0|2,0,0]=3 577 B17R3.30918 Cc1ccc2sc(cc2c1)c3ccsn3 271570a_100000057607_100009818082 [0,1,0,0,0,0|3,0,0]=4 578 B17R3.30918 Cc1ccc2sc(cc2c1)c3nc[nH]n3 271570a_100000057607_100000761765 [0,1,0,0,0,0|3,0,0]=4 579 B17R3.30918 Clc1ccc2[nH]c(cc2c1)c3c[nH]cn3 271570a_100010246260_100000756875 [0,1,0,0,0,0|3,0,0]=4 580 B17R3.30918 Clc1ccc2[nH]c(cc2c1)c3cc[nH]n3 271570a_100010246260_100000062575 [0,1,0,0,0,0|1,0,0]=2 581 B17R3.30918 Clc1ccc2[nH]c(cc2c1)c3ccco3 271570a_100010246260_100009814098 [0,1,0,0,0,0|3,0,0]=4 582 B17R3.30918 Clc1ccc2[nH]c(cc2c1)c3cccs3 271570a_100010246260_100011215356 [0,1,0,0,0,0|3,0,0]=4 583 B17R3.30918 Clc1ccc2[nH]c(cc2c1)c3ccoc3 271570a_100010246260_100011215275 [0,1,0,0,0,0|3,0,0]=4 584 B17R3.30918 Clc1ccc2[nH]c(cc2c1)c3ccsc3 271570a_100010246260_100000738268 [0,1,0,0,0,0|3,0,0]=4 585 B17R3.30918 Clc1ccc2[nH]c(cc2c1)c3ccsn3 271570a_100010246260_100009818082 [0,1,0,0,0,0|2,0,0]=3 586 B17R3.30918 Clc1ccc2[nH]c(cc2c1)c3cn[nH]c3 271570a_100010246260_100000238712 [0,1,0,0,0,0|3,0,0]=4 587 B17R3.30918 Clc1ccc2[nH]c(cc2c1)c3cscn3 271570a_100010246260_100000751502 [0,1,0,0,0,0|3,0,0]=4 588 B17R3.30918 Clc1ccc2[nH]c(cc2c1)c3nc[nH]n3 271570a_100010246260_100000761765 [0,1,0,0,0,0|2,0,0]=3 589 B17R3.30918 Clc1ccc2[nH]c(cc2c1)c3ncc[nH]3 271570a_100010246260_100025796157 [0,1,0,0,0,0|3,0,0]=4 590 B17R3.30918 Clc1ccc2[nH]c(cc2c1)c3ncco3 271570a_100010246260_100011787736 [0,1,0,0,0,0|3,0,0]=4 591 B17R3.30918 Clc1ccc2[nH]c(cc2c1)c3nccs3 271570a_100010246260_100000211983 [0,1,0,0,0,0|3,0,0]=4 592 B17R3.30918 Clc1ccc2[nH]c(cc2c1)c3nncs3 271570a_100010246260_100000739804 [0,1,0,0,0,0|2,0,1]=4 593 B17R3.30918 Clc1ccc2oc(cc2c1)c3cc[nH]n3 271570a_100012186365_100000062575 [0,1,0,0,0,0|2,0,0]=3 594 B17R3.30918 Clc1ccc2oc(cc2c1)c3ccsn3 271570a_100012186365_100009818082 [0,1,0,0,0,0|3,0,0]=4 595 B17R3.30918 Clc1ccc2oc(cc2c1)c3nc[nH]n3 271570a_100012186365_100000761765 [0,1,0,0,0,0|3,0,0]=4 596 B17R3.30918 Fc1ccc2[nH]c(cc2c1)c3c[nH]cn3 271570a_100010246264_100000756875 [0,1,0,0,0,0|3,0,0]=4 597 B17R3.30918 Fc1ccc2[nH]c(cc2c1)c3cc[nH]n3 271570a_100010246264_100000062575 [0,1,0,0,0,0|1,0,0]=2 598 B17R3.30918 Fc1ccc2[nH]c(cc2c1)c3ccco3 271570a_100010246264_100009814098 [0,1,0,0,0,0|3,0,0]=4 599 B17R3.30918 Fc1ccc2[nH]c(cc2c1)c3cccs3 271570a_100010246264_100011215356 [0,1,0,0,0,0|3,0,0]=4 600 B17R3.30918 Fc1ccc2[nH]c(cc2c1)c3ccoc3 271570a_100010246264_100011215275 [0,1,0,0,0,0|3,0,0]=4 601 B17R3.30918 Fc1ccc2[nH]c(cc2c1)c3ccsc3 271570a_100010246264_100000738268 [0,1,0,0,0,0|3,0,0]=4 602 B17R3.30918 Fc1ccc2[nH]c(cc2c1)c3ccsn3 271570a_100010246264_100009818082 [0,1,0,0,0,0|2,0,0]=3 603 B17R3.30918 Fc1ccc2[nH]c(cc2c1)c3cn[nH]c3 271570a_100010246264_100000238712 [0,1,0,0,0,0|3,0,0]=4 604 B17R3.30918 Fc1ccc2[nH]c(cc2c1)c3cscn3 271570a_100010246264_100000751502 [0,1,0,0,0,0|3,0,0]=4 605 B17R3.30918 Fc1ccc2[nH]c(cc2c1)c3nc[nH]n3 271570a_100010246264_100000761765 [0,1,0,0,0,0|2,0,0]=3 606 B17R3.30918 Fc1ccc2[nH]c(cc2c1)c3ncc[nH]3 271570a_100010246264_100025796157 [0,1,0,0,0,0|3,0,0]=4 607 B17R3.30918 Fc1ccc2[nH]c(cc2c1)c3ncco3 271570a_100010246264_100011787736 [0,1,0,0,0,0|3,0,0]=4 608 B17R3.30918 Fc1ccc2[nH]c(cc2c1)c3nccs3 271570a_100010246264_100000211983 [0,1,0,0,0,0|3,0,0]=4 609 B17R3.30918 Fc1ccc2[nH]c(cc2c1)c3nncs3 271570a_100010246264_100000739804 [0,1,0,0,0,0|2,0,1]=4 610 B17R3.30918 Fc1ccc2nc(cn2c1)c3cc[nH]c3 271570a_100000102155_100010231931 [0,1,0,0,0,0|3,0,0]=4 611 B17R3.30918 Fc1ccc2nc(cn2c1)c3cc[nH]n3 271570a_100000062414_100010231931 [0,1,0,0,0,0|2,0,0]=3 612 B17R3.30918 Fc1ccc2nc(sc2c1)c3cc[nH]c3 271570a_100000102155_100000751617 [0,1,0,0,0,0|2,0,0]=3 613 B17R3.30918 Fc1ccc2nc(sc2c1)c3cc[nH]n3 271570a_100000062414_100000751617 [0,1,0,0,0,0|1,0,0]=2 614 B17R3.30918 Fc1ccc2nc(sc2c1)c3ccco3 271570a_100000750936_100000751617 [0,1,0,0,0,0|3,0,0]=4 615 B17R3.30918 Fc1ccc2nc(sc2c1)c3cccs3 271570a_100000742291_100000751617 [0,1,0,0,0,0|3,0,0]=4 616 B17R3.30918 Fc1ccc2nc(sc2c1)c3ccoc3 271570a_100011218838_100000751617 [0,1,0,0,0,0|3,0,0]=4 617 B17R3.30918 Fc1ccc2nc(sc2c1)c3ccsc3 271570a_100011934443_100000751617 [0,1,0,0,0,0|3,0,0]=4 618 B17R3.30918 Fc1ccc2nc(sc2c1)c3cn[nH]c3 271570a_100000041997_100000751617 [0,1,0,0,0,0|3,0,0]=4 619 B17R3.30918 Fc1ccc2nc(sc2c1)c3ncc[nH]3 271570a_100016988920_100000751617 [0,1,0,0,0,0|3,0,0]=4 620 B17R3.30918 Fc1ccc2nc(sc2n1)c3cc[nH]c3 271570a_100000102155_200010738066 [0,1,0,0,0,0|3,0,0]=4 621 B17R3.30918 Fc1ccc2nc(sc2n1)c3cc[nH]n3 271570a_100000062414_200010738066 [0,1,0,0,0,0|2,0,0]=3 622 B17R3.30918 Fc1ccc2oc(cc2c1)c3cc[nH]n3 271570a_100012185221_100000062575 [0,1,0,0,0,0|2,0,0]=3 623 B17R3.30918 Fc1ccc2oc(cc2c1)c3ccsn3 271570a_100012185221_100009818082 [0,1,0,0,0,0|3,0,0]=4 624 B17R3.30918 Fc1ccc2oc(cc2c1)c3nc[nH]n3 271570a_100012185221_100000761765 [0,1,0,0,0,0|3,0,0]=4 625 B17R3.30918 Fc1ccc2sc(nc2c1)c3cc[nH]c3 271570a_100000102155_200010206605 [0,1,0,0,0,0|2,0,0]=3 626 B17R3.30918 Fc1ccc2sc(nc2c1)c3cc[nH]n3 271570a_100000062414_200010206605 [0,1,0,0,0,0|1,0,0]=2 627 B17R3.30918 Fc1ccc2sc(nc2c1)c3ccco3 271570a_100000750936_200010206605 [0,1,0,0,0,0|3,0,0]=4 628 B17R3.30918 Fc1ccc2sc(nc2c1)c3cccs3 271570a_100000742291_200010206605 [0,1,0,0,0,0|3,0,0]=4 629 B17R3.30918 Fc1ccc2sc(nc2c1)c3ccoc3 271570a_100011218838_200010206605 [0,1,0,0,0,0|3,0,0]=4 630 B17R3.30918 Fc1ccc2sc(nc2c1)c3ccsc3 271570a_100011934443_200010206605 [0,1,0,0,0,0|3,0,0]=4 631 B17R3.30918 Fc1ccc2sc(nc2c1)c3cn[nH]c3 271570a_100000041997_200010206605 [0,1,0,0,0,0|3,0,0]=4 632 B17R3.30918 Fc1ccc2sc(nc2c1)c3ncc[nH]3 271570a_100016988920_200010206605 [0,1,0,0,0,0|3,0,0]=4 633 B17R3.30918 Nc1ccc2nc(sc2c1)c3cc[nH]c3 271570a_100000102155_100010253933 [0,1,0,0,0,0|2,0,0]=3 634 B17R3.30918 Nc1ccc2nc(sc2c1)c3cc[nH]n3 271570a_100000062414_100010253933 [0,1,0,0,0,0|1,0,0]=2 635 B17R3.30918 Nc1ccc2nc(sc2c1)c3ccco3 271570a_100000750936_100010253933 [0,1,0,0,0,0|3,0,0]=4 636 B17R3.30918 Nc1ccc2nc(sc2c1)c3cccs3 271570a_100000742291_100010253933 [0,1,0,0,0,0|3,0,0]=4 637 B17R3.30918 Nc1ccc2nc(sc2c1)c3ccoc3 271570a_100011218838_100010253933 [0,1,0,0,0,0|3,0,0]=4 638 B17R3.30918 Nc1ccc2nc(sc2c1)c3ccsc3 271570a_100011934443_100010253933 [0,1,0,0,0,0|3,0,0]=4 639 B17R3.30918 Nc1ccc2nc(sc2c1)c3cn[nH]c3 271570a_100000041997_100010253933 [0,1,0,0,0,0|3,0,0]=4 640 B17R3.30918 Nc1ccc2nc(sc2c1)c3ncc[nH]3 271570a_100016988920_100010253933 [0,1,0,0,0,0|3,0,0]=4 641 B17R3.30918 Nc1ccc2sc(nc2c1)c3cc[nH]c3 271570a_100000102155_100010329861 [0,1,0,0,0,0|2,0,0]=3 642 B17R3.30918 Nc1ccc2sc(nc2c1)c3cc[nH]n3 271570a_100000062414_100010329861 [0,1,0,0,0,0|1,0,0]=2 643 B17R3.30918 Nc1ccc2sc(nc2c1)c3ccco3 271570a_100000750936_100010329861 [0,1,0,0,0,0|3,0,0]=4 644 B17R3.30918 Nc1ccc2sc(nc2c1)c3cccs3 271570a_100000742291_100010329861 [0,1,0,0,0,0|3,0,0]=4 645 B17R3.30918 Nc1ccc2sc(nc2c1)c3ccoc3 271570a_100011218838_100010329861 [0,1,0,0,0,0|3,0,0]=4 646 B17R3.30918 Nc1ccc2sc(nc2c1)c3ccsc3 271570a_100011934443_100010329861 [0,1,0,0,0,0|3,0,0]=4 647 B17R3.30918 Nc1ccc2sc(nc2c1)c3cn[nH]c3 271570a_100000041997_100010329861 [0,1,0,0,0,0|3,0,0]=4 648 B17R3.30918 Nc1ccc2sc(nc2c1)c3ncc[nH]3 271570a_100016988920_100010329861 [0,1,0,0,0,0|3,0,0]=4 649 B17R3.30918 O=c1ccn2nc(cc2[nH]1)c3cc[nH]n3 271570a_100000062414_100134615181 [0,1,0,0,0,0|3,0,0]=4 650 B17R3.30918 Oc1ccc2nc(sc2c1)c3cc[nH]c3 271570a_100000102155_100010063415 [0,1,0,0,0,0|2,0,0]=3 651 B17R3.30918 Oc1ccc2nc(sc2c1)c3cc[nH]n3 271570a_100000062414_100010063415 [0,1,0,0,0,0|1,0,0]=2 652 B17R3.30918 Oc1ccc2nc(sc2c1)c3ccco3 271570a_100000750936_100010063415 [0,1,0,0,0,0|3,0,0]=4 653 B17R3.30918 Oc1ccc2nc(sc2c1)c3cccs3 271570a_100000742291_100010063415 [0,1,0,0,0,0|3,0,0]=4 654 B17R3.30918 Oc1ccc2nc(sc2c1)c3ccoc3 271570a_100011218838_100010063415 [0,1,0,0,0,0|3,0,0]=4 655 B17R3.30918 Oc1ccc2nc(sc2c1)c3ccsc3 271570a_100011934443_100010063415 [0,1,0,0,0,0|3,0,0]=4 656 B17R3.30918 Oc1ccc2nc(sc2c1)c3cn[nH]c3 271570a_100000041997_100010063415 [0,1,0,0,0,0|3,0,0]=4 657 B17R3.30918 Oc1ccc2nc(sc2c1)c3ncc[nH]3 271570a_100016988920_100010063415 [0,1,0,0,0,0|3,0,0]=4 658 B15R2.562 Brc1ccccc1CSc2cc[nH]n2 62a_100000062575_100000184730 [0,0,1,0,0,0|3,0,0]=4 659 B15R2.562 Brc1ccccc1CSc2cc[nH]n2 62a_100000184730_100000062575 [0,0,1,0,0,0|3,0,0]=4 660 B15R2.562 Brc1ccccc1NCc2cc[nH]n2 207a_100000210017_100000738523 [0,0,1,0,0,0|1,0,1]=3 661 B15R2.562 Brc1ccccc1NCc2ccon2 34a_100000210017_100000234950 [0,0,1,0,0,0|2,0,1]=4 662 B15R2.562 Brc1cccnc1NCc2cc[nH]n2 27a_100000739516_100000696092 [0,0,1,0,0,0|2,0,1]=4 663 B15R2.562 Brc1cnccc1NCc2cc[nH]n2 27a_100000739516_100000726257 [0,0,1,0,0,0|2,0,1]=4 664 B15R2.562 Cc1ccccc1CSc2cc[nH]n2 62a_100000062575_100000211839 [0,0,1,0,0,0|3,0,0]=4 665 B15R2.562 Cc1ccccc1CSc2cc[nH]n2 62a_100000211839_100000062575 [0,0,1,0,0,0|3,0,0]=4 666 B15R2.562 Cc1ccccc1NCc2cc[nH]n2 207a_100015192222_100000738523 [0,0,1,0,0,0|1,0,1]=3 667 B15R2.562 Cc1ccccc1NCc2ccon2 34a_100015192222_100000234950 [0,0,1,0,0,0|2,0,1]=4 668 B15R2.562 Cc1cnccc1NCc2cc[nH]n2 27a_100000739516_100000765111 [0,0,1,0,0,0|2,0,1]=4 669 B15R2.562 Clc1ccccc1CSc2cc[nH]n2 62a_100000062575_100000187162 [0,0,1,0,0,0|3,0,0]=4 670 B15R2.562 Clc1ccccc1CSc2cc[nH]n2 62a_100000187162_100000062575 [0,0,1,0,0,0|3,0,0]=4 671 B15R2.562 Clc1ccccc1NCc2cc[nH]n2 207a_100000185783_100000738523 [0,0,1,0,0,0|1,0,1]=3 672 B15R2.562 Clc1ccccc1NCc2ccon2 34a_100000185783_100000234950 [0,0,1,0,0,0|2,0,1]=4 673 B15R2.562 Fc1ccccc1C=Cc2cc[nH]n2 271570a_200102527919_100000062575 [0,0,1,0,0,0|2,0,0]=3 674 B15R2.562 Fc1ccccc1C=Cc2ccsn2 271570a_200102527919_100009818082 [0,0,1,0,0,0|3,0,0]=4 675 B15R2.562 Fc1ccccc1C=Cc2nc[nH]n2 271570a_200102527919_100000761765 [0,0,1,0,0,0|3,0,0]=4 676 B15R2.562 Fc1ccccc1CSc2cc[nH]n2 62a_100000062575_100000211605 [0,0,1,0,0,0|3,0,0]=4 677 B15R2.562 Fc1ccccc1CSc2cc[nH]n2 62a_100000211605_100000062575 [0,0,1,0,0,0|3,0,0]=4 678 B15R2.562 Fc1ccccc1NCc2cc[nH]n2 207a_100000210422_100000738523 [0,0,1,0,0,0|1,0,1]=3 679 B15R2.562 Fc1ccccc1NCc2ccon2 34a_100000210422_100000234950 [0,0,1,0,0,0|2,0,1]=4 680 B15R2.562 Fc1cnccc1NCc2cc[nH]n2 27a_100000739516_100000035921 [0,0,1,0,0,0|2,0,1]=4 681 B15R2.562 Ic1ccccc1CSc2cc[nH]n2 62a_100000062575_100011216222 [0,0,1,0,0,0|3,0,0]=4 682 B15R2.562 Ic1ccccc1CSc2cc[nH]n2 62a_100011216222_100000062575 [0,0,1,0,0,0|3,0,0]=4 683 B15R2.562 Ic1ccccc1NCc2cc[nH]n2 207a_100000210053_100000738523 [0,0,1,0,0,0|1,0,1]=3 684 B15R2.562 Ic1ccccc1NCc2ccon2 34a_100000210053_100000234950 [0,0,1,0,0,0|2,0,1]=4 685 B15R2.562 Nc1ccccc1OCc2ccon2 34a_100000185747_100000234950 [0,0,1,0,0,0|2,0,1]=4 686 B15R2.562 Nc1ccccc1OCc2ccon2 7a_100000185747_100000234950 [0,0,1,0,0,0|2,0,1]=4 687 B15R2.562 Nc1ccccc1SCc2ccon2 62a_100000210017_100000234950 [0,0,1,0,0,0|2,0,1]=4 688 B15R2.562 Nc1ccccc1SCc2ccon2 62a_100000234950_100000210017 [0,0,1,0,0,0|2,0,1]=4 689 B15R2.562 Oc1ccccc1NCc2ccon2 34a_100000185747_100000234950 [0,0,1,0,0,0|2,0,1]=4 690 B15R2.2203 C=CCCNc1nc2ccccc2[nH]1 27a_100015191253_100009814255 [0,0,1,0,0,0|3,0,0]=4 691 B15R2.2203 C=CCCSc1nc2ccccc2[nH]1 62a_100000754431_100009814255 [0,0,1,0,0,0|3,0,0]=4 692 B15R2.2203 C=CCNCc1nc2ccccc2[nH]1 2230a_100020586998_100000737899 [0,0,1,0,0,0|1,0,2]=4 693 B15R2.2203 C=CCNCc1nc2ccccc2[nH]1 270004a_100020586998_100000185668 [0,0,1,0,0,0|1,0,2]=4 694 B15R2.2203 C=CCSCc1nc2ccccc2[nH]1 62a_100000210623_100000737899 [0,0,1,0,0,0|2,0,1]=4 695 B15R2.2203 CCCC=Cc1nc2ccccc2[nH]1 271570a_100016258520_100009814255 [0,0,1,0,0,0|2,0,1]=4 696 B15R2.2203 CCNN=Cc1cc2ccccc2[nH]1 4a_100000756455_100000051030 [0,0,1,0,0,0|1,0,2]=4 697 B15R2.2203 CCNN=Cc1nc2ccccc2[nH]1 4a_100000756455_100000185668 [0,0,1,0,0,0|0,0,2]=3 698 B15R2.2203 CCNN=Cc1nc2ccccc2s1 4a_100000756455_100011204187 [0,0,1,0,0,0|1,0,2]=4 699 B15R2.2203 CCOC=Cc1nc2ccccc2[nH]1 271570a_100016256518_100009814255 [0,0,1,0,0,0|3,0,0]=4 700 B15R2.2203 COCC=Cc1nc2ccccc2[nH]1 271570a_100016286323_100009814255 [0,0,1,0,0,0|2,0,1]=4 701 B15R3.4166 c1cc(n[nH]1)c2cc3sccc3s2 271570a_100000062414_200010191111 [0,0,0,0,1,0|3,0,0]=4 702 B15R3.4166 c1cc(n[nH]1)c2cc3sccc3s2 271570a_100010775590_100000062575 [0,0,0,0,1,0|3,0,0]=4 703 B15R3.4166 c1cn2nc(sc2n1)c3cc[nH]n3 271570a_100000062414_100011333511 [0,0,0,0,1,0|3,0,0]=4 704 B17R3.1917 c1cc2cc(ccc2cn1)c3cc[nH]n3 271570a_100000062414_100009816743 [0,0,0,0,0,1|3,0,0]=4 705 B17R3.1917 c1cc2cc(ccc2cn1)c3cc[nH]n3 271570a_100000070448_100000062575 [0,0,0,0,0,1|3,0,0]=4 706 B17R3.1917 c1cc2ccc(cc2cn1)c3cc[nH]n3 271570a_100000062414_100000686496 [0,0,0,0,0,1|3,0,0]=4 707 B17R3.1917 c1cc2ccc(cc2cn1)c3cc[nH]n3 271570a_100000068421_100000062575 [0,0,0,0,0,1|3,0,0]=4 708 B17R3.1917 c1cc2ccc(nc2cn1)c3cc[nH]c3 271570a_100000102155_100000020162 [0,0,0,0,0,1|3,0,0]=4 709 B17R3.1917 c1cc2ccc(nc2cn1)c3cc[nH]n3 271570a_100000062414_100000020162 [0,0,0,0,0,1|2,0,0]=3 710 B17R3.1917 c1ccc2cc(ccc2c1)c3cc[nH]c3 271570a_100000102155_100000233703 [0,0,0,0,0,1|3,0,0]=4 711 B17R3.1917 c1ccc2cc(ccc2c1)c3cc[nH]n3 271570a_100000062414_100000233703 [0,0,0,0,0,1|2,0,0]=3 712 B17R3.1917 c1ccc2cc(ccc2c1)c3cc[nH]n3 271570a_100011218693_100000062575 [0,0,0,0,0,1|2,0,0]=3 713 B17R3.1917 c1ccc2cc(ccc2c1)c3ccsn3 271570a_100011218693_100009818082 [0,0,0,0,0,1|3,0,0]=4 714 B17R3.1917 c1ccc2cc(ccc2c1)c3nc[nH]n3 271570a_100011218693_100000761765 [0,0,0,0,0,1|3,0,0]=4 715 B17R3.1917 c1ccc2cc(ncc2c1)c3cc[nH]c3 271570a_100000102155_100000047361 [0,0,0,0,0,1|2,0,0]=3 716 B17R3.1917 c1ccc2cc(ncc2c1)c3cc[nH]n3 271570a_100000062414_100000047361 [0,0,0,0,0,1|1,0,0]=2 717 B17R3.1917 c1ccc2cc(ncc2c1)c3ccoc3 271570a_100011218838_100000047361 [0,0,0,0,0,1|3,0,0]=4 718 B17R3.1917 c1ccc2cc(ncc2c1)c3ccsc3 271570a_100011934443_100000047361 [0,0,0,0,0,1|3,0,0]=4 719 B17R3.1917 c1ccc2cc(ncc2c1)c3cn[nH]c3 271570a_100000041997_100000047361 [0,0,0,0,0,1|3,0,0]=4 720 B17R3.1917 c1ccc2cc(ncc2c1)c3ncc[nH]3 271570a_100016988920_100000047361 [0,0,0,0,0,1|3,0,0]=4 721 B17R3.1917 c1ccc2nc(ccc2c1)c3cc[nH]c3 271570a_100000102155_100011291633 [0,0,0,0,0,1|2,0,0]=3 722 B17R3.1917 c1ccc2nc(ccc2c1)c3cc[nH]n3 271570a_100000062414_100011291633 [0,0,0,0,0,1|1,0,0]=2 723 B17R3.1917 c1ccc2nc(ccc2c1)c3ccoc3 271570a_100011218838_100011291633 [0,0,0,0,0,1|3,0,0]=4 724 B17R3.1917 c1ccc2nc(ccc2c1)c3ccsc3 271570a_100011934443_100011291633 [0,0,0,0,0,1|3,0,0]=4 725 B17R3.1917 c1ccc2nc(ccc2c1)c3cn[nH]c3 271570a_100000041997_100011291633 [0,0,0,0,0,1|3,0,0]=4 726 B17R3.1917 c1ccc2nc(ccc2c1)c3ncc[nH]3 271570a_100016988920_100011291633 [0,0,0,0,0,1|3,0,0]=4 727 B17R3.1917 c1ccc2nc(cnc2c1)c3cc[nH]c3 271570a_100000102155_100000756483 [0,0,0,0,0,1|1,0,1]=3 728 B17R3.1917 c1ccc2nc(cnc2c1)c3cc[nH]n3 271570a_100000062414_100000756483 [0,0,0,0,0,1|0,0,1]=2 729 B17R3.1917 c1ccc2nc(cnc2c1)c3ccoc3 271570a_100011218838_100000756483 [0,0,0,0,0,1|2,0,1]=4 730 B17R3.1917 c1ccc2nc(cnc2c1)c3ccsc3 271570a_100011934443_100000756483 [0,0,0,0,0,1|2,0,1]=4 731 B17R3.1917 c1ccc2nc(cnc2c1)c3cn[nH]c3 271570a_100000041997_100000756483 [0,0,0,0,0,1|2,0,1]=4 732 B17R3.1917 c1ccc2nc(cnc2c1)c3ncc[nH]3 271570a_100016988920_100000756483 [0,0,0,0,0,1|2,0,1]=4 733 B17R3.1917 c1ccc2nc(ncc2c1)c3cc[nH]c3 271570a_100000102155_100000097389 [0,0,0,0,0,1|1,0,1]=3 734 B17R3.1917 c1ccc2nc(ncc2c1)c3cc[nH]n3 271570a_100000062414_100000097389 [0,0,0,0,0,1|0,0,1]=2 735 B17R3.1917 c1ccc2nc(ncc2c1)c3ccoc3 271570a_100011218838_100000097389 [0,0,0,0,0,1|2,0,1]=4 736 B17R3.1917 c1ccc2nc(ncc2c1)c3ccsc3 271570a_100011934443_100000097389 [0,0,0,0,0,1|2,0,1]=4 737 B17R3.1917 c1ccc2nc(ncc2c1)c3cn[nH]c3 271570a_100000041997_100000097389 [0,0,0,0,0,1|2,0,1]=4 738 B17R3.1917 c1ccc2nc(ncc2c1)c3ncc[nH]3 271570a_100016988920_100000097389 [0,0,0,0,0,1|2,0,1]=4 739 B17R3.1917 c1ccc2ncc(cc2c1)c3c[nH]cn3 271570a_100012350238_100000756875 [0,0,0,0,0,1|3,0,0]=4 740 B17R3.1917 c1ccc2ncc(cc2c1)c3cc[nH]c3 271570a_100000102155_100000737414 [0,0,0,0,0,1|2,0,0]=3 741 B17R3.1917 c1ccc2ncc(cc2c1)c3cc[nH]n3 271570a_100000062414_100000737414 [0,0,0,0,0,1|1,0,0]=2 742 B17R3.1917 c1ccc2ncc(cc2c1)c3cc[nH]n3 271570a_100012350238_100000062575 [0,0,0,0,0,1|1,0,0]=2 743 B17R3.1917 c1ccc2ncc(cc2c1)c3ccoc3 271570a_100011218838_100000737414 [0,0,0,0,0,1|3,0,0]=4 744 B17R3.1917 c1ccc2ncc(cc2c1)c3ccoc3 271570a_100012350238_100011215275 [0,0,0,0,0,1|3,0,0]=4 745 B17R3.1917 c1ccc2ncc(cc2c1)c3ccsc3 271570a_100011934443_100000737414 [0,0,0,0,0,1|3,0,0]=4 746 B17R3.1917 c1ccc2ncc(cc2c1)c3ccsc3 271570a_100012350238_100000738268 [0,0,0,0,0,1|3,0,0]=4 747 B17R3.1917 c1ccc2ncc(cc2c1)c3ccsn3 271570a_100012350238_100009818082 [0,0,0,0,0,1|2,0,0]=3 748 B17R3.1917 c1ccc2ncc(cc2c1)c3cn[nH]c3 271570a_100000041997_100000737414 [0,0,0,0,0,1|3,0,0]=4 749 B17R3.1917 c1ccc2ncc(cc2c1)c3cn[nH]c3 271570a_100012350238_100000238712 [0,0,0,0,0,1|3,0,0]=4 750 B17R3.1917 c1ccc2ncc(cc2c1)c3cscn3 271570a_100012350238_100000751502 [0,0,0,0,0,1|3,0,0]=4 751 B17R3.1917 c1ccc2ncc(cc2c1)c3nc[nH]n3 271570a_100012350238_100000761765 [0,0,0,0,0,1|2,0,0]=3 752 B17R3.1917 c1ccc2ncc(cc2c1)c3ncc[nH]3 271570a_100012350238_100025796157 [0,0,0,0,0,1|3,0,0]=4 753 B17R3.1917 c1ccc2ncc(cc2c1)c3ncc[nH]3 271570a_100016988920_100000737414 [0,0,0,0,0,1|3,0,0]=4 754 B17R3.1917 c1ccc2ncc(cc2c1)c3ncco3 271570a_100012350238_100011787736 [0,0,0,0,0,1|3,0,0]=4 755 B17R3.1917 c1ccc2ncc(cc2c1)c3nccs3 271570a_100012350238_100000211983 [0,0,0,0,0,1|3,0,0]=4 756 B17R3.1917 c1ccc2ncc(cc2c1)c3nncs3 271570a_100012350238_100000739804 [0,0,0,0,0,1|2,0,1]=4 757 B17R3.1917 c1cnc2cc(ccc2c1)c3cc[nH]n3 271570a_100000062414_100009816655 [0,0,0,0,0,1|3,0,0]=4 758 B17R3.1917 c1cnc2cc(ccc2c1)c3cc[nH]n3 271570a_100012353946_100000062575 [0,0,0,0,0,1|3,0,0]=4 759 B17R3.1917 c1cnc2cc(cnc2c1)c3cc[nH]c3 271570a_100000102155_100010246316 [0,0,0,0,0,1|3,0,0]=4 760 B17R3.1917 c1cnc2cc(cnc2c1)c3cc[nH]n3 271570a_100000062414_100010246316 [0,0,0,0,0,1|2,0,0]=3 761 B17R3.1917 c1cnc2cc(ncc2n1)c3cc[nH]n3 271570a_100000062414_100010370699 [0,0,0,0,0,1|3,0,0]=4 762 B17R3.1917 c1cnc2ccc(cc2c1)c3cc[nH]n3 271570a_100000062414_100000754243 [0,0,0,0,0,1|3,0,0]=4 763 B17R3.1917 c1cnc2ccc(cc2c1)c3cc[nH]n3 271570a_100012351079_100000062575 [0,0,0,0,0,1|3,0,0]=4 764 B17R3.1917 c1cnc2ccc(nc2c1)c3cc[nH]c3 271570a_100000102155_100000073381 [0,0,0,0,0,1|3,0,0]=4 765 B17R3.1917 c1cnc2ccc(nc2c1)c3cc[nH]n3 271570a_100000062414_100000073381 [0,0,0,0,0,1|2,0,0]=3 766 B17R3.1917 c1cnc2nc(ccc2c1)c3cc[nH]c3 271570a_100000102155_100009888989 [0,0,0,0,0,1|3,0,0]=4 767 B17R3.1917 c1cnc2nc(ccc2c1)c3cc[nH]n3 271570a_100000062414_100009888989 [0,0,0,0,0,1|2,0,0]=3 768 B17R3.1917 c1cnc2nc(ccc2n1)c3cc[nH]n3 271570a_100000062414_100012351543 [0,0,0,0,0,1|3,0,0]=4 769 B17R3.1917 c1cnc2ncc(cc2n1)c3cc[nH]n3 271570a_100000062414_100000753224 [0,0,0,0,0,1|3,0,0]=4 770 B17R3.1917 c1cnc2ncc(nc2c1)c3cc[nH]c3 271570a_100000102155_100000084304 [0,0,0,0,0,1|2,0,1]=4 771 B17R3.1917 c1cnc2ncc(nc2c1)c3cc[nH]n3 271570a_100000062414_100000084304 [0,0,0,0,0,1|1,0,1]=3 772 B17R3.1917 c1coc(c1)c2cc3ccccc3cn2 271570a_100000750936_100000047361 [0,0,0,0,0,1|3,0,0]=4 773 B17R3.1917 c1coc(c1)c2ccc3ccccc3n2 271570a_100000750936_100011291633 [0,0,0,0,0,1|3,0,0]=4 774 B17R3.1917 c1coc(c1)c2cnc3ccccc3c2 271570a_100000750936_100000737414 [0,0,0,0,0,1|3,0,0]=4 775 B17R3.1917 c1coc(c1)c2cnc3ccccc3c2 271570a_100012350238_100009814098 [0,0,0,0,0,1|3,0,0]=4 776 B17R3.1917 c1coc(c1)c2cnc3ccccc3n2 271570a_100000750936_100000756483 [0,0,0,0,0,1|2,0,1]=4 777 B17R3.1917 c1coc(c1)c2ncc3ccccc3n2 271570a_100000750936_100000097389 [0,0,0,0,0,1|2,0,1]=4 778 B17R3.1917 c1csc(c1)c2cc3ccccc3cn2 271570a_100000742291_100000047361 [0,0,0,0,0,1|3,0,0]=4 779 B17R3.1917 c1csc(c1)c2ccc3ccccc3n2 271570a_100000742291_100011291633 [0,0,0,0,0,1|3,0,0]=4 780 B17R3.1917 c1csc(c1)c2cnc3ccccc3c2 271570a_100000742291_100000737414 [0,0,0,0,0,1|3,0,0]=4 781 B17R3.1917 c1csc(c1)c2cnc3ccccc3c2 271570a_100012350238_100011215356 [0,0,0,0,0,1|3,0,0]=4 782 B17R3.1917 c1csc(c1)c2cnc3ccccc3n2 271570a_100000742291_100000756483 [0,0,0,0,0,1|2,0,1]=4 783 B17R3.1917 c1csc(c1)c2ncc3ccccc3n2 271570a_100000742291_100000097389 [0,0,0,0,0,1|2,0,1]=4 784 B17R3.8685 c1ccc2[nH]c(cc2c1)Sc3c[nH]cn3 62a_100000756875_100010232065 [0,0,0,0,0,1|3,0,0]=4 785 B17R3.8685 c1ccc2[nH]c(cc2c1)Sc3c[nH]nn3 62a_100009819707_100010232065 [0,0,0,0,0,1|2,0,1]=4 786 B17R3.8685 c1ccc2[nH]c(cc2c1)Sc3cc[nH]n3 62a_100000062575_100010232065 [0,0,0,0,0,1|1,0,0]=2 787 B17R3.8685 c1ccc2[nH]c(cc2c1)Sc3ccoc3 62a_100011215275_100010232065 [0,0,0,0,0,1|3,0,0]=4 788 B17R3.8685 c1ccc2[nH]c(cc2c1)Sc3ccon3 62a_100009818083_100010232065 [0,0,0,0,0,1|2,0,0]=3 789 B17R3.8685 c1ccc2[nH]c(cc2c1)Sc3ccsc3 62a_100000738268_100010232065 [0,0,0,0,0,1|3,0,0]=4 790 B17R3.8685 c1ccc2[nH]c(cc2c1)Sc3ccsn3 62a_100009818082_100010232065 [0,0,0,0,0,1|2,0,0]=3 791 B17R3.8685 c1ccc2[nH]c(cc2c1)Sc3cn[nH]c3 62a_100000238712_100010232065 [0,0,0,0,0,1|3,0,0]=4 792 B17R3.8685 c1ccc2[nH]c(cc2c1)Sc3cscn3 62a_100000751502_100010232065 [0,0,0,0,0,1|3,0,0]=4 793 B17R3.8685 c1ccc2[nH]c(cc2c1)Sc3nc[nH]n3 62a_100000761765_100010232065 [0,0,0,0,0,1|2,0,0]=3 794 B17R3.8685 c1ccc2[nH]c(cc2c1)Sc3ncc[nH]3 62a_100025796157_100010232065 [0,0,0,0,0,1|3,0,0]=4 795 B17R3.8685 c1ccc2[nH]c(cc2c1)Sc3ncco3 62a_100011787736_100010232065 [0,0,0,0,0,1|3,0,0]=4 796 B17R3.8685 c1ccc2[nH]c(cc2c1)Sc3nccs3 62a_100000211983_100010232065 [0,0,0,0,0,1|3,0,0]=4 797 B17R3.8685 c1ccc2[nH]c(cc2c1)Sc3nncs3 62a_100000739804_100010232065 [0,0,0,0,0,1|2,0,1]=4 798 B17R3.8685 c1ccc2[nH]c(nc2c1)Sc3c[nH]cn3 62a_100000756875_100009814255 [0,0,0,0,0,1|2,0,0]=3 799 B17R3.8685 c1ccc2[nH]c(nc2c1)Sc3c[nH]nn3 62a_100009819707_100009814255 [0,0,0,0,0,1|1,0,1]=3 800 B17R3.8685 c1ccc2[nH]c(nc2c1)Sc3cc[nH]n3 62a_100000062575_100009814255 [0,0,0,0,0,1|0,0,0]=1 801 B17R3.8685 c1ccc2[nH]c(nc2c1)Sc3ccoc3 62a_100011215275_100009814255 [0,0,0,0,0,1|2,0,0]=3 802 B17R3.8685 c1ccc2[nH]c(nc2c1)Sc3ccon3 62a_100009818083_100009814255 [0,0,0,0,0,1|1,0,0]=2 803 B17R3.8685 c1ccc2[nH]c(nc2c1)Sc3ccsc3 62a_100000738268_100009814255 [0,0,0,0,0,1|2,0,0]=3 804 B17R3.8685 c1ccc2[nH]c(nc2c1)Sc3ccsn3 62a_100009818082_100009814255 [0,0,0,0,0,1|1,0,0]=2 805 B17R3.8685 c1ccc2[nH]c(nc2c1)Sc3cn[nH]c3 62a_100000238712_100009814255 [0,0,0,0,0,1|2,0,0]=3 806 B17R3.8685 c1ccc2[nH]c(nc2c1)Sc3cnco3 62a_100020591547_100009814255 [0,0,0,0,0,1|2,0,1]=4 807 B17R3.8685 c1ccc2[nH]c(nc2c1)Sc3cncs3 62a_100011934649_100009814255 [0,0,0,0,0,1|2,0,1]=4 808 B17R3.8685 c1ccc2[nH]c(nc2c1)Sc3cnoc3 62a_100009815712_100009814255 [0,0,0,0,0,1|2,0,1]=4 809 B17R3.8685 c1ccc2[nH]c(nc2c1)Sc3cnsc3 62a_100009815736_100009814255 [0,0,0,0,0,1|2,0,1]=4 810 B17R3.8685 c1ccc2[nH]c(nc2c1)Sc3cscn3 62a_100000751502_100009814255 [0,0,0,0,0,1|2,0,0]=3 811 B17R3.8685 c1ccc2[nH]c(nc2c1)Sc3nc[nH]n3 62a_100000761765_100009814255 [0,0,0,0,0,1|1,0,0]=2 812 B17R3.8685 c1ccc2[nH]c(nc2c1)Sc3ncc[nH]3 62a_100025796157_100009814255 [0,0,0,0,0,1|2,0,0]=3 813 B17R3.8685 c1ccc2[nH]c(nc2c1)Sc3ncco3 62a_100011787736_100009814255 [0,0,0,0,0,1|2,0,0]=3 814 B17R3.8685 c1ccc2[nH]c(nc2c1)Sc3nccs3 62a_100000211983_100009814255 [0,0,0,0,0,1|2,0,0]=3 815 B17R3.8685 c1ccc2[nH]c(nc2c1)Sc3ncns3 62a_100000693119_100009814255 [0,0,0,0,0,1|2,0,1]=4 816 B17R3.8685 c1ccc2[nH]c(nc2c1)Sc3nncs3 62a_100000739804_100009814255 [0,0,0,0,0,1|1,0,1]=3 817 B17R3.8685 c1ccc2c(c1)CC(C2)Sc3cc[nH]n3 62a_100000062575_100000753484 [0,0,0,0,0,1|2,0,1]=4 818 B17R3.8685 c1ccc2c(c1)CN(C2)Cc3cc[nH]n3 270004a_100000752595_100000738523 [0,0,0,0,0,1|3,0,0]=4 819 B17R3.8685 c1ccc2oc(cc2c1)Sc3cc[nH]n3 62a_100000062575_100010159458 [0,0,0,0,0,1|2,0,0]=3 820 B17R3.8685 c1ccc2oc(cc2c1)Sc3ccon3 62a_100009818083_100010159458 [0,0,0,0,0,1|3,0,0]=4 821 B17R3.8685 c1ccc2oc(cc2c1)Sc3ccsn3 62a_100009818082_100010159458 [0,0,0,0,0,1|3,0,0]=4 822 B17R3.8685 c1ccc2oc(cc2c1)Sc3nc[nH]n3 62a_100000761765_100010159458 [0,0,0,0,0,1|3,0,0]=4 823 B17R3.8685 c1ccc2sc(cc2c1)Sc3cc[nH]n3 62a_100000062575_100009816949 [0,0,0,0,0,1|2,0,0]=3 824 B17R3.8685 c1ccc2sc(cc2c1)Sc3ccon3 62a_100009818083_100009816949 [0,0,0,0,0,1|3,0,0]=4 825 B17R3.8685 c1ccc2sc(cc2c1)Sc3ccsn3 62a_100009818082_100009816949 [0,0,0,0,0,1|3,0,0]=4 826 B17R3.8685 c1ccc2sc(cc2c1)Sc3nc[nH]n3 62a_100000761765_100009816949 [0,0,0,0,0,1|3,0,0]=4 827 B17R3.8685 c1ccc2sc(nc2c1)Sc3c[nH]cn3 62a_100000756875_100000751744 [0,0,0,0,0,1|3,0,0]=4 828 B17R3.8685 c1ccc2sc(nc2c1)Sc3c[nH]nn3 62a_100009819707_100000751744 [0,0,0,0,0,1|2,0,1]=4 829 B17R3.8685 c1ccc2sc(nc2c1)Sc3cc[nH]n3 62a_100000062575_100000751744 [0,0,0,0,0,1|1,0,0]=2 830 B17R3.8685 c1ccc2sc(nc2c1)Sc3ccoc3 62a_100011215275_100000751744 [0,0,0,0,0,1|3,0,0]=4 831 B17R3.8685 c1ccc2sc(nc2c1)Sc3ccon3 62a_100009818083_100000751744 [0,0,0,0,0,1|2,0,0]=3 832 B17R3.8685 c1ccc2sc(nc2c1)Sc3ccsc3 62a_100000738268_100000751744 [0,0,0,0,0,1|3,0,0]=4 833 B17R3.8685 c1ccc2sc(nc2c1)Sc3ccsn3 62a_100009818082_100000751744 [0,0,0,0,0,1|2,0,0]=3 834 B17R3.8685 c1ccc2sc(nc2c1)Sc3cn[nH]c3 62a_100000238712_100000751744 [0,0,0,0,0,1|3,0,0]=4 835 B17R3.8685 c1ccc2sc(nc2c1)Sc3cscn3 62a_100000751502_100000751744 [0,0,0,0,0,1|3,0,0]=4 836 B17R3.8685 c1ccc2sc(nc2c1)Sc3nc[nH]n3 62a_100000761765_100000751744 [0,0,0,0,0,1|2,0,0]=3 837 B17R3.8685 c1ccc2sc(nc2c1)Sc3ncc[nH]3 62a_100025796157_100000751744 [0,0,0,0,0,1|3,0,0]=4 838 B17R3.8685 c1ccc2sc(nc2c1)Sc3ncco3 62a_100011787736_100000751744 [0,0,0,0,0,1|3,0,0]=4 839 B17R3.8685 c1ccc2sc(nc2c1)Sc3nccs3 62a_100000211983_100000751744 [0,0,0,0,0,1|3,0,0]=4 840 B17R3.8685 c1ccc2sc(nc2c1)Sc3nncs3 62a_100000739804_100000751744 [0,0,0,0,0,1|2,0,1]=4 841 B17R3.8685 c1ccn2cc(nc2c1)Sc3cc[nH]n3 62a_100000062575_100009819586 [0,0,0,0,0,1|2,0,0]=3 842 B17R3.8685 c1ccn2cc(nc2c1)Sc3ccon3 62a_100009818083_100009819586 [0,0,0,0,0,1|3,0,0]=4 843 B17R3.8685 c1ccn2cc(nc2c1)Sc3ccsn3 62a_100009818082_100009819586 [0,0,0,0,0,1|3,0,0]=4 844 B17R3.8685 c1ccn2cc(nc2c1)Sc3nc[nH]n3 62a_100000761765_100009819586 [0,0,0,0,0,1|3,0,0]=4 845 B17R3.8685 c1cn2nc(nc2cn1)Sc3cc[nH]n3 62a_100000062575_100010748104 [0,0,0,0,0,1|2,0,1]=4 846 B17R3.8685 c1cn2nc(nc2cn1)Sc3cc[nH]n3 62a_100010748104_100000062575 [0,0,0,0,0,1|2,0,1]=4 847 B17R3.8685 c1cnc2[nH]c(cc2c1)Sc3cc[nH]n3 62a_100000062575_100010079843 [0,0,0,0,0,1|2,0,0]=3 848 B17R3.8685 c1cnc2[nH]c(cc2c1)Sc3ccon3 62a_100009818083_100010079843 [0,0,0,0,0,1|3,0,0]=4 849 B17R3.8685 c1cnc2[nH]c(cc2c1)Sc3ccsn3 62a_100009818082_100010079843 [0,0,0,0,0,1|3,0,0]=4 850 B17R3.8685 c1cnc2[nH]c(cc2c1)Sc3nc[nH]n3 62a_100000761765_100010079843 [0,0,0,0,0,1|3,0,0]=4 851 B17R3.8685 c1cnc2sc(nc2c1)Sc3cc[nH]n3 62a_100000062575_100010188088 [0,0,0,0,0,1|2,0,0]=3 852 B17R3.8685 c1cnc2sc(nc2c1)Sc3cc[nH]n3 62a_100010188088_100000062575 [0,0,0,0,0,1|2,0,0]=3 853 B17R3.8685 c1cnc2sc(nc2c1)Sc3ccon3 62a_100009818083_100010188088 [0,0,0,0,0,1|3,0,0]=4 854 B17R3.8685 c1cnc2sc(nc2c1)Sc3ccon3 62a_100010188088_100009818083 [0,0,0,0,0,1|3,0,0]=4 855 B17R3.8685 c1cnc2sc(nc2c1)Sc3ccsn3 62a_100009818082_100010188088 [0,0,0,0,0,1|3,0,0]=4 856 B17R3.8685 c1cnc2sc(nc2c1)Sc3ccsn3 62a_100010188088_100009818082 [0,0,0,0,0,1|3,0,0]=4 857 B17R3.8685 c1cnc2sc(nc2c1)Sc3nc[nH]n3 62a_100000761765_100010188088 [0,0,0,0,0,1|3,0,0]=4 858 B17R3.8685 c1cnc2sc(nc2c1)Sc3nc[nH]n3 62a_100010188088_100000761765 [0,0,0,0,0,1|3,0,0]=4 859 B17R3.8685 c1cnn2cc(nc2c1)Sc3cc[nH]n3 62a_100000062575_200010296001 [0,0,0,0,0,1|3,0,0]=4 860 B17R3.8685 c1cnn2cc(nc2c1)Sc3cc[nH]n3 62a_200010296001_100000062575 [0,0,0,0,0,1|3,0,0]=4 861 B17R3.8685 c1coc(c1)Sc2cc3ccccc3[nH]2 62a_100009814098_100010232065 [0,0,0,0,0,1|3,0,0]=4 862 B17R3.8685 c1coc(c1)Sc2nc3ccccc3[nH]2 62a_100009814098_100009814255 [0,0,0,0,0,1|2,0,0]=3 863 B17R3.8685 c1coc(c1)Sc2nc3ccccc3s2 62a_100009814098_100000751744 [0,0,0,0,0,1|3,0,0]=4 864 B17R3.8685 c1csc(c1)Sc2cc3ccccc3[nH]2 62a_100011215356_100010232065 [0,0,0,0,0,1|3,0,0]=4 865 B17R3.8685 c1csc(c1)Sc2nc3ccccc3[nH]2 62a_100011215356_100009814255 [0,0,0,0,0,1|2,0,0]=3 866 B17R3.8685 c1csc(c1)Sc2nc3ccccc3s2 62a_100011215356_100000751744 [0,0,0,0,0,1|3,0,0]=4 867 B17R3.8708 C1=C(CCCC1)c2nc3ccccc3[nH]2 271570a_100000062251_100009814255 [0,0,0,0,0,1|2,0,1]=4 868 B17R3.8708 C1=C(CCCO1)c2nc3ccccc3[nH]2 271570a_100010175576_100009814255 [0,0,0,0,0,1|2,0,1]=4 869 B17R3.8708 C1=C(CCNC1)c2cc3ccccc3[nH]2 271570a_100000731432_100010232065 [0,0,0,0,0,1|2,0,1]=4 870 B17R3.8708 C1=C(CCNC1)c2nc3ccccc3[nH]2 271570a_100000731432_100009814255 [0,0,0,0,0,1|1,0,1]=3 871 B17R3.8708 C1=C(CCNC1)c2nc3ccccc3s2 271570a_100000731432_100000751744 [0,0,0,0,0,1|2,0,1]=4 872 B17R3.8708 C1=C(CCOC1)c2nc3ccccc3[nH]2 271570a_100000070234_100009814255 [0,0,0,0,0,1|2,0,1]=4 873 B17R3.8708 C1=C(CCSC1)c2nc3ccccc3[nH]2 271570a_100010232141_100009814255 [0,0,0,0,0,1|2,0,1]=4 874 B17R3.8708 C1=C(Cc2c1cccc2)c3ccccn3 271570a_100010239756_100011216584 [0,0,0,0,0,1|3,0,0]=4 875 B17R3.8708 C1=C(Cc2c1cccc2)c3cccnc3 271570a_100010239756_100000752921 [0,0,0,0,0,1|3,0,0]=4 876 B17R3.8708 C1=C(Cc2c1cccc2)c3cccnn3 271570a_100010239756_100016991348 [0,0,0,0,0,1|2,0,1]=4 877 B17R3.8708 C1=C(Cc2c1cccc2)c3ccncn3 271570a_100010239756_100000703185 [0,0,0,0,0,1|2,0,1]=4 878 B17R3.8708 C1=C(Cc2c1cccc2)c3ccnnc3 271570a_100010239756_100000732662 [0,0,0,0,0,1|2,0,1]=4 879 B17R3.8708 C1=C(Cc2c1cccc2)c3cnccn3 271570a_100010239756_100000758340 [0,0,0,0,0,1|3,0,0]=4 880 B17R3.8708 C1=C(Cc2c1cccc2)c3ncccn3 271570a_100010239756_100000211032 [0,0,0,0,0,1|3,0,0]=4 881 B17R3.8708 C1=C(OCCC1)c2nc3ccccc3[nH]2 271570a_100010177797_100009814255 [0,0,0,0,0,1|2,0,1]=4 882 B17R3.8708 C1=CCN(CC1)c2nc3ccccc3[nH]2 27a_100000698166_100009814255 [0,0,0,0,0,1|3,0,0]=4 883 B17R3.8708 c1ccc(cc1)c2cc3ccccc3[nH]2 271570a_100010206980_100000210277 [0,0,0,0,0,1|3,0,0]=4 884 B17R3.8708 c1ccc(cc1)c2cc3ccccc3[nH]2 271570a_100011218836_100010232065 [0,0,0,0,0,1|3,0,0]=4 885 B17R3.8708 c1ccc(cc1)c2nc3ccccc3[nH]2 271570a_100011218836_100009814255 [0,0,0,0,0,1|2,0,0]=3 886 B17R3.8708 c1ccc(cc1)c2nc3ccccc3s2 271570a_100011218836_100000751744 [0,0,0,0,0,1|3,0,0]=4 887 B17R3.8708 c1ccc(cc1)c2nc3ccccc3s2 271570a_200000082171_100000210277 [0,0,0,0,0,1|3,0,0]=4 888 B17R3.8708 c1ccc(nc1)c2cc3ccccc3[nH]2 271570a_100010206980_100011216584 [0,0,0,0,0,1|2,0,0]=3 889 B17R3.8708 c1ccc(nc1)c2cc3ccccc3[nH]2 271570a_100011264011_100010232065 [0,0,0,0,0,1|2,0,0]=3 890 B17R3.8708 c1ccc(nc1)c2cc3ccccc3o2 271570a_100011264011_100010159458 [0,0,0,0,0,1|3,0,0]=4 891 B17R3.8708 c1ccc(nc1)c2cc3ccccc3o2 271570a_100011328764_100011216584 [0,0,0,0,0,1|3,0,0]=4 892 B17R3.8708 c1ccc(nc1)c2cc3ccccc3s2 271570a_100000034353_100011216584 [0,0,0,0,0,1|3,0,0]=4 893 B17R3.8708 c1ccc(nc1)c2cc3ccccc3s2 271570a_100011264011_100009816949 [0,0,0,0,0,1|3,0,0]=4 894 B17R3.8708 c1ccc(nc1)c2cc3cccnc3[nH]2 271570a_100011264011_100010079843 [0,0,0,0,0,1|3,0,0]=4 895 B17R3.8708 c1ccc(nc1)c2cn3ccccc3n2 271570a_100011264011_100009819586 [0,0,0,0,0,1|3,0,0]=4 896 B17R3.8708 c1ccc(nc1)c2nc3ccccc3[nH]2 271570a_100011264011_100009814255 [0,0,0,0,0,1|1,0,0]=2 897 B17R3.8708 c1ccc(nc1)c2nc3ccccc3s2 271570a_100011264011_100000751744 [0,0,0,0,0,1|2,0,0]=3 898 B17R3.8708 c1ccc(nc1)c2nc3ccccc3s2 271570a_200000082171_100011216584 [0,0,0,0,0,1|2,0,0]=3 899 B17R3.8708 c1ccc(nc1)c2nc3cccnc3s2 271570a_100011264011_100010188088 [0,0,0,0,0,1|3,0,0]=4 900 B17R3.8708 c1ccc2[nH]c(cc2c1)c3ccncc3 271570a_100000752145_100010232065 [0,0,0,0,0,1|2,0,1]=4 901 B17R3.8708 c1ccc2[nH]c(cc2c1)c3ccncc3 271570a_100010206980_100000035832 [0,0,0,0,0,1|2,0,1]=4 902 B17R3.8708 c1ccc2[nH]c(cc2c1)c3ccncn3 271570a_100010206980_100000703185 [0,0,0,0,0,1|1,0,1]=3 903 B17R3.8708 c1ccc2[nH]c(cc2c1)c3ccnnc3 271570a_100010206980_100000732662 [0,0,0,0,0,1|1,0,1]=3 904 B17R3.8708 c1ccc2[nH]c(cc2c1)c3cnccn3 271570a_100010206980_100000758340 [0,0,0,0,0,1|2,0,0]=3 905 B17R3.8708 c1ccc2[nH]c(cc2c1)c3cnccn3 271570a_100011962566_100010232065 [0,0,0,0,0,1|2,0,0]=3 906 B17R3.8708 c1ccc2[nH]c(cc2c1)c3cncnc3 271570a_100000707473_100010232065 [0,0,0,0,0,1|2,0,1]=4 907 B17R3.8708 c1ccc2[nH]c(cc2c1)c3cncnc3 271570a_100010206980_100011206942 [0,0,0,0,0,1|2,0,1]=4 908 B17R3.8708 c1ccc2[nH]c(cc2c1)c3cnnnc3 271570a_100010206980_100009846058 [0,0,0,0,0,1|2,0,1]=4 909 B17R3.8708 c1ccc2[nH]c(nc2c1)c3ccncc3 271570a_100000752145_100009814255 [0,0,0,0,0,1|1,0,1]=3 910 B17R3.8708 c1ccc2[nH]c(nc2c1)c3cnccn3 271570a_100011962566_100009814255 [0,0,0,0,0,1|1,0,0]=2 911 B17R3.8708 c1ccc2[nH]c(nc2c1)c3cncnc3 271570a_100000707473_100009814255 [0,0,0,0,0,1|1,0,1]=3 912 B17R3.8708 c1ccc2oc(cc2c1)c3ccncn3 271570a_100011328764_100000703185 [0,0,0,0,0,1|2,0,1]=4 913 B17R3.8708 c1ccc2oc(cc2c1)c3ccnnc3 271570a_100011328764_100000732662 [0,0,0,0,0,1|2,0,1]=4 914 B17R3.8708 c1ccc2oc(cc2c1)c3cnccn3 271570a_100011328764_100000758340 [0,0,0,0,0,1|3,0,0]=4 915 B17R3.8708 c1ccc2oc(cc2c1)c3cnccn3 271570a_100011962566_100010159458 [0,0,0,0,0,1|3,0,0]=4 916 B17R3.8708 c1ccc2sc(cc2c1)c3ccncn3 271570a_100000034353_100000703185 [0,0,0,0,0,1|2,0,1]=4 917 B17R3.8708 c1ccc2sc(cc2c1)c3ccnnc3 271570a_100000034353_100000732662 [0,0,0,0,0,1|2,0,1]=4 918 B17R3.8708 c1ccc2sc(cc2c1)c3cnccn3 271570a_100000034353_100000758340 [0,0,0,0,0,1|3,0,0]=4 919 B17R3.8708 c1ccc2sc(cc2c1)c3cnccn3 271570a_100011962566_100009816949 [0,0,0,0,0,1|3,0,0]=4 920 B17R3.8708 c1ccc2sc(nc2c1)c3ccncc3 271570a_100000752145_100000751744 [0,0,0,0,0,1|2,0,1]=4 921 B17R3.8708 c1ccc2sc(nc2c1)c3ccncc3 271570a_200000082171_100000035832 [0,0,0,0,0,1|2,0,1]=4 922 B17R3.8708 c1ccc2sc(nc2c1)c3ccncn3 271570a_200000082171_100000703185 [0,0,0,0,0,1|1,0,1]=3 923 B17R3.8708 c1ccc2sc(nc2c1)c3ccnnc3 271570a_200000082171_100000732662 [0,0,0,0,0,1|1,0,1]=3 924 B17R3.8708 c1ccc2sc(nc2c1)c3cnccn3 271570a_100011962566_100000751744 [0,0,0,0,0,1|2,0,0]=3 925 B17R3.8708 c1ccc2sc(nc2c1)c3cnccn3 271570a_200000082171_100000758340 [0,0,0,0,0,1|2,0,0]=3 926 B17R3.8708 c1ccc2sc(nc2c1)c3cncnc3 271570a_100000707473_100000751744 [0,0,0,0,0,1|2,0,1]=4 927 B17R3.8708 c1ccc2sc(nc2c1)c3cncnc3 271570a_200000082171_100011206942 [0,0,0,0,0,1|2,0,1]=4 928 B17R3.8708 c1ccc2sc(nc2c1)c3cnnnc3 271570a_200000082171_100009846058 [0,0,0,0,0,1|2,0,1]=4 929 B17R3.8708 c1ccn2cc(nc2c1)c3cnccn3 271570a_100011962566_100009819586 [0,0,0,0,0,1|3,0,0]=4 930 B17R3.8708 c1cnc(nc1)c2cc3ccccc3[nH]2 271570a_100010206980_100000211032 [0,0,0,0,0,1|2,0,0]=3 931 B17R3.8708 c1cnc(nc1)c2cc3ccccc3o2 271570a_100011328764_100000211032 [0,0,0,0,0,1|3,0,0]=4 932 B17R3.8708 c1cnc(nc1)c2cc3ccccc3s2 271570a_100000034353_100000211032 [0,0,0,0,0,1|3,0,0]=4 933 B17R3.8708 c1cnc(nc1)c2nc3ccccc3s2 271570a_200000082171_100000211032 [0,0,0,0,0,1|2,0,0]=3 934 B17R3.8708 c1cnc2[nH]c(cc2c1)c3cnccn3 271570a_100011962566_100010079843 [0,0,0,0,0,1|3,0,0]=4 935 B17R3.8708 c1cnc2sc(nc2c1)c3cnccn3 271570a_100011962566_100010188088 [0,0,0,0,0,1|3,0,0]=4 936 B17R3.8708 c1cncc(c1)c2cc3ccccc3[nH]2 271570a_100000757648_100010232065 [0,0,0,0,0,1|2,0,0]=3 937 B17R3.8708 c1cncc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_100000752921 [0,0,0,0,0,1|2,0,0]=3 938 B17R3.8708 c1cncc(c1)c2cc3ccccc3o2 271570a_100000757648_100010159458 [0,0,0,0,0,1|3,0,0]=4 939 B17R3.8708 c1cncc(c1)c2cc3ccccc3o2 271570a_100011328764_100000752921 [0,0,0,0,0,1|3,0,0]=4 940 B17R3.8708 c1cncc(c1)c2cc3ccccc3s2 271570a_100000034353_100000752921 [0,0,0,0,0,1|3,0,0]=4 941 B17R3.8708 c1cncc(c1)c2cc3ccccc3s2 271570a_100000757648_100009816949 [0,0,0,0,0,1|3,0,0]=4 942 B17R3.8708 c1cncc(c1)c2cc3cccnc3[nH]2 271570a_100000757648_100010079843 [0,0,0,0,0,1|3,0,0]=4 943 B17R3.8708 c1cncc(c1)c2cn3ccccc3n2 271570a_100000757648_100009819586 [0,0,0,0,0,1|3,0,0]=4 944 B17R3.8708 c1cncc(c1)c2nc3ccccc3[nH]2 271570a_100000757648_100009814255 [0,0,0,0,0,1|1,0,0]=2 945 B17R3.8708 c1cncc(c1)c2nc3ccccc3s2 271570a_100000757648_100000751744 [0,0,0,0,0,1|2,0,0]=3 946 B17R3.8708 c1cncc(c1)c2nc3ccccc3s2 271570a_200000082171_100000752921 [0,0,0,0,0,1|2,0,0]=3 947 B17R3.8708 c1cncc(c1)c2nc3cccnc3s2 271570a_100000757648_100010188088 [0,0,0,0,0,1|3,0,0]=4 948 B17R3.8708 c1cnnc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_100016991348 [0,0,0,0,0,1|1,0,1]=3 949 B17R3.8708 c1cnnc(c1)c2cc3ccccc3o2 271570a_100011328764_100016991348 [0,0,0,0,0,1|2,0,1]=4 950 B17R3.8708 c1cnnc(c1)c2cc3ccccc3s2 271570a_100000034353_100016991348 [0,0,0,0,0,1|2,0,1]=4 951 B17R3.8708 c1cnnc(c1)c2nc3ccccc3s2 271570a_200000082171_100016991348 [0,0,0,0,0,1|1,0,1]=3 952 B14R2.101 C(#Cc1cc[nH]n1)c2ccccc2 271570a_100000069678_100000062575 [1,0,1,0,0,0|1,0,1]=4 953 B14R2.101 C(=Cc1cc[nH]n1)c2ccccc2 271570a_100102527694_100000062575 [1,0,1,0,0,0|1,0,0]=3 954 B14R2.101 C(=Cc1cc[nH]n1)c2cccnc2 271570a_100102525586_100000062575 [1,0,1,0,0,0|2,0,0]=4 955 B14R2.101 C(=Cc1ccsn1)c2ccccc2 271570a_100102527694_100009818082 [1,0,1,0,0,0|2,0,0]=4 956 B14R2.101 C(=Cc1nc[nH]n1)c2ccccc2 271570a_100102527694_100000761765 [1,0,1,0,0,0|2,0,0]=4 957 B14R2.101 c1ccc(cc1)CSc2cc[nH]n2 62a_100000062575_100015291786 [1,0,1,0,0,0|2,0,0]=4 958 B14R2.101 c1ccc(cc1)CSc2cc[nH]n2 62a_100000211182_100000062575 [1,0,1,0,0,0|2,0,0]=4 959 B14R2.101 c1ccc(cc1)NCc2cc[nH]n2 207a_100000106764_100000738523 [1,0,1,0,0,0|0,0,1]=3 960 B14R2.101 c1ccc(cc1)NCc2ccon2 34a_100000106764_100000234950 [1,0,1,0,0,0|1,0,1]=4 961 B14R2.67 C=CCNc1nc2ccccc2[nH]1 27a_100020586998_100009814255 [1,0,1,0,0,0|1,0,1]=4 962 B14R2.67 C=CCSc1nc2ccccc2[nH]1 62a_100000210623_100009814255 [1,0,1,0,0,0|2,0,0]=4 963 B14R2.67 CC=NNc1nc2ccccc2[nH]1 4a_100000188875_200000210099 [1,0,1,0,0,0|1,0,1]=4 964 B16R2.2843 O=C1CC(=NN1)C(=O)Nc2ccccc2 22a_100000106764_200000752725 [0,1,1,0,0,0|1,0,1]=4 965 B16R2.2843 O=C1CC(=NN1)C(=O)Nc2ccccc2 527a_100000106764_200000752725 [0,1,1,0,0,0|1,0,1]=4 966 B16R2.1480 C=Cc1ccccc1NCc2cc[nH]n2 207a_100012022501_100000738523 [0,1,1,0,0,0|1,0,1]=4 967 B16R2.1480 CCc1ccccc1NCc2cc[nH]n2 207a_100000212081_100000738523 [0,1,1,0,0,0|1,0,1]=4 968 B16R2.1480 COc1ccccc1NCc2cc[nH]n2 207a_100000210025_100000738523 [0,1,1,0,0,0|1,0,1]=4 969 B16R2.1480 CSc1ccccc1NCc2cc[nH]n2 207a_100000211160_100000738523 [0,1,1,0,0,0|1,0,1]=4 970 B16R2.1480 OCc1ccccc1NCc2cc[nH]n2 207a_100000212039_100000738523 [0,1,1,0,0,0|1,0,1]=4 971 B16R2.2925 Cc1c(cccc1NCc2cc[nH]n2)Br 207a_100000750434_100000738523 [0,1,1,0,0,0|1,0,1]=4 972 B16R2.2925 Cc1c(cccc1NCc2cc[nH]n2)Cl 207a_100000210441_100000738523 [0,1,1,0,0,0|1,0,1]=4 973 B16R2.2925 Cc1c(cccc1NCc2cc[nH]n2)F 207a_100000745574_100000738523 [0,1,1,0,0,0|1,0,1]=4 974 B16R2.2925 Cc1c(cccc1NCc2cc[nH]n2)I 207a_100000761887_100000738523 [0,1,1,0,0,0|1,0,1]=4 975 B16R2.2925 Cc1cccc(c1C)NCc2cc[nH]n2 207a_100000210026_100000738523 [0,1,1,0,0,0|1,0,1]=4 976 B16R2.2925 Cc1cccc(c1Cl)NCc2cc[nH]n2 207a_100000765562_100000738523 [0,1,1,0,0,0|1,0,1]=4 977 B16R2.2925 Cc1cccc(c1F)NCc2cc[nH]n2 207a_100000697159_100000738523 [0,1,1,0,0,0|1,0,1]=4 978 B16R2.2925 Clc1c(cccc1NCc2cc[nH]n2)Br 207a_100000687075_100000738523 [0,1,1,0,0,0|1,0,1]=4 979 B16R2.2925 Fc1c(cccc1NCc2cc[nH]n2)Br 207a_100011935091_100000738523 [0,1,1,0,0,0|1,0,1]=4 980 B16R2.2925 Fc1c(cccc1NCc2cc[nH]n2)Cl 207a_100000199060_100000738523 [0,1,1,0,0,0|1,0,1]=4 981 B16R2.2966 Cc1c[nH]nc1C=Cc2ccccc2F 271570a_200102527919_100009871783 [0,1,1,0,0,0|2,0,0]=4 982 B16R2.2966 Cc1ccccc1NCc2n[nH]cc2Cl 207a_100015192222_100000040271 [0,1,1,0,0,0|1,0,1]=4 983 B16R2.2966 Clc1c[nH]nc1CNc2ccccc2Br 207a_100000210017_100000040271 [0,1,1,0,0,0|1,0,1]=4 984 B16R2.2966 Clc1c[nH]nc1CNc2ccccc2I 207a_100000210053_100000040271 [0,1,1,0,0,0|1,0,1]=4 985 B16R2.2966 Clc1ccccc1NCc2n[nH]cc2Cl 207a_100000185783_100000040271 [0,1,1,0,0,0|1,0,1]=4 986 B16R2.2966 Fc1ccccc1C=Cc2n[nH]cc2Br 271570a_200102527919_100015839836 [0,1,1,0,0,0|2,0,0]=4 987 B16R2.2966 Fc1ccccc1NCc2n[nH]cc2Cl 207a_100000210422_100000040271 [0,1,1,0,0,0|1,0,1]=4 988 B16R2.2966 Nc1c[nH]nc1C=Cc2ccccc2F 271570a_200102527919_100010894806 [0,1,1,0,0,0|2,0,0]=4 989 B16R2.3000 Cc1cc(ccc1NCc2cc[nH]n2)Br 207a_100000211769_100000738523 [0,1,1,0,0,0|1,0,1]=4 990 B16R2.3000 Cc1cc(ccc1NCc2cc[nH]n2)Cl 207a_100000210418_100000738523 [0,1,1,0,0,0|1,0,1]=4 991 B16R2.3000 Cc1cc(ccc1NCc2cc[nH]n2)F 207a_100000211637_100000738523 [0,1,1,0,0,0|1,0,1]=4 992 B16R2.3000 Cc1cc(ccc1NCc2cc[nH]n2)I 207a_100000184554_100000738523 [0,1,1,0,0,0|1,0,1]=4 993 B16R2.3000 Cc1ccc(c(c1)C)NCc2cc[nH]n2 207a_100000736561_100000738523 [0,1,1,0,0,0|1,0,1]=4 994 B16R2.3000 Cc1ccc(c(c1)F)NCc2cc[nH]n2 207a_100000211023_100000738523 [0,1,1,0,0,0|1,0,1]=4 995 B16R2.3000 Fc1cc(ccc1NCc2cc[nH]n2)Br 207a_100000210722_100000738523 [0,1,1,0,0,0|1,0,1]=4 996 B16R2.3000 Fc1cc(ccc1NCc2cc[nH]n2)Cl 207a_100000211020_100000738523 [0,1,1,0,0,0|1,0,1]=4 997 B16R2.3000 Fc1cc(ccc1NCc2cc[nH]n2)I 207a_100011215594_100000738523 [0,1,1,0,0,0|1,0,1]=4 998 B16R2.3000 Fc1ccc(c(c1)F)C=Cc2cc[nH]n2 271570a_100102527928_100000062575 [0,1,1,0,0,0|2,0,0]=4 999 B16R2.3000 Fc1ccc(c(c1)F)NCc2cc[nH]n2 207a_100000210720_100000738523 [0,1,1,0,0,0|1,0,1]=4 1000 B16R2.11414 Cc1cc(n[nH]1)C=Cc2ccccc2F 271570a_200102527919_100015199547 [0,1,1,0,0,0|2,0,0]=4 1001 B16R2.11414 Cc1ccccc1NCc2ccn(n2)C 207a_100015192222_100000750880 [0,1,1,0,0,0|1,0,1]=4 1002 B16R2.11414 Cc1ccccc1NCc2ccn(n2)C 270302a_100015192222_100000750880 [0,1,1,0,0,0|1,0,1]=4 1003 B16R2.11414 Cc1ccccc1NCc2ccn(n2)C 34a_100015192222_100000726502 [0,1,1,0,0,0|1,0,1]=4 1004 B16R2.11414 Cn1ccc(n1)C=Cc2ccccc2F 271570a_200102527919_100000752436 [0,1,1,0,0,0|2,0,0]=4 1005 B16R2.11414 Cn1ccc(n1)CNc2ccccc2Br 207a_100000210017_100000750880 [0,1,1,0,0,0|1,0,1]=4 1006 B16R2.11414 Cn1ccc(n1)CNc2ccccc2Br 34a_100000210017_100000726502 [0,1,1,0,0,0|1,0,1]=4 1007 B16R2.11414 Cn1ccc(n1)CNc2ccccc2Cl 207a_100000185783_100000750880 [0,1,1,0,0,0|1,0,1]=4 1008 B16R2.11414 Cn1ccc(n1)CNc2ccccc2Cl 34a_100000185783_100000726502 [0,1,1,0,0,0|1,0,1]=4 1009 B16R2.11414 Cn1ccc(n1)CNc2ccccc2F 207a_100000210422_100000750880 [0,1,1,0,0,0|1,0,1]=4 1010 B16R2.11414 Cn1ccc(n1)CNc2ccccc2F 34a_100000210422_100000726502 [0,1,1,0,0,0|1,0,1]=4 1011 B16R2.11414 Cn1ccc(n1)CNc2ccccc2I 207a_100000210053_100000750880 [0,1,1,0,0,0|1,0,1]=4 1012 B16R2.11414 Cn1ccc(n1)CNc2ccccc2I 34a_100000210053_100000726502 [0,1,1,0,0,0|1,0,1]=4 1013 B16R2.11414 Cn1ccc(n1)CNc2ccccc2O 34a_100000185747_100000726502 [0,1,1,0,0,0|1,0,1]=4 1014 B16R2.11414 Cn1ccc(n1)COc2ccccc2N 34a_100000185747_100000726502 [0,1,1,0,0,0|1,0,1]=4 1015 B16R2.11414 Cn1ccc(n1)COc2ccccc2N 7a_100000185747_100000726502 [0,1,1,0,0,0|1,0,1]=4 1016 B16R2.11414 Cn1ccc(n1)CSc2ccccc2N 62a_100000210017_100000726502 [0,1,1,0,0,0|1,0,1]=4 1017 B16R2.11414 Cn1ccc(n1)CSc2ccccc2N 62a_100000726502_100000210017 [0,1,1,0,0,0|1,0,1]=4 1018 B16R2.11414 Nc1cc(n[nH]1)C=Cc2ccccc2F 271570a_200102527919_100009822546 [0,1,1,0,0,0|2,0,0]=4 1019 B16R2.12623 Cc1ccc(c(c1)NCc2cc[nH]n2)C 207a_100000185781_100000738523 [0,1,1,0,0,0|1,0,1]=4 1020 B16R2.12623 Cc1ccc(c(c1)NCc2cc[nH]n2)Cl 207a_100011215360_100000738523 [0,1,1,0,0,0|1,0,1]=4 1021 B16R2.12623 Cc1ccc(c(c1)NCc2cc[nH]n2)F 207a_100000211285_100000738523 [0,1,1,0,0,0|1,0,1]=4 1022 B16R2.12623 Cc1ccc(cc1NCc2cc[nH]n2)Br 207a_100000741167_100000738523 [0,1,1,0,0,0|1,0,1]=4 1023 B16R2.12623 Cc1ccc(cc1NCc2cc[nH]n2)Cl 207a_100000211374_100000738523 [0,1,1,0,0,0|1,0,1]=4 1024 B16R2.12623 Cc1ccc(cc1NCc2cc[nH]n2)F 207a_100000211107_100000738523 [0,1,1,0,0,0|1,0,1]=4 1025 B16R2.12623 Cc1ccc(cc1NCc2cc[nH]n2)I 207a_100000761890_100000738523 [0,1,1,0,0,0|1,0,1]=4 1026 B16R2.12623 Fc1ccc(c(c1)NCc2cc[nH]n2)F 207a_100000210742_100000738523 [0,1,1,0,0,0|1,0,1]=4 1027 B16R2.12623 Fc1ccc(cc1NCc2cc[nH]n2)Br 207a_100000740924_100000738523 [0,1,1,0,0,0|1,0,1]=4 1028 B16R2.12623 Fc1ccc(cc1NCc2cc[nH]n2)Cl 207a_100000212115_100000738523 [0,1,1,0,0,0|1,0,1]=4 1029 B16R2.12623 Fc1ccc(cc1NCc2cc[nH]n2)I 207a_100011464823_100000738523 [0,1,1,0,0,0|1,0,1]=4 1030 B16R2.25778 Cc1cccc(c1NCc2cc[nH]n2)C 207a_100000185769_100000738523 [0,1,1,0,0,0|1,0,1]=4 1031 B16R2.25778 Cc1cccc(c1NCc2cc[nH]n2)F 207a_100000766463_100000738523 [0,1,1,0,0,0|1,0,1]=4 1032 B16R2.25778 Fc1cccc(c1NCc2cc[nH]n2)F 207a_100000210704_100000738523 [0,1,1,0,0,0|1,0,1]=4 1033 B16R2.2128 CCNN=C(C)c1nc2ccccc2[nH]1 4a_100000756455_100000199114 [0,1,1,0,0,0|0,0,2]=4 1034 B16R2.492 C=C(C)C=NNc1nc2ccccc2[nH]1 4a_100000188875_100000210575 [0,1,1,0,0,0|2,0,0]=4 1035 B16R2.492 CC(=O)NN=Cc1cc2ccccc2[nH]1 4a_100000189765_100000051030 [0,1,1,0,0,0|1,0,1]=4 1036 B16R2.492 CC(=O)NN=Cc1nc2ccccc2[nH]1 4a_100000189765_100000185668 [0,1,1,0,0,0|0,0,1]=3 1037 B16R2.492 CC(=O)NN=Cc1nc2ccccc2s1 4a_100000189765_100011204187 [0,1,1,0,0,0|1,0,1]=4 1038 B16R2.492 CC(C)NN=Cc1nc2ccccc2[nH]1 4a_100000741168_100000185668 [0,1,1,0,0,0|0,0,2]=4 1039 B16R2.1181 C=CC(=NNc1nc2ccccc2[nH]1)C 4a_100000188875_200015361842 [0,1,1,0,0,0|2,0,0]=4 1040 B16R2.1181 CNC(=O)C=Cc1nc2ccccc2o1 11a_106832991635_100000697878 [0,1,1,0,0,0|2,0,0]=4 1041 B16R2.1181 CNC(=O)C=Cc1nc2ccccc2o1 240690a_100102657272_100000697878 [0,1,1,0,0,0|2,0,0]=4 1042 B16R2.1181 CNC(=O)C=Cc1nc2ccccc2s1 11a_106832991635_100000682698 [0,1,1,0,0,0|2,0,0]=4 1043 B16R2.1181 CNC(=O)C=Cc1nc2ccccc2s1 1626a_100102657272_100000682698 [0,1,1,0,0,0|2,0,0]=4 1044 B16R2.1181 CNC(=O)C=Cc1nc2ccccc2s1 240690a_100102657272_100000682698 [0,1,1,0,0,0|2,0,0]=4 1045 B16R2.2272 CCNN=Cc1nc2ccccc2n1C 4a_100000756455_100000188960 [0,1,1,0,0,0|0,0,2]=4 1046 B16R2.2435 CCNN=Cc1nc2cc(ccc2[nH]1)F 4a_100000756455_200011915233 [0,1,1,0,0,0|0,0,2]=4 1047 B16R2.2435 CCNN=Cc1nc2ccc(cc2[nH]1)Br 4a_100000756455_200011361486 [0,1,1,0,0,0|0,0,2]=4 1048 B16R2.2875 CCCNN=Cc1nc2ccccc2[nH]1 4a_100000740057_100000185668 [0,1,1,0,0,0|0,0,2]=4 1049 B16R2.2875 OCCNN=Cc1nc2ccccc2[nH]1 4a_100000210001_100000185668 [0,1,1,0,0,0|0,0,2]=4 1050 B18R3.2942 Cc1cc(n[nH]1)c2cc3ccccc3cn2 271570a_100009872134_100000047361 [0,1,0,0,0,1|1,0,0]=3 1051 B18R3.2942 Cc1cc(n[nH]1)c2ccc3ccccc3c2 271570a_100009872134_100000233703 [0,1,0,0,0,1|2,0,0]=4 1052 B18R3.2942 Cc1cc(n[nH]1)c2ccc3ccccc3c2 271570a_100011218693_100015199547 [0,1,0,0,0,1|2,0,0]=4 1053 B18R3.2942 Cc1cc(n[nH]1)c2ccc3ccccc3n2 271570a_100009872134_100011291633 [0,1,0,0,0,1|1,0,0]=3 1054 B18R3.2942 Cc1cc(n[nH]1)c2ccc3cccnc3n2 271570a_100009872134_100009888989 [0,1,0,0,0,1|2,0,0]=4 1055 B18R3.2942 Cc1cc(n[nH]1)c2ccc3ccncc3n2 271570a_100009872134_100000020162 [0,1,0,0,0,1|2,0,0]=4 1056 B18R3.2942 Cc1cc(n[nH]1)c2ccc3ncccc3n2 271570a_100009872134_100000073381 [0,1,0,0,0,1|2,0,0]=4 1057 B18R3.2942 Cc1cc(n[nH]1)c2cnc3ccccc3c2 271570a_100009872134_100000737414 [0,1,0,0,0,1|1,0,0]=3 1058 B18R3.2942 Cc1cc(n[nH]1)c2cnc3ccccc3c2 271570a_100012350238_100015199547 [0,1,0,0,0,1|1,0,0]=3 1059 B18R3.2942 Cc1cc(n[nH]1)c2cnc3ccccc3n2 271570a_100009872134_100000756483 [0,1,0,0,0,1|0,0,1]=3 1060 B18R3.2942 Cc1cc(n[nH]1)c2cnc3cccnc3c2 271570a_100009872134_100010246316 [0,1,0,0,0,1|2,0,0]=4 1061 B18R3.2942 Cc1cc(n[nH]1)c2cnc3ncccc3n2 271570a_100009872134_100000084304 [0,1,0,0,0,1|1,0,1]=4 1062 B18R3.2942 Cc1cc(n[nH]1)c2ncc3ccccc3n2 271570a_100009872134_100000097389 [0,1,0,0,0,1|0,0,1]=3 1063 B18R3.2942 Cc1nc(n[nH]1)c2cnc3ccccc3c2 271570a_100012350238_100000732540 [0,1,0,0,0,1|2,0,0]=4 1064 B18R3.2942 Cn1ccc(c1)c2cc3ccccc3cn2 271570a_100010172022_100000047361 [0,1,0,0,0,1|2,0,0]=4 1065 B18R3.2942 Cn1ccc(c1)c2ccc3ccccc3n2 271570a_100010172022_100011291633 [0,1,0,0,0,1|2,0,0]=4 1066 B18R3.2942 Cn1ccc(c1)c2cnc3ccccc3c2 271570a_100010172022_100000737414 [0,1,0,0,0,1|2,0,0]=4 1067 B18R3.2942 Cn1ccc(c1)c2cnc3ccccc3n2 271570a_100010172022_100000756483 [0,1,0,0,0,1|1,0,1]=4 1068 B18R3.2942 Cn1ccc(c1)c2ncc3ccccc3n2 271570a_100010172022_100000097389 [0,1,0,0,0,1|1,0,1]=4 1069 B18R3.2942 Cn1ccc(n1)c2cc3ccccc3cn2 271570a_100012348833_100000047361 [0,1,0,0,0,1|1,0,0]=3 1070 B18R3.2942 Cn1ccc(n1)c2ccc3ccccc3c2 271570a_100011218693_100000752436 [0,1,0,0,0,1|2,0,0]=4 1071 B18R3.2942 Cn1ccc(n1)c2ccc3ccccc3c2 271570a_100012348833_100000233703 [0,1,0,0,0,1|2,0,0]=4 1072 B18R3.2942 Cn1ccc(n1)c2ccc3ccccc3n2 271570a_100012348833_100011291633 [0,1,0,0,0,1|1,0,0]=3 1073 B18R3.2942 Cn1ccc(n1)c2ccc3cccnc3n2 271570a_100012348833_100009888989 [0,1,0,0,0,1|2,0,0]=4 1074 B18R3.2942 Cn1ccc(n1)c2ccc3ccncc3n2 271570a_100012348833_100000020162 [0,1,0,0,0,1|2,0,0]=4 1075 B18R3.2942 Cn1ccc(n1)c2ccc3ncccc3n2 271570a_100012348833_100000073381 [0,1,0,0,0,1|2,0,0]=4 1076 B18R3.2942 Cn1ccc(n1)c2cnc3ccccc3c2 271570a_100012348833_100000737414 [0,1,0,0,0,1|1,0,0]=3 1077 B18R3.2942 Cn1ccc(n1)c2cnc3ccccc3c2 271570a_100012350238_100000752436 [0,1,0,0,0,1|1,0,0]=3 1078 B18R3.2942 Cn1ccc(n1)c2cnc3ccccc3n2 271570a_100012348833_100000756483 [0,1,0,0,0,1|0,0,1]=3 1079 B18R3.2942 Cn1ccc(n1)c2cnc3cccnc3c2 271570a_100012348833_100010246316 [0,1,0,0,0,1|2,0,0]=4 1080 B18R3.2942 Cn1ccc(n1)c2cnc3ncccc3n2 271570a_100012348833_100000084304 [0,1,0,0,0,1|1,0,1]=4 1081 B18R3.2942 Cn1ccc(n1)c2ncc3ccccc3n2 271570a_100012348833_100000097389 [0,1,0,0,0,1|0,0,1]=3 1082 B18R3.2942 Cn1cnc(n1)c2cnc3ccccc3c2 271570a_100012350238_100009819955 [0,1,0,0,0,1|2,0,0]=4 1083 B18R3.2942 Cn1ncc(n1)c2cnc3ccccc3c2 271570a_100012350238_100000733932 [0,1,0,0,0,1|2,0,0]=4 1084 B18R3.2942 Nc1cc(n[nH]1)c2ccc3ccccc3c2 271570a_100011218693_100009822546 [0,1,0,0,0,1|2,0,0]=4 1085 B18R3.2942 Nc1cc(n[nH]1)c2cnc3ccccc3c2 271570a_100012350238_100009822546 [0,1,0,0,0,1|1,0,0]=3 1086 B18R3.2942 Nc1nc(n[nH]1)c2cnc3ccccc3c2 271570a_100012350238_100015184587 [0,1,0,0,0,1|2,0,0]=4 1087 B18R3.3053 Brc1ccc2ncc(cc2c1)c3cc[nH]c3 271570a_100000102155_100010740133 [0,1,0,0,0,1|2,0,0]=4 1088 B18R3.3053 Brc1ccc2ncc(cc2c1)c3cc[nH]n3 271570a_100000062414_100010740133 [0,1,0,0,0,1|1,0,0]=3 1089 B18R3.3053 Cc1ccc2ncc(cc2c1)c3cc[nH]c3 271570a_100000102155_100015841224 [0,1,0,0,0,1|2,0,0]=4 1090 B18R3.3053 Cc1ccc2ncc(cc2c1)c3cc[nH]n3 271570a_100000062414_100015841224 [0,1,0,0,0,1|1,0,0]=3 1091 B18R3.3053 Cc1ccc2ncc(cc2c1)c3cc[nH]n3 271570a_200010887317_100000062575 [0,1,0,0,0,1|1,0,0]=3 1092 B18R3.3053 Cc1ccc2ncc(cc2c1)c3ccsn3 271570a_200010887317_100009818082 [0,1,0,0,0,1|2,0,0]=4 1093 B18R3.3053 Cc1ccc2ncc(cc2c1)c3nc[nH]n3 271570a_200010887317_100000761765 [0,1,0,0,0,1|2,0,0]=4 1094 B18R3.3053 Clc1ccc2ncc(cc2c1)c3cc[nH]c3 271570a_100000102155_100015929906 [0,1,0,0,0,1|2,0,0]=4 1095 B18R3.3053 Clc1ccc2ncc(cc2c1)c3cc[nH]n3 271570a_100000062414_100015929906 [0,1,0,0,0,1|1,0,0]=3 1096 B18R3.3053 Fc1ccc2cnc(cc2c1)c3cc[nH]c3 271570a_100000102155_100009828686 [0,1,0,0,0,1|2,0,0]=4 1097 B18R3.3053 Fc1ccc2cnc(cc2c1)c3cc[nH]n3 271570a_100000062414_100009828686 [0,1,0,0,0,1|1,0,0]=3 1098 B18R3.3053 Fc1ccc2cnc(nc2c1)c3cc[nH]c3 271570a_100000102155_100000104070 [0,1,0,0,0,1|1,0,1]=4 1099 B18R3.3053 Fc1ccc2cnc(nc2c1)c3cc[nH]n3 271570a_100000062414_100000104070 [0,1,0,0,0,1|0,0,1]=3 1100 B18R3.3053 Fc1cnc2ccc(nc2c1)c3cc[nH]n3 271570a_100000062414_100009889179 [0,1,0,0,0,1|2,0,0]=4 1101 B18R3.3053 Nc1ccc2ccc(cc2c1)c3cc[nH]n3 271570a_100000062414_100010090036 [0,1,0,0,0,1|2,0,0]=4 1102 B18R3.3053 Nc1ccc2ccc(nc2n1)c3cc[nH]n3 271570a_100000062414_100000117679 [0,1,0,0,0,1|2,0,0]=4 1103 B18R3.3053 Nc1ccc2ncc(cc2c1)c3cc[nH]c3 271570a_100000102155_100009888932 [0,1,0,0,0,1|2,0,0]=4 1104 B18R3.3053 Nc1ccc2ncc(cc2c1)c3cc[nH]n3 271570a_100000062414_100009888932 [0,1,0,0,0,1|1,0,0]=3 1105 B18R3.3053 O=c1ccc2cnc(cc2[nH]1)c3cc[nH]n3 271570a_100000062414_100010563892 [0,1,0,0,0,1|2,0,0]=4 1106 B18R3.3053 Oc1ccc2ccc(cc2c1)c3cc[nH]n3 271570a_100000062414_100009816537 [0,1,0,0,0,1|2,0,0]=4 1107 B18R3.3053 Oc1ccc2ccc(nc2c1)c3cc[nH]c3 271570a_100000102155_100000079174 [0,1,0,0,0,1|2,0,0]=4 1108 B18R3.3053 Oc1ccc2ccc(nc2c1)c3cc[nH]n3 271570a_100000062414_100000079174 [0,1,0,0,0,1|1,0,0]=3 1109 B18R3.3053 Oc1ccc2ccc(nc2n1)c3cc[nH]n3 271570a_100000062414_200010218124 [0,1,0,0,0,1|2,0,0]=4 1110 B18R3.3053 Oc1ccc2ncc(cc2c1)c3cc[nH]c3 271570a_100000102155_100010137430 [0,1,0,0,0,1|2,0,0]=4 1111 B18R3.3053 Oc1ccc2ncc(cc2c1)c3cc[nH]n3 271570a_100000062414_100010137430 [0,1,0,0,0,1|1,0,0]=3 1112 B18R3.3053 Oc1ccc2ncc(cc2n1)c3cc[nH]n3 271570a_100000062414_100010009477 [0,1,0,0,0,1|2,0,0]=4 1113 B18R3.3053 Oc1ccc2ncc(nc2c1)c3cc[nH]c3 271570a_100000102155_200020640061 [0,1,0,0,0,1|1,0,1]=4 1114 B18R3.3053 Oc1ccc2ncc(nc2c1)c3cc[nH]n3 271570a_100000062414_200020640061 [0,1,0,0,0,1|0,0,1]=3 1115 B18R3.3824 Brc1c[nH]nc1c2ccc3ccccc3c2 271570a_100011218693_100015839836 [0,1,0,0,0,1|2,0,0]=4 1116 B18R3.3824 Brc1c[nH]nc1c2cnc3ccccc3c2 271570a_100012350238_100015839836 [0,1,0,0,0,1|1,0,0]=3 1117 B18R3.3824 Cc1c[nH]nc1c2cc3ccccc3cn2 271570a_100102527747_100000047361 [0,1,0,0,0,1|1,0,0]=3 1118 B18R3.3824 Cc1c[nH]nc1c2ccc3ccccc3c2 271570a_100011218693_100009871783 [0,1,0,0,0,1|2,0,0]=4 1119 B18R3.3824 Cc1c[nH]nc1c2ccc3ccccc3c2 271570a_100102527747_100000233703 [0,1,0,0,0,1|2,0,0]=4 1120 B18R3.3824 Cc1c[nH]nc1c2ccc3ccccc3n2 271570a_100102527747_100011291633 [0,1,0,0,0,1|1,0,0]=3 1121 B18R3.3824 Cc1c[nH]nc1c2ccc3cccnc3n2 271570a_100102527747_100009888989 [0,1,0,0,0,1|2,0,0]=4 1122 B18R3.3824 Cc1c[nH]nc1c2ccc3ccncc3n2 271570a_100102527747_100000020162 [0,1,0,0,0,1|2,0,0]=4 1123 B18R3.3824 Cc1c[nH]nc1c2ccc3ncccc3n2 271570a_100102527747_100000073381 [0,1,0,0,0,1|2,0,0]=4 1124 B18R3.3824 Cc1c[nH]nc1c2cnc3ccccc3c2 271570a_100012350238_100009871783 [0,1,0,0,0,1|1,0,0]=3 1125 B18R3.3824 Cc1c[nH]nc1c2cnc3ccccc3c2 271570a_100102527747_100000737414 [0,1,0,0,0,1|1,0,0]=3 1126 B18R3.3824 Cc1c[nH]nc1c2cnc3ccccc3n2 271570a_100102527747_100000756483 [0,1,0,0,0,1|0,0,1]=3 1127 B18R3.3824 Cc1c[nH]nc1c2cnc3cccnc3c2 271570a_100102527747_100010246316 [0,1,0,0,0,1|2,0,0]=4 1128 B18R3.3824 Cc1c[nH]nc1c2cnc3ncccc3n2 271570a_100102527747_100000084304 [0,1,0,0,0,1|1,0,1]=4 1129 B18R3.3824 Cc1c[nH]nc1c2ncc3ccccc3n2 271570a_100102527747_100000097389 [0,1,0,0,0,1|0,0,1]=3 1130 B18R3.3824 Nc1c[nH]nc1c2ccc3ccccc3c2 271570a_100011218693_100010894806 [0,1,0,0,0,1|2,0,0]=4 1131 B18R3.3824 Nc1c[nH]nc1c2cnc3ccccc3c2 271570a_100012350238_100010894806 [0,1,0,0,0,1|1,0,0]=3 1132 B18R3.4383 Brc1c(ccc2c1cccc2)c3cc[nH]n3 271570a_100000062414_200010089984 [0,1,0,0,0,1|2,0,0]=4 1133 B18R3.4383 Cc1c(ccc2c1cccc2)c3cc[nH]n3 271570a_100000062414_100010221197 [0,1,0,0,0,1|2,0,0]=4 1134 B18R3.4383 Cc1c(ccc2c1cccc2)c3cc[nH]n3 271570a_100011161507_100000062575 [0,1,0,0,0,1|2,0,0]=4 1135 B18R3.4383 Clc1c(cnc2c1cccc2)c3cc[nH]c3 271570a_100000102155_100012352519 [0,1,0,0,0,1|2,0,0]=4 1136 B18R3.4383 Clc1c(cnc2c1cccc2)c3cc[nH]n3 271570a_100000062414_100012352519 [0,1,0,0,0,1|1,0,0]=3 1137 B18R3.4383 Fc1c(ccc2c1cccc2)c3cc[nH]n3 271570a_100000062414_100009832041 [0,1,0,0,0,1|2,0,0]=4 1138 B18R3.4383 Nc1c(ccc2c1cccc2)c3cc[nH]n3 271570a_100000062414_100009817101 [0,1,0,0,0,1|2,0,0]=4 1139 B18R3.4383 Nc1c(cnc2c1cccc2)c3cc[nH]c3 271570a_100000102155_100009995562 [0,1,0,0,0,1|2,0,0]=4 1140 B18R3.4383 Nc1c(cnc2c1cccc2)c3cc[nH]n3 271570a_100000062414_100009995562 [0,1,0,0,0,1|1,0,0]=3 1141 B18R3.4383 Nc1c(ncc2c1cccc2)c3cc[nH]c3 271570a_100000102155_100000087573 [0,1,0,0,0,1|2,0,0]=4 1142 B18R3.4383 Nc1c(ncc2c1cccc2)c3cc[nH]n3 271570a_100000062414_100000087573 [0,1,0,0,0,1|1,0,0]=3 1143 B18R3.4383 O=c1c(c[nH]c2c1cccc2)c3cc[nH]c3 271570a_100000102155_100012339567 [0,1,0,0,0,1|2,0,0]=4 1144 B18R3.4383 O=c1c(c[nH]c2c1cccc2)c3cc[nH]n3 271570a_100000062414_100012339567 [0,1,0,0,0,1|1,0,0]=3 1145 B18R3.4383 O=c1c(coc2c1cccc2)c3cc[nH]n3 271570a_100000062414_100009813851 [0,1,0,0,0,1|2,0,0]=4 1146 B18R3.4383 Oc1c(ccc2c1cccc2)c3cc[nH]n3 271570a_100000062414_100009996032 [0,1,0,0,0,1|2,0,0]=4 1147 B18R3.4383 Oc1c(nnc2c1cccc2)c3cc[nH]c3 271570a_100000102155_100000688347 [0,1,0,0,0,1|2,0,0]=4 1148 B18R3.4383 Oc1c(nnc2c1cccc2)c3cc[nH]n3 271570a_100000062414_100000688347 [0,1,0,0,0,1|1,0,0]=3 1149 B18R3.5872 Brc1cccc2c1ncc(c2)c3cc[nH]c3 271570a_100000102155_100010204298 [0,1,0,0,0,1|2,0,0]=4 1150 B18R3.5872 Brc1cccc2c1ncc(c2)c3cc[nH]n3 271570a_100000062414_100010204298 [0,1,0,0,0,1|1,0,0]=3 1151 B18R3.5872 Cc1cccc2c1ncc(c2)c3cc[nH]c3 271570a_100000102155_100009829671 [0,1,0,0,0,1|2,0,0]=4 1152 B18R3.5872 Cc1cccc2c1ncc(c2)c3cc[nH]n3 271570a_100000062414_100009829671 [0,1,0,0,0,1|1,0,0]=3 1153 B18R3.5872 Cc1cccc2c1ncc(c2)c3cc[nH]n3 271570a_100000707987_100000062575 [0,1,0,0,0,1|1,0,0]=3 1154 B18R3.5872 Cc1cccc2c1ncc(c2)c3ccsn3 271570a_100000707987_100009818082 [0,1,0,0,0,1|2,0,0]=4 1155 B18R3.5872 Cc1cccc2c1ncc(c2)c3nc[nH]n3 271570a_100000707987_100000761765 [0,1,0,0,0,1|2,0,0]=4 1156 B18R3.5872 Clc1cccc2c1ncc(c2)c3cc[nH]c3 271570a_100000102155_100000759377 [0,1,0,0,0,1|2,0,0]=4 1157 B18R3.5872 Clc1cccc2c1ncc(c2)c3cc[nH]n3 271570a_100000062414_100000759377 [0,1,0,0,0,1|1,0,0]=3 1158 B18R3.5872 Fc1cccc2c1ncc(c2)c3cc[nH]c3 271570a_100000102155_100000049890 [0,1,0,0,0,1|2,0,0]=4 1159 B18R3.5872 Fc1cccc2c1ncc(c2)c3cc[nH]n3 271570a_100000062414_100000049890 [0,1,0,0,0,1|1,0,0]=3 1160 B18R3.5872 Fc1cccc2c1ncc(c2)c3cc[nH]n3 271570a_100000707988_100000062575 [0,1,0,0,0,1|1,0,0]=3 1161 B18R3.5872 Fc1cccc2c1ncc(c2)c3ccsn3 271570a_100000707988_100009818082 [0,1,0,0,0,1|2,0,0]=4 1162 B18R3.5872 Fc1cccc2c1ncc(c2)c3nc[nH]n3 271570a_100000707988_100000761765 [0,1,0,0,0,1|2,0,0]=4 1163 B18R3.5872 Nc1cccc2c1ccc(c2)c3cc[nH]n3 271570a_100000062414_100010090037 [0,1,0,0,0,1|2,0,0]=4 1164 B18R3.5872 Nc1cccc2c1ncc(c2)c3cc[nH]c3 271570a_100000102155_100000702407 [0,1,0,0,0,1|2,0,0]=4 1165 B18R3.5872 Nc1cccc2c1ncc(c2)c3cc[nH]n3 271570a_100000062414_100000702407 [0,1,0,0,0,1|1,0,0]=3 1166 B18R3.5872 Oc1cccc2c1ccc(c2)c3cc[nH]n3 271570a_100000062414_100010202202 [0,1,0,0,0,1|2,0,0]=4 1167 B18R3.5872 Oc1nccc2c1cnc(c2)c3cc[nH]n3 271570a_100000062414_100020669822 [0,1,0,0,0,1|2,0,0]=4 1168 B18R3.5872 Oc1nccc2c1ncc(c2)c3cc[nH]n3 271570a_100000062414_100010117065 [0,1,0,0,0,1|2,0,0]=4 1169 B18R3.6367 Brc1cc2ccccc2cc1c3cc[nH]n3 271570a_100000062414_200010169544 [0,1,0,0,0,1|2,0,0]=4 1170 B18R3.6367 Brc1cc2ccccc2nc1c3cc[nH]c3 271570a_100000102155_100010072790 [0,1,0,0,0,1|2,0,0]=4 1171 B18R3.6367 Brc1cc2ccccc2nc1c3cc[nH]n3 271570a_100000062414_100010072790 [0,1,0,0,0,1|1,0,0]=3 1172 B18R3.6367 Cc1cc2ccccc2nc1c3cc[nH]c3 271570a_100000102155_100000751756 [0,1,0,0,0,1|2,0,0]=4 1173 B18R3.6367 Cc1cc2ccccc2nc1c3cc[nH]n3 271570a_100000062414_100000751756 [0,1,0,0,0,1|1,0,0]=3 1174 B18R3.6367 Cc1cc2cccnc2nc1c3cc[nH]n3 271570a_100000062414_100009877248 [0,1,0,0,0,1|2,0,0]=4 1175 B18R3.6367 Cc1nc2ccccc2nc1c3cc[nH]c3 271570a_100000102155_100000185947 [0,1,0,0,0,1|1,0,1]=4 1176 B18R3.6367 Cc1nc2ccccc2nc1c3cc[nH]n3 271570a_100000062414_100000185947 [0,1,0,0,0,1|0,0,1]=3 1177 B18R3.6367 Clc1cc2ccccc2cc1c3cc[nH]n3 271570a_100000062414_100010152806 [0,1,0,0,0,1|2,0,0]=4 1178 B18R3.6367 Clc1nc2ccccc2cc1c3cc[nH]c3 271570a_100000102155_100010220712 [0,1,0,0,0,1|2,0,0]=4 1179 B18R3.6367 Clc1nc2ccccc2cc1c3cc[nH]n3 271570a_100000062414_100010220712 [0,1,0,0,0,1|1,0,0]=3 1180 B18R3.6367 Clc1nc2ccccc2cc1c3cc[nH]n3 271570a_200000043004_100000062575 [0,1,0,0,0,1|1,0,0]=3 1181 B18R3.6367 Clc1nc2ccccc2cc1c3ccsn3 271570a_200000043004_100009818082 [0,1,0,0,0,1|2,0,0]=4 1182 B18R3.6367 Clc1nc2ccccc2cc1c3nc[nH]n3 271570a_200000043004_100000761765 [0,1,0,0,0,1|2,0,0]=4 1183 B18R3.6367 Fc1nc2ccccc2cc1c3cc[nH]c3 271570a_100000102155_100011158909 [0,1,0,0,0,1|2,0,0]=4 1184 B18R3.6367 Fc1nc2ccccc2cc1c3cc[nH]n3 271570a_100000062414_100011158909 [0,1,0,0,0,1|1,0,0]=3 1185 B18R3.6367 Fc1nc2ccccc2cc1c3cc[nH]n3 271570a_200000042388_100000062575 [0,1,0,0,0,1|1,0,0]=3 1186 B18R3.6367 Fc1nc2ccccc2cc1c3ccsn3 271570a_200000042388_100009818082 [0,1,0,0,0,1|2,0,0]=4 1187 B18R3.6367 Fc1nc2ccccc2cc1c3nc[nH]n3 271570a_200000042388_100000761765 [0,1,0,0,0,1|2,0,0]=4 1188 B18R3.6367 Nc1cc2ccccc2cc1c3cc[nH]n3 271570a_100000062414_100009991566 [0,1,0,0,0,1|2,0,0]=4 1189 B18R3.6367 Nc1nc2ccccc2cc1c3cc[nH]c3 271570a_100000102155_100010135404 [0,1,0,0,0,1|2,0,0]=4 1190 B18R3.6367 Nc1nc2ccccc2cc1c3cc[nH]n3 271570a_100000062414_100010135404 [0,1,0,0,0,1|1,0,0]=3 1191 B18R3.6367 Nc1nc2ccccc2nc1c3cc[nH]c3 271570a_100000102155_100000009970 [0,1,0,0,0,1|1,0,1]=4 1192 B18R3.6367 Nc1nc2ccccc2nc1c3cc[nH]n3 271570a_100000062414_100000009970 [0,1,0,0,0,1|0,0,1]=3 1193 B18R3.6367 O=c1oc2ccccc2cc1c3cc[nH]n3 271570a_100000062414_200000187772 [0,1,0,0,0,1|2,0,0]=4 1194 B18R3.6367 Oc1cc2ccccc2cc1c3cc[nH]n3 271570a_100000062414_100009817189 [0,1,0,0,0,1|2,0,0]=4 1195 B18R3.6367 Oc1cc2ccccc2cc1c3cc[nH]n3 271570a_100009888625_100000062575 [0,1,0,0,0,1|2,0,0]=4 1196 B18R3.6367 Oc1cc2ccccc2nc1c3cc[nH]c3 271570a_100000102155_200000100762 [0,1,0,0,0,1|2,0,0]=4 1197 B18R3.6367 Oc1cc2ccccc2nc1c3cc[nH]n3 271570a_100000062414_200000100762 [0,1,0,0,0,1|1,0,0]=3 1198 B18R3.6367 Oc1nc2ccccc2cc1c3cc[nH]c3 271570a_100000102155_200009820883 [0,1,0,0,0,1|2,0,0]=4 1199 B18R3.6367 Oc1nc2ccccc2cc1c3cc[nH]n3 271570a_100000062414_200009820883 [0,1,0,0,0,1|1,0,0]=3 1200 B18R3.6548 Cc1cc(nc2c1cccc2)c3cc[nH]c3 271570a_100000102155_100012354972 [0,1,0,0,0,1|2,0,0]=4 1201 B18R3.6548 Cc1cc(nc2c1cccc2)c3cc[nH]n3 271570a_100000062414_100012354972 [0,1,0,0,0,1|1,0,0]=3 1202 B18R3.6548 Cc1nc(nc2c1cccc2)c3cc[nH]c3 271570a_100000102155_100000046098 [0,1,0,0,0,1|1,0,1]=4 1203 B18R3.6548 Cc1nc(nc2c1cccc2)c3cc[nH]n3 271570a_100000062414_100000046098 [0,1,0,0,0,1|0,0,1]=3 1204 B18R3.6548 Nc1cc(cc2c1cccc2)c3cc[nH]n3 271570a_100000062414_100010171453 [0,1,0,0,0,1|2,0,0]=4 1205 B18R3.6548 Nc1cc(nc2c1cccc2)c3cc[nH]c3 271570a_100000102155_100010197925 [0,1,0,0,0,1|2,0,0]=4 1206 B18R3.6548 Nc1cc(nc2c1cccc2)c3cc[nH]n3 271570a_100000062414_100010197925 [0,1,0,0,0,1|1,0,0]=3 1207 B18R3.6548 Nc1nc(cc2c1cccc2)c3cc[nH]c3 271570a_100000102155_100009957331 [0,1,0,0,0,1|2,0,0]=4 1208 B18R3.6548 Nc1nc(cc2c1cccc2)c3cc[nH]n3 271570a_100000062414_100009957331 [0,1,0,0,0,1|1,0,0]=3 1209 B18R3.6548 O=c1cc([nH]c2c1cccc2)c3cc[nH]c3 271570a_100000102155_100000090176 [0,1,0,0,0,1|2,0,0]=4 1210 B18R3.6548 O=c1cc([nH]c2c1cccc2)c3cc[nH]n3 271570a_100000062414_100000090176 [0,1,0,0,0,1|1,0,0]=3 1211 B18R3.6548 O=c1cc(nc2n1cccc2)c3cc[nH]n3 271570a_100000062414_100000707704 [0,1,0,0,0,1|2,0,0]=4 1212 B18R3.6548 Oc1cc(cc2c1cccc2)c3cc[nH]n3 271570a_100000062414_100010089979 [0,1,0,0,0,1|2,0,0]=4 1213 B18R3.6548 [O-][n+]1cc(cc2c1cccc2)c3cc[nH]n3 271570a_100000062414_200010000521 [0,1,0,0,0,1|1,0,1]=4 1214 B18R3.51705 Brc1ccc2cc(ccc2c1)c3cc[nH]n3 271570a_100000062414_100012344972 [0,1,0,0,0,1|2,0,0]=4 1215 B18R3.51705 Brc1ccc2cc(ccc2c1)c3cc[nH]n3 271570a_100010152634_100000062575 [0,1,0,0,0,1|2,0,0]=4 1216 B18R3.51705 Cc1ccc2nc(ccc2c1)c3cc[nH]c3 271570a_100000102155_100011865911 [0,1,0,0,0,1|2,0,0]=4 1217 B18R3.51705 Cc1ccc2nc(ccc2c1)c3cc[nH]n3 271570a_100000062414_100011865911 [0,1,0,0,0,1|1,0,0]=3 1218 B18R3.51705 Cc1ccc2nc(ccc2n1)c3cc[nH]n3 271570a_100000062414_200009884078 [0,1,0,0,0,1|2,0,0]=4 1219 B18R3.51705 Clc1ccc2cc(cnc2c1)c3cc[nH]c3 271570a_100000102155_100015716233 [0,1,0,0,0,1|2,0,0]=4 1220 B18R3.51705 Clc1ccc2cc(cnc2c1)c3cc[nH]n3 271570a_100000062414_100015716233 [0,1,0,0,0,1|1,0,0]=3 1221 B18R3.51705 Fc1ccc2cc(ccc2c1)c3cc[nH]n3 271570a_100000062414_100009817052 [0,1,0,0,0,1|2,0,0]=4 1222 B18R3.51705 Fc1ccc2cc(ccc2c1)c3cc[nH]n3 271570a_100009866154_100000062575 [0,1,0,0,0,1|2,0,0]=4 1223 B18R3.51705 Fc1ccc2nc(ccc2c1)c3cc[nH]c3 271570a_100000102155_100011998705 [0,1,0,0,0,1|2,0,0]=4 1224 B18R3.51705 Fc1ccc2nc(ccc2c1)c3cc[nH]n3 271570a_100000062414_100011998705 [0,1,0,0,0,1|1,0,0]=3 1225 B18R3.51705 Fc1ccc2nc(cnc2c1)c3cc[nH]c3 271570a_100000102155_100000098432 [0,1,0,0,0,1|1,0,1]=4 1226 B18R3.51705 Fc1ccc2nc(cnc2c1)c3cc[nH]n3 271570a_100000062414_100000098432 [0,1,0,0,0,1|0,0,1]=3 1227 B18R3.51705 Nc1ccc2cc(ccc2c1)c3cc[nH]n3 271570a_100000062414_100000185457 [0,1,0,0,0,1|2,0,0]=4 1228 B18R3.51705 Nc1ccc2cc(cnc2c1)c3cc[nH]c3 271570a_100000102155_200010264087 [0,1,0,0,0,1|2,0,0]=4 1229 B18R3.51705 Nc1ccc2cc(cnc2c1)c3cc[nH]n3 271570a_100000062414_200010264087 [0,1,0,0,0,1|1,0,0]=3 1230 B18R3.51705 Nc1ccc2cc(cnc2n1)c3cc[nH]n3 271570a_100000062414_100010214896 [0,1,0,0,0,1|2,0,0]=4 1231 B18R3.51705 Nc1ccc2nc(cnc2c1)c3cc[nH]c3 271570a_100000102155_100009885871 [0,1,0,0,0,1|1,0,1]=4 1232 B18R3.51705 Nc1ccc2nc(cnc2c1)c3cc[nH]n3 271570a_100000062414_100009885871 [0,1,0,0,0,1|0,0,1]=3 1233 B18R3.51705 Oc1ccc2cc(ccc2c1)c3cc[nH]n3 271570a_100000041922_100000062575 [0,1,0,0,0,1|2,0,0]=4 1234 B18R3.51705 Oc1ccc2cc(ccc2c1)c3cc[nH]n3 271570a_100000062414_100000185455 [0,1,0,0,0,1|2,0,0]=4 1235 B18R3.51705 Oc1ccc2cc(cnc2c1)c3cc[nH]c3 271570a_100000102155_200010153753 [0,1,0,0,0,1|2,0,0]=4 1236 B18R3.51705 Oc1ccc2cc(cnc2c1)c3cc[nH]n3 271570a_100000062414_200010153753 [0,1,0,0,0,1|1,0,0]=3 1237 B18R3.51705 Oc1ccc2cc(cnc2n1)c3cc[nH]n3 271570a_100000062414_100009814606 [0,1,0,0,0,1|2,0,0]=4 1238 B18R3.51705 Oc1ccc2nc(ccc2c1)c3cc[nH]c3 271570a_100000102155_100009849208 [0,1,0,0,0,1|2,0,0]=4 1239 B18R3.51705 Oc1ccc2nc(ccc2c1)c3cc[nH]n3 271570a_100000062414_100009849208 [0,1,0,0,0,1|1,0,0]=3 1240 B18R3.51705 Oc1ccc2nc(cnc2c1)c3cc[nH]c3 271570a_100000102155_200010664160 [0,1,0,0,0,1|1,0,1]=4 1241 B18R3.51705 Oc1ccc2nc(cnc2c1)c3cc[nH]n3 271570a_100000062414_200010664160 [0,1,0,0,0,1|0,0,1]=3 1242 B18R3.89733 Cc1cccc2c1cc(cc2)c3cc[nH]n3 271570a_100000062414_100010089936 [0,1,0,0,0,1|2,0,0]=4 1243 B18R3.89733 Cc1cccc2c1nc(cc2)c3cc[nH]c3 271570a_100000102155_100012002297 [0,1,0,0,0,1|2,0,0]=4 1244 B18R3.89733 Cc1cccc2c1nc(cc2)c3cc[nH]n3 271570a_100000062414_100012002297 [0,1,0,0,0,1|1,0,0]=3 1245 B18R3.89733 Fc1cccc2c1nc(cc2)c3cc[nH]c3 271570a_100000102155_100012017632 [0,1,0,0,0,1|2,0,0]=4 1246 B18R3.89733 Fc1cccc2c1nc(cc2)c3cc[nH]n3 271570a_100000062414_100012017632 [0,1,0,0,0,1|1,0,0]=3 1247 B18R3.89733 Nc1cccc2c1cc(cc2)c3cc[nH]n3 271570a_100000062414_100010090012 [0,1,0,0,0,1|2,0,0]=4 1248 B18R3.89733 Nc1cccc2c1cc(cn2)c3cc[nH]c3 271570a_100000102155_100010264086 [0,1,0,0,0,1|2,0,0]=4 1249 B18R3.89733 Nc1cccc2c1cc(cn2)c3cc[nH]n3 271570a_100000062414_100010264086 [0,1,0,0,0,1|1,0,0]=3 1250 B18R3.89733 O=c1[nH]ccc2c1cc(cn2)c3cc[nH]n3 271570a_100000062414_100010134370 [0,1,0,0,0,1|2,0,0]=4 1251 B18R3.89733 Oc1cccc2c1cc(cc2)c3cc[nH]n3 271570a_100000062414_100010089991 [0,1,0,0,0,1|2,0,0]=4 1252 B18R3.89733 Oc1cccc2c1cc(cn2)c3cc[nH]c3 271570a_100000102155_200010153752 [0,1,0,0,0,1|2,0,0]=4 1253 B18R3.89733 Oc1cccc2c1cc(cn2)c3cc[nH]n3 271570a_100000062414_200010153752 [0,1,0,0,0,1|1,0,0]=3 1254 B18R3.89733 Oc1cccc2c1nc(cc2)c3cc[nH]c3 271570a_100000102155_100010153751 [0,1,0,0,0,1|2,0,0]=4 1255 B18R3.89733 Oc1cccc2c1nc(cc2)c3cc[nH]n3 271570a_100000062414_100010153751 [0,1,0,0,0,1|1,0,0]=3 1256 B18R3.89733 Oc1cccc2c1nc(nc2)c3cc[nH]c3 271570a_100000102155_100010674811 [0,1,0,0,0,1|1,0,1]=4 1257 B18R3.89733 Oc1cccc2c1nc(nc2)c3cc[nH]n3 271570a_100000062414_100010674811 [0,1,0,0,0,1|0,0,1]=3 1258 B18R3.112 Brc1c(sc2c1cccc2)Sc3cc[nH]n3 62a_100000062575_100015504031 [0,1,0,0,0,1|2,0,0]=4 1259 B18R3.112 Brc1c(sc2c1cccc2)Sc3cc[nH]n3 62a_100015504031_100000062575 [0,1,0,0,0,1|2,0,0]=4 1260 B18R3.112 Cc1c(sc2c1cccc2)Sc3cc[nH]n3 62a_100000062575_200010198769 [0,1,0,0,0,1|2,0,0]=4 1261 B18R3.112 Cn1c(nc2c1cccc2)Sc3c[nH]cn3 62a_100000756875_200000239431 [0,1,0,0,0,1|2,0,0]=4 1262 B18R3.112 Cn1c(nc2c1cccc2)Sc3c[nH]cn3 62a_200000239431_100000756875 [0,1,0,0,0,1|2,0,0]=4 1263 B18R3.112 Cn1c(nc2c1cccc2)Sc3c[nH]nn3 62a_100009819707_200000239431 [0,1,0,0,0,1|1,0,1]=4 1264 B18R3.112 Cn1c(nc2c1cccc2)Sc3c[nH]nn3 62a_200000239431_100009819707 [0,1,0,0,0,1|1,0,1]=4 1265 B18R3.112 Cn1c(nc2c1cccc2)Sc3cc[nH]n3 62a_100000062575_200000239431 [0,1,0,0,0,1|0,0,0]=2 1266 B18R3.112 Cn1c(nc2c1cccc2)Sc3cc[nH]n3 62a_200000239431_100000062575 [0,1,0,0,0,1|0,0,0]=2 1267 B18R3.112 Cn1c(nc2c1cccc2)Sc3ccco3 62a_100009814098_200000239431 [0,1,0,0,0,1|2,0,0]=4 1268 B18R3.112 Cn1c(nc2c1cccc2)Sc3ccco3 62a_200000239431_100009814098 [0,1,0,0,0,1|2,0,0]=4 1269 B18R3.112 Cn1c(nc2c1cccc2)Sc3cccs3 62a_100011215356_200000239431 [0,1,0,0,0,1|2,0,0]=4 1270 B18R3.112 Cn1c(nc2c1cccc2)Sc3cccs3 62a_200000239431_100011215356 [0,1,0,0,0,1|2,0,0]=4 1271 B18R3.112 Cn1c(nc2c1cccc2)Sc3ccoc3 62a_100011215275_200000239431 [0,1,0,0,0,1|2,0,0]=4 1272 B18R3.112 Cn1c(nc2c1cccc2)Sc3ccoc3 62a_200000239431_100011215275 [0,1,0,0,0,1|2,0,0]=4 1273 B18R3.112 Cn1c(nc2c1cccc2)Sc3ccon3 62a_100009818083_200000239431 [0,1,0,0,0,1|1,0,0]=3 1274 B18R3.112 Cn1c(nc2c1cccc2)Sc3ccon3 62a_200000239431_100009818083 [0,1,0,0,0,1|1,0,0]=3 1275 B18R3.112 Cn1c(nc2c1cccc2)Sc3ccsc3 62a_100000738268_200000239431 [0,1,0,0,0,1|2,0,0]=4 1276 B18R3.112 Cn1c(nc2c1cccc2)Sc3ccsc3 62a_200000239431_100000738268 [0,1,0,0,0,1|2,0,0]=4 1277 B18R3.112 Cn1c(nc2c1cccc2)Sc3ccsn3 62a_100009818082_200000239431 [0,1,0,0,0,1|1,0,0]=3 1278 B18R3.112 Cn1c(nc2c1cccc2)Sc3ccsn3 62a_200000239431_100009818082 [0,1,0,0,0,1|1,0,0]=3 1279 B18R3.112 Cn1c(nc2c1cccc2)Sc3cn[nH]c3 62a_100000238712_200000239431 [0,1,0,0,0,1|2,0,0]=4 1280 B18R3.112 Cn1c(nc2c1cccc2)Sc3cn[nH]c3 62a_200000239431_100000238712 [0,1,0,0,0,1|2,0,0]=4 1281 B18R3.112 Cn1c(nc2c1cccc2)Sc3cscn3 62a_100000751502_200000239431 [0,1,0,0,0,1|2,0,0]=4 1282 B18R3.112 Cn1c(nc2c1cccc2)Sc3cscn3 62a_200000239431_100000751502 [0,1,0,0,0,1|2,0,0]=4 1283 B18R3.112 Cn1c(nc2c1cccc2)Sc3nc[nH]n3 62a_100000761765_200000239431 [0,1,0,0,0,1|1,0,0]=3 1284 B18R3.112 Cn1c(nc2c1cccc2)Sc3nc[nH]n3 62a_200000239431_100000761765 [0,1,0,0,0,1|1,0,0]=3 1285 B18R3.112 Cn1c(nc2c1cccc2)Sc3ncc[nH]3 62a_100025796157_200000239431 [0,1,0,0,0,1|2,0,0]=4 1286 B18R3.112 Cn1c(nc2c1cccc2)Sc3ncc[nH]3 62a_200000239431_100025796157 [0,1,0,0,0,1|2,0,0]=4 1287 B18R3.112 Cn1c(nc2c1cccc2)Sc3ncco3 62a_100011787736_200000239431 [0,1,0,0,0,1|2,0,0]=4 1288 B18R3.112 Cn1c(nc2c1cccc2)Sc3ncco3 62a_200000239431_100011787736 [0,1,0,0,0,1|2,0,0]=4 1289 B18R3.112 Cn1c(nc2c1cccc2)Sc3nccs3 62a_100000211983_200000239431 [0,1,0,0,0,1|2,0,0]=4 1290 B18R3.112 Cn1c(nc2c1cccc2)Sc3nccs3 62a_200000239431_100000211983 [0,1,0,0,0,1|2,0,0]=4 1291 B18R3.112 Cn1c(nc2c1cccc2)Sc3nncs3 62a_100000739804_200000239431 [0,1,0,0,0,1|1,0,1]=4 1292 B18R3.112 Cn1c(nc2c1cccc2)Sc3nncs3 62a_200000239431_100000739804 [0,1,0,0,0,1|1,0,1]=4 1293 B18R3.30587 Brc1cc([nH]n1)Sc2nc3ccccc3[nH]2 62a_100160470719_100009814255 [0,1,0,0,0,1|0,0,2]=4 1294 B18R3.30587 Brc1ccc(s1)Sc2nc3ccccc3[nH]2 62a_100010197418_100009814255 [0,1,0,0,0,1|2,0,0]=4 1295 B18R3.30587 Brc1csc(n1)Sc2nc3ccccc3[nH]2 62a_200016082925_100009814255 [0,1,0,0,0,1|2,0,0]=4 1296 B18R3.30587 Cc1c[nH]c(n1)Sc2nc3ccccc3[nH]2 62a_100161115468_100009814255 [0,1,0,0,0,1|2,0,0]=4 1297 B18R3.30587 Cc1cc(cs1)Sc2nc3ccccc3[nH]2 62a_100000759034_100009814255 [0,1,0,0,0,1|2,0,0]=4 1298 B18R3.30587 Cc1cc(n[nH]1)Sc2cc3ccccc3[nH]2 62a_100009819999_100010232065 [0,1,0,0,0,1|1,0,0]=3 1299 B18R3.30587 Cc1cc(n[nH]1)Sc2cc3ccccc3o2 62a_100009819999_100010159458 [0,1,0,0,0,1|2,0,0]=4 1300 B18R3.30587 Cc1cc(n[nH]1)Sc2cc3ccccc3s2 62a_100009819999_100009816949 [0,1,0,0,0,1|2,0,0]=4 1301 B18R3.30587 Cc1cc(n[nH]1)Sc2cc3cccnc3[nH]2 62a_100009819999_100010079843 [0,1,0,0,0,1|2,0,0]=4 1302 B18R3.30587 Cc1cc(n[nH]1)Sc2cn3ccccc3n2 62a_100009819999_100009819586 [0,1,0,0,0,1|2,0,0]=4 1303 B18R3.30587 Cc1cc(n[nH]1)Sc2nc3ccccc3[nH]2 62a_100009819999_100009814255 [0,1,0,0,0,1|0,0,0]=2 1304 B18R3.30587 Cc1cc(n[nH]1)Sc2nc3ccccc3s2 62a_100009819999_100000751744 [0,1,0,0,0,1|1,0,0]=3 1305 B18R3.30587 Cc1cc(n[nH]1)Sc2nc3cccnc3s2 62a_100009819999_100010188088 [0,1,0,0,0,1|2,0,0]=4 1306 B18R3.30587 Cc1cc(n[nH]1)Sc2nc3cccnc3s2 62a_100010188088_100009819999 [0,1,0,0,0,1|2,0,0]=4 1307 B18R3.30587 Cc1cc(no1)Sc2cc3ccccc3[nH]2 62a_100000716708_100010232065 [0,1,0,0,0,1|2,0,0]=4 1308 B18R3.30587 Cc1cc(no1)Sc2nc3ccccc3[nH]2 62a_100000716708_100009814255 [0,1,0,0,0,1|1,0,0]=3 1309 B18R3.30587 Cc1cc(no1)Sc2nc3ccccc3s2 62a_100000716708_100000751744 [0,1,0,0,0,1|2,0,0]=4 1310 B18R3.30587 Cc1cc(sn1)Sc2nc3ccccc3[nH]2 62a_100009815735_100009814255 [0,1,0,0,0,1|1,0,1]=4 1311 B18R3.30587 Cc1ccc(s1)Sc2nc3ccccc3[nH]2 62a_100000031368_100009814255 [0,1,0,0,0,1|2,0,0]=4 1312 B18R3.30587 Cc1cn(nn1)Cc2nc3ccccc3[nH]2 274090a_100000737899_200000242740 [0,1,0,0,0,1|1,0,1]=4 1313 B18R3.30587 Cc1cnc(s1)Sc2nc3ccccc3[nH]2 62a_100000690809_100009814255 [0,1,0,0,0,1|2,0,0]=4 1314 B18R3.30587 Cc1csc(c1)Sc2nc3ccccc3[nH]2 62a_100009876951_100009814255 [0,1,0,0,0,1|2,0,0]=4 1315 B18R3.30587 Cc1csc(n1)Sc2nc3ccccc3[nH]2 62a_100011291629_100009814255 [0,1,0,0,0,1|2,0,0]=4 1316 B18R3.30587 Cc1nc(c[nH]1)Sc2nc3ccccc3[nH]2 62a_100009814057_100009814255 [0,1,0,0,0,1|2,0,0]=4 1317 B18R3.30587 Cc1nc(cs1)Sc2nc3ccccc3[nH]2 62a_100011934587_100009814255 [0,1,0,0,0,1|2,0,0]=4 1318 B18R3.30587 Cc1nc(n[nH]1)Sc2cc3ccccc3[nH]2 62a_100000732540_100010232065 [0,1,0,0,0,1|2,0,0]=4 1319 B18R3.30587 Cc1nc(n[nH]1)Sc2nc3ccccc3[nH]2 62a_100000732540_100009814255 [0,1,0,0,0,1|1,0,0]=3 1320 B18R3.30587 Cc1nc(n[nH]1)Sc2nc3ccccc3s2 62a_100000732540_100000751744 [0,1,0,0,0,1|2,0,0]=4 1321 B18R3.30587 Cc1nc(no1)Cc2nc3ccccc3[nH]2 270196a_100000182587_100000070787 [0,1,0,0,0,1|2,0,0]=4 1322 B18R3.30587 Cc1nc(no1)Sc2nc3ccccc3[nH]2 62a_100012003639_100009814255 [0,1,0,0,0,1|2,0,0]=4 1323 B18R3.30587 Cc1nnc(s1)Sc2nc3ccccc3[nH]2 62a_100000686958_100009814255 [0,1,0,0,0,1|1,0,1]=4 1324 B18R3.30587 Cn1cc(cn1)Sc2nc3ccccc3[nH]2 62a_100000745744_100009814255 [0,1,0,0,0,1|2,0,0]=4 1325 B18R3.30587 Cn1cc(nn1)Sc2nc3ccccc3[nH]2 62a_100000760339_100009814255 [0,1,0,0,0,1|1,0,1]=4 1326 B18R3.30587 Cn1ccc(n1)Sc2cc3ccccc3[nH]2 62a_100000752436_100010232065 [0,1,0,0,0,1|1,0,0]=3 1327 B18R3.30587 Cn1ccc(n1)Sc2cc3ccccc3o2 62a_100000752436_100010159458 [0,1,0,0,0,1|2,0,0]=4 1328 B18R3.30587 Cn1ccc(n1)Sc2cc3ccccc3s2 62a_100000752436_100009816949 [0,1,0,0,0,1|2,0,0]=4 1329 B18R3.30587 Cn1ccc(n1)Sc2cc3cccnc3[nH]2 62a_100000752436_100010079843 [0,1,0,0,0,1|2,0,0]=4 1330 B18R3.30587 Cn1ccc(n1)Sc2cn3ccccc3n2 62a_100000752436_100009819586 [0,1,0,0,0,1|2,0,0]=4 1331 B18R3.30587 Cn1ccc(n1)Sc2nc3ccccc3[nH]2 62a_100000752436_100009814255 [0,1,0,0,0,1|0,0,0]=2 1332 B18R3.30587 Cn1ccc(n1)Sc2nc3ccccc3s2 62a_100000752436_100000751744 [0,1,0,0,0,1|1,0,0]=3 1333 B18R3.30587 Cn1ccc(n1)Sc2nc3cccnc3s2 62a_100000752436_100010188088 [0,1,0,0,0,1|2,0,0]=4 1334 B18R3.30587 Cn1ccc(n1)Sc2nc3cccnc3s2 62a_100010188088_100000752436 [0,1,0,0,0,1|2,0,0]=4 1335 B18R3.30587 Cn1cnc(c1)Sc2nc3ccccc3[nH]2 62a_100000040308_100009814255 [0,1,0,0,0,1|2,0,0]=4 1336 B18R3.30587 Cn1cnc(n1)Sc2cc3ccccc3[nH]2 62a_100009819955_100010232065 [0,1,0,0,0,1|2,0,0]=4 1337 B18R3.30587 Cn1cnc(n1)Sc2nc3ccccc3[nH]2 62a_100009819955_100009814255 [0,1,0,0,0,1|1,0,0]=3 1338 B18R3.30587 Cn1cnc(n1)Sc2nc3ccccc3s2 62a_100009819955_100000751744 [0,1,0,0,0,1|2,0,0]=4 1339 B18R3.30587 Cn1ncc(n1)Sc2cc3ccccc3[nH]2 62a_100000733932_100010232065 [0,1,0,0,0,1|2,0,0]=4 1340 B18R3.30587 Cn1ncc(n1)Sc2nc3ccccc3[nH]2 62a_100000733932_100009814255 [0,1,0,0,0,1|1,0,0]=3 1341 B18R3.30587 Cn1ncc(n1)Sc2nc3ccccc3s2 62a_100000733932_100000751744 [0,1,0,0,0,1|2,0,0]=4 1342 B18R3.30587 Cn1nnc(n1)Sc2nc3ccccc3[nH]2 62a_200009870515_100009814255 [0,1,0,0,0,1|2,0,0]=4 1343 B18R3.30587 Nc1cc(n[nH]1)Sc2cc3ccccc3[nH]2 62a_100009822546_100010232065 [0,1,0,0,0,1|1,0,0]=3 1344 B18R3.30587 Nc1cc(n[nH]1)Sc2cc3ccccc3o2 62a_100009822546_100010159458 [0,1,0,0,0,1|2,0,0]=4 1345 B18R3.30587 Nc1cc(n[nH]1)Sc2cc3ccccc3s2 62a_100009822546_100009816949 [0,1,0,0,0,1|2,0,0]=4 1346 B18R3.30587 Nc1cc(n[nH]1)Sc2cc3cccnc3[nH]2 62a_100009822546_100010079843 [0,1,0,0,0,1|2,0,0]=4 1347 B18R3.30587 Nc1cc(n[nH]1)Sc2cn3ccccc3n2 62a_100009822546_100009819586 [0,1,0,0,0,1|2,0,0]=4 1348 B18R3.30587 Nc1cc(n[nH]1)Sc2nc3ccccc3[nH]2 62a_100009822546_100009814255 [0,1,0,0,0,1|0,0,0]=2 1349 B18R3.30587 Nc1cc(n[nH]1)Sc2nc3ccccc3s2 62a_100009822546_100000751744 [0,1,0,0,0,1|1,0,0]=3 1350 B18R3.30587 Nc1cc(n[nH]1)Sc2nc3cccnc3s2 62a_100009822546_100010188088 [0,1,0,0,0,1|2,0,0]=4 1351 B18R3.30587 Nc1cc(n[nH]1)Sc2nc3cccnc3s2 62a_100010188088_100009822546 [0,1,0,0,0,1|2,0,0]=4 1352 B18R3.30587 Nc1csc(n1)Sc2nc3ccccc3[nH]2 62a_200015188442_100009814255 [0,1,0,0,0,1|2,0,0]=4 1353 B18R3.30587 Nc1nc(cs1)Sc2nc3ccccc3[nH]2 62a_100011998049_100009814255 [0,1,0,0,0,1|2,0,0]=4 1354 B18R3.30587 Nc1nc(n[nH]1)Sc2cc3ccccc3[nH]2 62a_100015184587_100010232065 [0,1,0,0,0,1|2,0,0]=4 1355 B18R3.30587 Nc1nc(n[nH]1)Sc2nc3ccccc3[nH]2 62a_100015184587_100009814255 [0,1,0,0,0,1|1,0,0]=3 1356 B18R3.30587 Nc1nc(n[nH]1)Sc2nc3ccccc3s2 62a_100015184587_100000751744 [0,1,0,0,0,1|2,0,0]=4 1357 B18R3.30587 Nc1nnc(s1)Sc2nc3ccccc3[nH]2 62a_100000738278_100009814255 [0,1,0,0,0,1|1,0,1]=4 1358 B18R3.30587 Oc1nc(no1)Cc2nc3ccccc3[nH]2 270196a_100000182587_100015183105 [0,1,0,0,0,1|2,0,0]=4 1359 B18R3.32726 Brc1ccc2[nH]c(cc2c1)Sc3cc[nH]n3 62a_100000062575_100011012855 [0,1,0,0,0,1|1,0,0]=3 1360 B18R3.32726 Brc1ccc2[nH]c(cc2c1)Sc3cc[nH]n3 62a_100011012855_100000062575 [0,1,0,0,0,1|1,0,0]=3 1361 B18R3.32726 Brc1ccc2[nH]c(cc2c1)Sc3ccon3 62a_100009818083_100011012855 [0,1,0,0,0,1|2,0,0]=4 1362 B18R3.32726 Brc1ccc2[nH]c(cc2c1)Sc3ccon3 62a_100011012855_100009818083 [0,1,0,0,0,1|2,0,0]=4 1363 B18R3.32726 Brc1ccc2[nH]c(cc2c1)Sc3ccsn3 62a_100009818082_100011012855 [0,1,0,0,0,1|2,0,0]=4 1364 B18R3.32726 Brc1ccc2[nH]c(cc2c1)Sc3ccsn3 62a_100011012855_100009818082 [0,1,0,0,0,1|2,0,0]=4 1365 B18R3.32726 Brc1ccc2[nH]c(cc2c1)Sc3nc[nH]n3 62a_100000761765_100011012855 [0,1,0,0,0,1|2,0,0]=4 1366 B18R3.32726 Brc1ccc2[nH]c(cc2c1)Sc3nc[nH]n3 62a_100011012855_100000761765 [0,1,0,0,0,1|2,0,0]=4 1367 B18R3.32726 Brc1ccc2sc(cc2c1)Sc3cc[nH]n3 62a_100000062575_200010198765 [0,1,0,0,0,1|2,0,0]=4 1368 B18R3.32726 Brc1ccc2sc(cc2c1)Sc3cc[nH]n3 62a_200010198765_100000062575 [0,1,0,0,0,1|2,0,0]=4 1369 B18R3.32726 Cc1ccc2nc(sc2c1)Sc3cc[nH]n3 62a_100000062575_100010186437 [0,1,0,0,0,1|1,0,0]=3 1370 B18R3.32726 Cc1ccc2nc(sc2c1)Sc3ccon3 62a_100009818083_100010186437 [0,1,0,0,0,1|2,0,0]=4 1371 B18R3.32726 Cc1ccc2nc(sc2c1)Sc3ccsn3 62a_100009818082_100010186437 [0,1,0,0,0,1|2,0,0]=4 1372 B18R3.32726 Cc1ccc2nc(sc2c1)Sc3nc[nH]n3 62a_100000761765_100010186437 [0,1,0,0,0,1|2,0,0]=4 1373 B18R3.32726 Fc1ccc2nc(cn2c1)Sc3cc[nH]n3 62a_100000062575_100010231931 [0,1,0,0,0,1|2,0,0]=4 1374 B18R3.32726 Fc1ccc2nc(cn2c1)Sc3cc[nH]n3 62a_100010231931_100000062575 [0,1,0,0,0,1|2,0,0]=4 1375 B18R3.32726 Fc1ccc2nc(sc2c1)Sc3cc[nH]n3 62a_100000062575_100000751617 [0,1,0,0,0,1|1,0,0]=3 1376 B18R3.32726 Fc1ccc2nc(sc2c1)Sc3cc[nH]n3 62a_100000751617_100000062575 [0,1,0,0,0,1|1,0,0]=3 1377 B18R3.32726 Fc1ccc2nc(sc2c1)Sc3ccon3 62a_100000751617_100009818083 [0,1,0,0,0,1|2,0,0]=4 1378 B18R3.32726 Fc1ccc2nc(sc2c1)Sc3ccon3 62a_100009818083_100000751617 [0,1,0,0,0,1|2,0,0]=4 1379 B18R3.32726 Fc1ccc2nc(sc2c1)Sc3ccsn3 62a_100000751617_100009818082 [0,1,0,0,0,1|2,0,0]=4 1380 B18R3.32726 Fc1ccc2nc(sc2c1)Sc3ccsn3 62a_100009818082_100000751617 [0,1,0,0,0,1|2,0,0]=4 1381 B18R3.32726 Fc1ccc2nc(sc2c1)Sc3nc[nH]n3 62a_100000751617_100000761765 [0,1,0,0,0,1|2,0,0]=4 1382 B18R3.32726 Fc1ccc2nc(sc2c1)Sc3nc[nH]n3 62a_100000761765_100000751617 [0,1,0,0,0,1|2,0,0]=4 1383 B18R3.32726 Fc1ccc2nc(sc2n1)Sc3cc[nH]n3 62a_100000062575_200010738066 [0,1,0,0,0,1|2,0,0]=4 1384 B18R3.32726 Fc1ccc2nc(sc2n1)Sc3cc[nH]n3 62a_200010738066_100000062575 [0,1,0,0,0,1|2,0,0]=4 1385 B18R3.32726 Fc1ccc2sc(nc2c1)Sc3cc[nH]n3 62a_100000062575_200010206605 [0,1,0,0,0,1|1,0,0]=3 1386 B18R3.32726 Fc1ccc2sc(nc2c1)Sc3cc[nH]n3 62a_200010206605_100000062575 [0,1,0,0,0,1|1,0,0]=3 1387 B18R3.32726 Fc1ccc2sc(nc2c1)Sc3ccon3 62a_100009818083_200010206605 [0,1,0,0,0,1|2,0,0]=4 1388 B18R3.32726 Fc1ccc2sc(nc2c1)Sc3ccon3 62a_200010206605_100009818083 [0,1,0,0,0,1|2,0,0]=4 1389 B18R3.32726 Fc1ccc2sc(nc2c1)Sc3ccsn3 62a_100009818082_200010206605 [0,1,0,0,0,1|2,0,0]=4 1390 B18R3.32726 Fc1ccc2sc(nc2c1)Sc3ccsn3 62a_200010206605_100009818082 [0,1,0,0,0,1|2,0,0]=4 1391 B18R3.32726 Fc1ccc2sc(nc2c1)Sc3nc[nH]n3 62a_100000761765_200010206605 [0,1,0,0,0,1|2,0,0]=4 1392 B18R3.32726 Fc1ccc2sc(nc2c1)Sc3nc[nH]n3 62a_200010206605_100000761765 [0,1,0,0,0,1|2,0,0]=4 1393 B18R3.32726 Nc1ccc2nc(sc2c1)Sc3cc[nH]n3 62a_100000062575_100010253933 [0,1,0,0,0,1|1,0,0]=3 1394 B18R3.32726 Nc1ccc2nc(sc2c1)Sc3cc[nH]n3 62a_100010253933_100000062575 [0,1,0,0,0,1|1,0,0]=3 1395 B18R3.32726 Nc1ccc2nc(sc2c1)Sc3ccon3 62a_100009818083_100010253933 [0,1,0,0,0,1|2,0,0]=4 1396 B18R3.32726 Nc1ccc2nc(sc2c1)Sc3ccon3 62a_100010253933_100009818083 [0,1,0,0,0,1|2,0,0]=4 1397 B18R3.32726 Nc1ccc2nc(sc2c1)Sc3ccsn3 62a_100009818082_100010253933 [0,1,0,0,0,1|2,0,0]=4 1398 B18R3.32726 Nc1ccc2nc(sc2c1)Sc3ccsn3 62a_100010253933_100009818082 [0,1,0,0,0,1|2,0,0]=4 1399 B18R3.32726 Nc1ccc2nc(sc2c1)Sc3nc[nH]n3 62a_100000761765_100010253933 [0,1,0,0,0,1|2,0,0]=4 1400 B18R3.32726 Nc1ccc2nc(sc2c1)Sc3nc[nH]n3 62a_100010253933_100000761765 [0,1,0,0,0,1|2,0,0]=4 1401 B18R3.32726 Nc1ccc2sc(nc2c1)Sc3cc[nH]n3 62a_100000062575_100010329861 [0,1,0,0,0,1|1,0,0]=3 1402 B18R3.32726 Nc1ccc2sc(nc2c1)Sc3cc[nH]n3 62a_100010329861_100000062575 [0,1,0,0,0,1|1,0,0]=3 1403 B18R3.32726 Nc1ccc2sc(nc2c1)Sc3ccon3 62a_100009818083_100010329861 [0,1,0,0,0,1|2,0,0]=4 1404 B18R3.32726 Nc1ccc2sc(nc2c1)Sc3ccon3 62a_100010329861_100009818083 [0,1,0,0,0,1|2,0,0]=4 1405 B18R3.32726 Nc1ccc2sc(nc2c1)Sc3ccsn3 62a_100009818082_100010329861 [0,1,0,0,0,1|2,0,0]=4 1406 B18R3.32726 Nc1ccc2sc(nc2c1)Sc3ccsn3 62a_100010329861_100009818082 [0,1,0,0,0,1|2,0,0]=4 1407 B18R3.32726 Nc1ccc2sc(nc2c1)Sc3nc[nH]n3 62a_100000761765_100010329861 [0,1,0,0,0,1|2,0,0]=4 1408 B18R3.32726 Nc1ccc2sc(nc2c1)Sc3nc[nH]n3 62a_100010329861_100000761765 [0,1,0,0,0,1|2,0,0]=4 1409 B18R3.32726 Oc1ccc2nc(sc2c1)Sc3cc[nH]n3 62a_100000062575_100010063415 [0,1,0,0,0,1|1,0,0]=3 1410 B18R3.32726 Oc1ccc2nc(sc2c1)Sc3ccon3 62a_100009818083_100010063415 [0,1,0,0,0,1|2,0,0]=4 1411 B18R3.32726 Oc1ccc2nc(sc2c1)Sc3ccsn3 62a_100009818082_100010063415 [0,1,0,0,0,1|2,0,0]=4 1412 B18R3.32726 Oc1ccc2nc(sc2c1)Sc3nc[nH]n3 62a_100000761765_100010063415 [0,1,0,0,0,1|2,0,0]=4 1413 B18R3.88205 Brc1cccc2c1[nH]c(c2)Sc3cc[nH]n3 62a_100000062575_100135389745 [0,1,0,0,0,1|1,0,0]=3 1414 B18R3.88205 Brc1cccc2c1[nH]c(c2)Sc3cc[nH]n3 62a_100135389745_100000062575 [0,1,0,0,0,1|1,0,0]=3 1415 B18R3.88205 Brc1cccc2c1[nH]c(c2)Sc3ccon3 62a_100009818083_100135389745 [0,1,0,0,0,1|2,0,0]=4 1416 B18R3.88205 Brc1cccc2c1[nH]c(c2)Sc3ccon3 62a_100135389745_100009818083 [0,1,0,0,0,1|2,0,0]=4 1417 B18R3.88205 Brc1cccc2c1[nH]c(c2)Sc3ccsn3 62a_100009818082_100135389745 [0,1,0,0,0,1|2,0,0]=4 1418 B18R3.88205 Brc1cccc2c1[nH]c(c2)Sc3ccsn3 62a_100135389745_100009818082 [0,1,0,0,0,1|2,0,0]=4 1419 B18R3.88205 Brc1cccc2c1[nH]c(c2)Sc3nc[nH]n3 62a_100000761765_100135389745 [0,1,0,0,0,1|2,0,0]=4 1420 B18R3.88205 Brc1cccc2c1[nH]c(c2)Sc3nc[nH]n3 62a_100135389745_100000761765 [0,1,0,0,0,1|2,0,0]=4 1421 B18R3.88205 Cc1cccc2c1nc(s2)Sc3cc[nH]n3 62a_100000062575_100010008827 [0,1,0,0,0,1|1,0,0]=3 1422 B18R3.88205 Cc1cccc2c1nc(s2)Sc3ccon3 62a_100009818083_100010008827 [0,1,0,0,0,1|2,0,0]=4 1423 B18R3.88205 Cc1cccc2c1nc(s2)Sc3ccsn3 62a_100009818082_100010008827 [0,1,0,0,0,1|2,0,0]=4 1424 B18R3.88205 Cc1cccc2c1nc(s2)Sc3nc[nH]n3 62a_100000761765_100010008827 [0,1,0,0,0,1|2,0,0]=4 1425 B18R3.88205 Clc1ccnc2c1cc([nH]2)Sc3cc[nH]n3 62a_100000062575_100010234028 [0,1,0,0,0,1|2,0,0]=4 1426 B18R3.88205 Fc1cccc2c1nc(s2)Sc3cc[nH]n3 62a_100000062575_100010008856 [0,1,0,0,0,1|1,0,0]=3 1427 B18R3.88205 Fc1cccc2c1nc(s2)Sc3ccon3 62a_100009818083_100010008856 [0,1,0,0,0,1|2,0,0]=4 1428 B18R3.88205 Fc1cccc2c1nc(s2)Sc3ccsn3 62a_100009818082_100010008856 [0,1,0,0,0,1|2,0,0]=4 1429 B18R3.88205 Fc1cccc2c1nc(s2)Sc3nc[nH]n3 62a_100000761765_100010008856 [0,1,0,0,0,1|2,0,0]=4 1430 B18R3.88205 Nc1ncnc2c1[nH]c(n2)Sc3cc[nH]n3 62a_100009817290_100000062575 [0,1,0,0,0,1|2,0,0]=4 1431 B18R3.93074 Brc1c[nH]nc1Sc2cc3ccccc3[nH]2 62a_100015839836_100010232065 [0,1,0,0,0,1|1,0,0]=3 1432 B18R3.93074 Brc1c[nH]nc1Sc2cc3ccccc3o2 62a_100015839836_100010159458 [0,1,0,0,0,1|2,0,0]=4 1433 B18R3.93074 Brc1c[nH]nc1Sc2cc3ccccc3s2 62a_100015839836_100009816949 [0,1,0,0,0,1|2,0,0]=4 1434 B18R3.93074 Brc1c[nH]nc1Sc2cc3cccnc3[nH]2 62a_100015839836_100010079843 [0,1,0,0,0,1|2,0,0]=4 1435 B18R3.93074 Brc1c[nH]nc1Sc2cn3ccccc3n2 62a_100015839836_100009819586 [0,1,0,0,0,1|2,0,0]=4 1436 B18R3.93074 Brc1c[nH]nc1Sc2nc3ccccc3[nH]2 62a_100015839836_100009814255 [0,1,0,0,0,1|0,0,0]=2 1437 B18R3.93074 Brc1c[nH]nc1Sc2nc3ccccc3s2 62a_100015839836_100000751744 [0,1,0,0,0,1|1,0,0]=3 1438 B18R3.93074 Brc1c[nH]nc1Sc2nc3cccnc3s2 62a_100010188088_100015839836 [0,1,0,0,0,1|2,0,0]=4 1439 B18R3.93074 Brc1c[nH]nc1Sc2nc3cccnc3s2 62a_100015839836_100010188088 [0,1,0,0,0,1|2,0,0]=4 1440 B18R3.93074 Brc1ccsc1Sc2nc3ccccc3[nH]2 62a_100012361411_100009814255 [0,1,0,0,0,1|2,0,0]=4 1441 B18R3.93074 Brc1cscc1Sc2nc3ccccc3[nH]2 62a_100010143727_100009814255 [0,1,0,0,0,1|2,0,0]=4 1442 B18R3.93074 Brc1n[nH]cc1Sc2nc3ccccc3[nH]2 62a_100011012988_100009814255 [0,1,0,0,0,1|2,0,0]=4 1443 B18R3.93074 Cc1[nH]cnc1Sc2nc3ccccc3[nH]2 62a_100010186451_100009814255 [0,1,0,0,0,1|2,0,0]=4 1444 B18R3.93074 Cc1c[nH]nc1Sc2cc3ccccc3[nH]2 62a_100009871783_100010232065 [0,1,0,0,0,1|1,0,0]=3 1445 B18R3.93074 Cc1c[nH]nc1Sc2cc3ccccc3o2 62a_100009871783_100010159458 [0,1,0,0,0,1|2,0,0]=4 1446 B18R3.93074 Cc1c[nH]nc1Sc2cc3ccccc3s2 62a_100009871783_100009816949 [0,1,0,0,0,1|2,0,0]=4 1447 B18R3.93074 Cc1c[nH]nc1Sc2cc3cccnc3[nH]2 62a_100009871783_100010079843 [0,1,0,0,0,1|2,0,0]=4 1448 B18R3.93074 Cc1c[nH]nc1Sc2cn3ccccc3n2 62a_100009871783_100009819586 [0,1,0,0,0,1|2,0,0]=4 1449 B18R3.93074 Cc1c[nH]nc1Sc2nc3ccccc3[nH]2 62a_100009871783_100009814255 [0,1,0,0,0,1|0,0,0]=2 1450 B18R3.93074 Cc1c[nH]nc1Sc2nc3ccccc3s2 62a_100009871783_100000751744 [0,1,0,0,0,1|1,0,0]=3 1451 B18R3.93074 Cc1c[nH]nc1Sc2nc3cccnc3s2 62a_100009871783_100010188088 [0,1,0,0,0,1|2,0,0]=4 1452 B18R3.93074 Cc1c[nH]nc1Sc2nc3cccnc3s2 62a_100010188088_100009871783 [0,1,0,0,0,1|2,0,0]=4 1453 B18R3.93074 Cc1ccsc1Sc2nc3ccccc3[nH]2 62a_100010247149_100009814255 [0,1,0,0,0,1|2,0,0]=4 1454 B18R3.93074 Cc1cscc1Sc2nc3ccccc3[nH]2 62a_100000759966_100009814255 [0,1,0,0,0,1|2,0,0]=4 1455 B18R3.93074 Cc1n[nH]cc1Sc2nc3ccccc3[nH]2 62a_100000692133_100009814255 [0,1,0,0,0,1|2,0,0]=4 1456 B18R3.93074 Cc1sccc1Sc2nc3ccccc3[nH]2 62a_100000684487_100009814255 [0,1,0,0,0,1|2,0,0]=4 1457 B18R3.93074 Cc1scnc1Sc2nc3ccccc3[nH]2 62a_100000732656_100009814255 [0,1,0,0,0,1|2,0,0]=4 1458 B18R3.93074 Cn1ccnc1Sc2nc3ccccc3[nH]2 62a_100000707724_100009814255 [0,1,0,0,0,1|2,0,0]=4 1459 B18R3.93074 Cn1nccc1Sc2nc3ccccc3[nH]2 62a_100000688441_100009814255 [0,1,0,0,0,1|0,0,2]=4 1460 B18R3.93074 Fc1n[nH]cc1Sc2nc3ccccc3[nH]2 62a_100015597042_100009814255 [0,1,0,0,0,1|2,0,0]=4 1461 B18R3.93074 Nc1c[nH]nc1Sc2cc3ccccc3[nH]2 62a_100010894806_100010232065 [0,1,0,0,0,1|1,0,0]=3 1462 B18R3.93074 Nc1c[nH]nc1Sc2cc3ccccc3o2 62a_100010894806_100010159458 [0,1,0,0,0,1|2,0,0]=4 1463 B18R3.93074 Nc1c[nH]nc1Sc2cc3ccccc3s2 62a_100010894806_100009816949 [0,1,0,0,0,1|2,0,0]=4 1464 B18R3.93074 Nc1c[nH]nc1Sc2cc3cccnc3[nH]2 62a_100010894806_100010079843 [0,1,0,0,0,1|2,0,0]=4 1465 B18R3.93074 Nc1c[nH]nc1Sc2cn3ccccc3n2 62a_100010894806_100009819586 [0,1,0,0,0,1|2,0,0]=4 1466 B18R3.93074 Nc1c[nH]nc1Sc2nc3ccccc3[nH]2 62a_100010894806_100009814255 [0,1,0,0,0,1|0,0,0]=2 1467 B18R3.93074 Nc1c[nH]nc1Sc2nc3ccccc3s2 62a_100010894806_100000751744 [0,1,0,0,0,1|1,0,0]=3 1468 B18R3.93074 Nc1c[nH]nc1Sc2nc3cccnc3s2 62a_100010188088_100010894806 [0,1,0,0,0,1|2,0,0]=4 1469 B18R3.93074 Nc1c[nH]nc1Sc2nc3cccnc3s2 62a_100010894806_100010188088 [0,1,0,0,0,1|2,0,0]=4 1470 B18R3.93074 Nc1n[nH]cc1Sc2nc3ccccc3[nH]2 62a_100000717100_100009814255 [0,1,0,0,0,1|2,0,0]=4 1471 B18R3.111 Cn1c(cc2c1cccc2)c3ccccn3 271570a_100010171889_100011216584 [0,1,0,0,0,1|2,0,0]=4 1472 B18R3.111 Cn1c(cc2c1cccc2)c3cccnc3 271570a_100010171889_100000752921 [0,1,0,0,0,1|2,0,0]=4 1473 B18R3.111 Cn1c(cc2c1cccc2)c3cccnn3 271570a_100010171889_100016991348 [0,1,0,0,0,1|1,0,1]=4 1474 B18R3.111 Cn1c(cc2c1cccc2)c3ccncn3 271570a_100010171889_100000703185 [0,1,0,0,0,1|1,0,1]=4 1475 B18R3.111 Cn1c(cc2c1cccc2)c3ccnnc3 271570a_100010171889_100000732662 [0,1,0,0,0,1|1,0,1]=4 1476 B18R3.111 Cn1c(cc2c1cccc2)c3cnccn3 271570a_100010171889_100000758340 [0,1,0,0,0,1|2,0,0]=4 1477 B18R3.111 Cn1c(cc2c1cccc2)c3ncccn3 271570a_100010171889_100000211032 [0,1,0,0,0,1|2,0,0]=4 1478 B18R3.111 Cn1c(nc2c1cccc2)C3=CCNCC3 271570a_100000731432_200000239431 [0,1,0,0,0,1|1,0,1]=4 1479 B18R3.111 Cn1c(nc2c1cccc2)c3ccccc3 271570a_100011218836_200000239431 [0,1,0,0,0,1|2,0,0]=4 1480 B18R3.111 Cn1c(nc2c1cccc2)c3ccccn3 271570a_100011264011_200000239431 [0,1,0,0,0,1|1,0,0]=3 1481 B18R3.111 Cn1c(nc2c1cccc2)c3cccnc3 271570a_100000757648_200000239431 [0,1,0,0,0,1|1,0,0]=3 1482 B18R3.111 Cn1c(nc2c1cccc2)c3ccncc3 271570a_100000752145_200000239431 [0,1,0,0,0,1|1,0,1]=4 1483 B18R3.111 Cn1c(nc2c1cccc2)c3cnccn3 271570a_100011962566_200000239431 [0,1,0,0,0,1|1,0,0]=3 1484 B18R3.111 Cn1c(nc2c1cccc2)c3cncnc3 271570a_100000707473_200000239431 [0,1,0,0,0,1|1,0,1]=4 1485 B18R3.5893 Brc1cccc2c1[nH]c(c2)c3ccccn3 271570a_100011264011_100135389745 [0,1,0,0,0,1|2,0,0]=4 1486 B18R3.5893 Brc1cccc2c1[nH]c(c2)c3ccccn3 271570a_200010246277_100011216584 [0,1,0,0,0,1|2,0,0]=4 1487 B18R3.5893 Brc1cccc2c1[nH]c(c2)c3cccnc3 271570a_100000757648_100135389745 [0,1,0,0,0,1|2,0,0]=4 1488 B18R3.5893 Brc1cccc2c1[nH]c(c2)c3cccnc3 271570a_200010246277_100000752921 [0,1,0,0,0,1|2,0,0]=4 1489 B18R3.5893 Brc1cccc2c1[nH]c(c2)c3cccnn3 271570a_200010246277_100016991348 [0,1,0,0,0,1|1,0,1]=4 1490 B18R3.5893 Brc1cccc2c1[nH]c(c2)c3ccncn3 271570a_200010246277_100000703185 [0,1,0,0,0,1|1,0,1]=4 1491 B18R3.5893 Brc1cccc2c1[nH]c(c2)c3ccnnc3 271570a_200010246277_100000732662 [0,1,0,0,0,1|1,0,1]=4 1492 B18R3.5893 Brc1cccc2c1[nH]c(c2)c3cnccn3 271570a_100011962566_100135389745 [0,1,0,0,0,1|2,0,0]=4 1493 B18R3.5893 Brc1cccc2c1[nH]c(c2)c3cnccn3 271570a_200010246277_100000758340 [0,1,0,0,0,1|2,0,0]=4 1494 B18R3.5893 Brc1cccc2c1[nH]c(c2)c3ncccn3 271570a_200010246277_100000211032 [0,1,0,0,0,1|2,0,0]=4 1495 B18R3.5893 Cc1cccc2c1[nH]c(c2)c3ccccn3 271570a_100010246273_100011216584 [0,1,0,0,0,1|2,0,0]=4 1496 B18R3.5893 Cc1cccc2c1[nH]c(c2)c3cccnc3 271570a_100010246273_100000752921 [0,1,0,0,0,1|2,0,0]=4 1497 B18R3.5893 Cc1cccc2c1[nH]c(c2)c3cccnn3 271570a_100010246273_100016991348 [0,1,0,0,0,1|1,0,1]=4 1498 B18R3.5893 Cc1cccc2c1[nH]c(c2)c3ccncn3 271570a_100010246273_100000703185 [0,1,0,0,0,1|1,0,1]=4 1499 B18R3.5893 Cc1cccc2c1[nH]c(c2)c3ccnnc3 271570a_100010246273_100000732662 [0,1,0,0,0,1|1,0,1]=4 1500 B18R3.5893 Cc1cccc2c1[nH]c(c2)c3cnccn3 271570a_100010246273_100000758340 [0,1,0,0,0,1|2,0,0]=4 1501 B18R3.5893 Cc1cccc2c1[nH]c(c2)c3ncccn3 271570a_100010246273_100000211032 [0,1,0,0,0,1|2,0,0]=4 1502 B18R3.5893 Cc1cccc2c1nc(s2)c3ccccn3 271570a_100011264011_100010008827 [0,1,0,0,0,1|2,0,0]=4 1503 B18R3.5893 Cc1cccc2c1nc(s2)c3cccnc3 271570a_100000757648_100010008827 [0,1,0,0,0,1|2,0,0]=4 1504 B18R3.5893 Cc1cccc2c1nc(s2)c3cnccn3 271570a_100011962566_100010008827 [0,1,0,0,0,1|2,0,0]=4 1505 B18R3.5893 Clc1cccc2c1[nH]c(c2)c3ccccn3 271570a_100015811879_100011216584 [0,1,0,0,0,1|2,0,0]=4 1506 B18R3.5893 Clc1cccc2c1[nH]c(c2)c3cccnc3 271570a_100015811879_100000752921 [0,1,0,0,0,1|2,0,0]=4 1507 B18R3.5893 Clc1cccc2c1[nH]c(c2)c3cccnn3 271570a_100015811879_100016991348 [0,1,0,0,0,1|1,0,1]=4 1508 B18R3.5893 Clc1cccc2c1[nH]c(c2)c3ccncn3 271570a_100015811879_100000703185 [0,1,0,0,0,1|1,0,1]=4 1509 B18R3.5893 Clc1cccc2c1[nH]c(c2)c3ccnnc3 271570a_100015811879_100000732662 [0,1,0,0,0,1|1,0,1]=4 1510 B18R3.5893 Clc1cccc2c1[nH]c(c2)c3cnccn3 271570a_100015811879_100000758340 [0,1,0,0,0,1|2,0,0]=4 1511 B18R3.5893 Clc1cccc2c1[nH]c(c2)c3ncccn3 271570a_100015811879_100000211032 [0,1,0,0,0,1|2,0,0]=4 1512 B18R3.5893 Clc1cccc2c1cc([nH]2)c3ccccn3 271570a_100010246266_100011216584 [0,1,0,0,0,1|2,0,0]=4 1513 B18R3.5893 Clc1cccc2c1cc([nH]2)c3cccnc3 271570a_100010246266_100000752921 [0,1,0,0,0,1|2,0,0]=4 1514 B18R3.5893 Clc1cccc2c1cc([nH]2)c3cccnn3 271570a_100010246266_100016991348 [0,1,0,0,0,1|1,0,1]=4 1515 B18R3.5893 Clc1cccc2c1cc([nH]2)c3ccncn3 271570a_100010246266_100000703185 [0,1,0,0,0,1|1,0,1]=4 1516 B18R3.5893 Clc1cccc2c1cc([nH]2)c3ccnnc3 271570a_100010246266_100000732662 [0,1,0,0,0,1|1,0,1]=4 1517 B18R3.5893 Clc1cccc2c1cc([nH]2)c3cnccn3 271570a_100010246266_100000758340 [0,1,0,0,0,1|2,0,0]=4 1518 B18R3.5893 Clc1cccc2c1cc([nH]2)c3ncccn3 271570a_100010246266_100000211032 [0,1,0,0,0,1|2,0,0]=4 1519 B18R3.5893 Fc1cccc2c1[nH]c(c2)c3ccccn3 271570a_100010082618_100011216584 [0,1,0,0,0,1|2,0,0]=4 1520 B18R3.5893 Fc1cccc2c1[nH]c(c2)c3cccnc3 271570a_100010082618_100000752921 [0,1,0,0,0,1|2,0,0]=4 1521 B18R3.5893 Fc1cccc2c1[nH]c(c2)c3cccnn3 271570a_100010082618_100016991348 [0,1,0,0,0,1|1,0,1]=4 1522 B18R3.5893 Fc1cccc2c1[nH]c(c2)c3ccncn3 271570a_100010082618_100000703185 [0,1,0,0,0,1|1,0,1]=4 1523 B18R3.5893 Fc1cccc2c1[nH]c(c2)c3ccnnc3 271570a_100010082618_100000732662 [0,1,0,0,0,1|1,0,1]=4 1524 B18R3.5893 Fc1cccc2c1[nH]c(c2)c3cnccn3 271570a_100010082618_100000758340 [0,1,0,0,0,1|2,0,0]=4 1525 B18R3.5893 Fc1cccc2c1[nH]c(c2)c3ncccn3 271570a_100010082618_100000211032 [0,1,0,0,0,1|2,0,0]=4 1526 B18R3.5893 Fc1cccc2c1cc([nH]2)c3ccccn3 271570a_100010071326_100011216584 [0,1,0,0,0,1|2,0,0]=4 1527 B18R3.5893 Fc1cccc2c1cc([nH]2)c3cccnc3 271570a_100010071326_100000752921 [0,1,0,0,0,1|2,0,0]=4 1528 B18R3.5893 Fc1cccc2c1cc([nH]2)c3cccnn3 271570a_100010071326_100016991348 [0,1,0,0,0,1|1,0,1]=4 1529 B18R3.5893 Fc1cccc2c1cc([nH]2)c3ccncn3 271570a_100010071326_100000703185 [0,1,0,0,0,1|1,0,1]=4 1530 B18R3.5893 Fc1cccc2c1cc([nH]2)c3ccnnc3 271570a_100010071326_100000732662 [0,1,0,0,0,1|1,0,1]=4 1531 B18R3.5893 Fc1cccc2c1cc([nH]2)c3cnccn3 271570a_100010071326_100000758340 [0,1,0,0,0,1|2,0,0]=4 1532 B18R3.5893 Fc1cccc2c1cc([nH]2)c3ncccn3 271570a_100010071326_100000211032 [0,1,0,0,0,1|2,0,0]=4 1533 B18R3.5893 Fc1cccc2c1nc(s2)c3ccccn3 271570a_100011264011_100010008856 [0,1,0,0,0,1|2,0,0]=4 1534 B18R3.5893 Fc1cccc2c1nc(s2)c3cccnc3 271570a_100000757648_100010008856 [0,1,0,0,0,1|2,0,0]=4 1535 B18R3.5893 Fc1cccc2c1nc(s2)c3cnccn3 271570a_100011962566_100010008856 [0,1,0,0,0,1|2,0,0]=4 1536 B18R3.5893 Oc1cccc2c1nc([nH]2)c3ccccc3 271570a_203496583355_100007458543 [0,1,0,0,0,1|2,0,0]=4 1537 B18R3.30705 Brc1ccc(cc1)c2nc3ccccc3[nH]2 271570a_100010235827_100009814255 [0,1,0,0,0,1|2,0,0]=4 1538 B18R3.30705 Brc1ccc(cn1)c2cc3ccccc3[nH]2 271570a_100010206980_100009814638 [0,1,0,0,0,1|2,0,0]=4 1539 B18R3.30705 Brc1ccc(cn1)c2nc3ccccc3s2 271570a_200000082171_100009814638 [0,1,0,0,0,1|2,0,0]=4 1540 B18R3.30705 Brc1ccc(nc1)c2cc3ccccc3[nH]2 271570a_100010206980_100000686858 [0,1,0,0,0,1|2,0,0]=4 1541 B18R3.30705 Brc1ccc(nc1)c2nc3ccccc3s2 271570a_200000082171_100000686858 [0,1,0,0,0,1|2,0,0]=4 1542 B18R3.30705 Brc1cnc(nc1)c2cc3ccccc3[nH]2 271570a_100010206980_100000690281 [0,1,0,0,0,1|2,0,0]=4 1543 B18R3.30705 Brc1cnc(nc1)c2nc3ccccc3s2 271570a_200000082171_100000690281 [0,1,0,0,0,1|2,0,0]=4 1544 B18R3.30705 C[n+]1ccc(cc1)c2nc3ccccc3[nH]2 271570a_100010897472_100009814255 [0,1,0,0,0,1|1,0,1]=4 1545 B18R3.30705 Cc1ccc(cc1)c2nc3ccccc3[nH]2 271570a_100000708704_100009814255 [0,1,0,0,0,1|2,0,0]=4 1546 B18R3.30705 Cc1ccc(cn1)c2cc3ccccc3[nH]2 271570a_100010206980_100000751577 [0,1,0,0,0,1|2,0,0]=4 1547 B18R3.30705 Cc1ccc(cn1)c2cc3ccccc3[nH]2 271570a_100012354835_100010232065 [0,1,0,0,0,1|2,0,0]=4 1548 B18R3.30705 Cc1ccc(cn1)c2nc3ccccc3[nH]2 271570a_100012354835_100009814255 [0,1,0,0,0,1|1,0,0]=3 1549 B18R3.30705 Cc1ccc(cn1)c2nc3ccccc3s2 271570a_100012354835_100000751744 [0,1,0,0,0,1|2,0,0]=4 1550 B18R3.30705 Cc1ccc(cn1)c2nc3ccccc3s2 271570a_200000082171_100000751577 [0,1,0,0,0,1|2,0,0]=4 1551 B18R3.30705 Cc1ccc(nc1)c2cc3ccccc3[nH]2 271570a_100000066433_100010232065 [0,1,0,0,0,1|2,0,0]=4 1552 B18R3.30705 Cc1ccc(nc1)c2cc3ccccc3[nH]2 271570a_100010206980_100000754016 [0,1,0,0,0,1|2,0,0]=4 1553 B18R3.30705 Cc1ccc(nc1)c2nc3ccccc3[nH]2 271570a_100000066433_100009814255 [0,1,0,0,0,1|1,0,0]=3 1554 B18R3.30705 Cc1ccc(nc1)c2nc3ccccc3s2 271570a_100000066433_100000751744 [0,1,0,0,0,1|2,0,0]=4 1555 B18R3.30705 Cc1ccc(nc1)c2nc3ccccc3s2 271570a_200000082171_100000754016 [0,1,0,0,0,1|2,0,0]=4 1556 B18R3.30705 Cc1ccc(nn1)c2cc3ccccc3[nH]2 271570a_100010206980_100011450037 [0,1,0,0,0,1|1,0,1]=4 1557 B18R3.30705 Cc1ccc(nn1)c2nc3ccccc3s2 271570a_200000082171_100011450037 [0,1,0,0,0,1|1,0,1]=4 1558 B18R3.30705 Cc1cnc(cn1)c2cc3ccccc3[nH]2 271570a_100010206980_100011999403 [0,1,0,0,0,1|2,0,0]=4 1559 B18R3.30705 Cc1cnc(cn1)c2nc3ccccc3s2 271570a_200000082171_100011999403 [0,1,0,0,0,1|2,0,0]=4 1560 B18R3.30705 Cc1cnc(nc1)c2cc3ccccc3[nH]2 271570a_100010206980_100011825175 [0,1,0,0,0,1|2,0,0]=4 1561 B18R3.30705 Cc1cnc(nc1)c2nc3ccccc3s2 271570a_200000082171_100011825175 [0,1,0,0,0,1|2,0,0]=4 1562 B18R3.30705 Cc1ncc(cn1)c2nc3ccccc3[nH]2 271570a_100010255633_100009814255 [0,1,0,0,0,1|1,0,1]=4 1563 B18R3.30705 Clc1ccc(cc1)c2nc3ccccc3[nH]2 271570a_100011213355_100009814255 [0,1,0,0,0,1|2,0,0]=4 1564 B18R3.30705 Clc1ccc(cn1)c2cc3ccccc3[nH]2 271570a_100000037156_100010232065 [0,1,0,0,0,1|2,0,0]=4 1565 B18R3.30705 Clc1ccc(cn1)c2cc3ccccc3[nH]2 271570a_100010206980_100000034144 [0,1,0,0,0,1|2,0,0]=4 1566 B18R3.30705 Clc1ccc(cn1)c2nc3ccccc3[nH]2 271570a_100000037156_100009814255 [0,1,0,0,0,1|1,0,0]=3 1567 B18R3.30705 Clc1ccc(cn1)c2nc3ccccc3s2 271570a_100000037156_100000751744 [0,1,0,0,0,1|2,0,0]=4 1568 B18R3.30705 Clc1ccc(cn1)c2nc3ccccc3s2 271570a_200000082171_100000034144 [0,1,0,0,0,1|2,0,0]=4 1569 B18R3.30705 Clc1ccc(nc1)c2cc3ccccc3[nH]2 271570a_100010206980_100011356976 [0,1,0,0,0,1|2,0,0]=4 1570 B18R3.30705 Clc1ccc(nc1)c2cc3ccccc3[nH]2 271570a_200000049369_100010232065 [0,1,0,0,0,1|2,0,0]=4 1571 B18R3.30705 Clc1ccc(nc1)c2nc3ccccc3[nH]2 271570a_200000049369_100009814255 [0,1,0,0,0,1|1,0,0]=3 1572 B18R3.30705 Clc1ccc(nc1)c2nc3ccccc3s2 271570a_200000049369_100000751744 [0,1,0,0,0,1|2,0,0]=4 1573 B18R3.30705 Clc1ccc(nc1)c2nc3ccccc3s2 271570a_200000082171_100011356976 [0,1,0,0,0,1|2,0,0]=4 1574 B18R3.30705 Clc1cnc(nc1)c2cc3ccccc3[nH]2 271570a_100010206980_100011356929 [0,1,0,0,0,1|2,0,0]=4 1575 B18R3.30705 Clc1cnc(nc1)c2nc3ccccc3s2 271570a_200000082171_100011356929 [0,1,0,0,0,1|2,0,0]=4 1576 B18R3.30705 Clc1ncc(cn1)c2nc3ccccc3[nH]2 271570a_100000087307_100009814255 [0,1,0,0,0,1|1,0,1]=4 1577 B18R3.30705 Fc1ccc(cc1)c2nc3ccccc3[nH]2 271570a_100011934326_100009814255 [0,1,0,0,0,1|2,0,0]=4 1578 B18R3.30705 Fc1ccc(cn1)c2cc3ccccc3[nH]2 271570a_100000041719_100010232065 [0,1,0,0,0,1|2,0,0]=4 1579 B18R3.30705 Fc1ccc(cn1)c2cc3ccccc3[nH]2 271570a_100010206980_100000748661 [0,1,0,0,0,1|2,0,0]=4 1580 B18R3.30705 Fc1ccc(cn1)c2nc3ccccc3[nH]2 271570a_100000041719_100009814255 [0,1,0,0,0,1|1,0,0]=3 1581 B18R3.30705 Fc1ccc(cn1)c2nc3ccccc3s2 271570a_100000041719_100000751744 [0,1,0,0,0,1|2,0,0]=4 1582 B18R3.30705 Fc1ccc(cn1)c2nc3ccccc3s2 271570a_200000082171_100000748661 [0,1,0,0,0,1|2,0,0]=4 1583 B18R3.30705 Fc1ccc(nc1)c2cc3ccccc3[nH]2 271570a_100000117362_100010232065 [0,1,0,0,0,1|2,0,0]=4 1584 B18R3.30705 Fc1ccc(nc1)c2cc3ccccc3[nH]2 271570a_100010206980_100000744514 [0,1,0,0,0,1|2,0,0]=4 1585 B18R3.30705 Fc1ccc(nc1)c2nc3ccccc3[nH]2 271570a_100000117362_100009814255 [0,1,0,0,0,1|1,0,0]=3 1586 B18R3.30705 Fc1ccc(nc1)c2nc3ccccc3s2 271570a_100000117362_100000751744 [0,1,0,0,0,1|2,0,0]=4 1587 B18R3.30705 Fc1ccc(nc1)c2nc3ccccc3s2 271570a_200000082171_100000744514 [0,1,0,0,0,1|2,0,0]=4 1588 B18R3.30705 Fc1cnc(cn1)c2cc3ccccc3[nH]2 271570a_100010206980_100009856528 [0,1,0,0,0,1|2,0,0]=4 1589 B18R3.30705 Fc1cnc(cn1)c2nc3ccccc3s2 271570a_200000082171_100009856528 [0,1,0,0,0,1|2,0,0]=4 1590 B18R3.30705 Fc1cnc(nc1)c2cc3ccccc3[nH]2 271570a_100010206980_100000685220 [0,1,0,0,0,1|2,0,0]=4 1591 B18R3.30705 Fc1cnc(nc1)c2nc3ccccc3s2 271570a_200000082171_100000685220 [0,1,0,0,0,1|2,0,0]=4 1592 B18R3.30705 Fc1ncc(cn1)c2nc3ccccc3[nH]2 271570a_100010172013_100009814255 [0,1,0,0,0,1|1,0,1]=4 1593 B18R3.30705 Ic1ccc(cc1)c2nc3ccccc3[nH]2 271570a_100000033156_100009814255 [0,1,0,0,0,1|2,0,0]=4 1594 B18R3.30705 Nc1ccc(cc1)c2nc3ccccc3[nH]2 271570a_100015188457_100009814255 [0,1,0,0,0,1|2,0,0]=4 1595 B18R3.30705 Nc1ccc(cn1)c2cc3ccccc3[nH]2 271570a_100000062249_100010232065 [0,1,0,0,0,1|2,0,0]=4 1596 B18R3.30705 Nc1ccc(cn1)c2cc3ccccc3[nH]2 271570a_100010206980_100000187370 [0,1,0,0,0,1|2,0,0]=4 1597 B18R3.30705 Nc1ccc(cn1)c2nc3ccccc3[nH]2 271570a_100000062249_100009814255 [0,1,0,0,0,1|1,0,0]=3 1598 B18R3.30705 Nc1ccc(cn1)c2nc3ccccc3s2 271570a_100000062249_100000751744 [0,1,0,0,0,1|2,0,0]=4 1599 B18R3.30705 Nc1ccc(cn1)c2nc3ccccc3s2 271570a_200000082171_100000187370 [0,1,0,0,0,1|2,0,0]=4 1600 B18R3.30705 Nc1ccc(nc1)c2cc3ccccc3[nH]2 271570a_100010206980_100000744251 [0,1,0,0,0,1|2,0,0]=4 1601 B18R3.30705 Nc1ccc(nc1)c2nc3ccccc3s2 271570a_200000082171_100000744251 [0,1,0,0,0,1|2,0,0]=4 1602 B18R3.30705 Nc1ccc(nn1)c2cc3ccccc3[nH]2 271570a_100010206980_100009816609 [0,1,0,0,0,1|1,0,1]=4 1603 B18R3.30705 Nc1ccc(nn1)c2nc3ccccc3s2 271570a_200000082171_100009816609 [0,1,0,0,0,1|1,0,1]=4 1604 B18R3.30705 Nc1cnc(cn1)c2cc3ccccc3[nH]2 271570a_100010206980_100000761932 [0,1,0,0,0,1|2,0,0]=4 1605 B18R3.30705 Nc1cnc(cn1)c2nc3ccccc3s2 271570a_200000082171_100000761932 [0,1,0,0,0,1|2,0,0]=4 1606 B18R3.30705 Nc1cnc(nc1)c2cc3ccccc3[nH]2 271570a_100010206980_100000068403 [0,1,0,0,0,1|2,0,0]=4 1607 B18R3.30705 Nc1cnc(nc1)c2nc3ccccc3s2 271570a_200000082171_100000068403 [0,1,0,0,0,1|2,0,0]=4 1608 B18R3.30705 Nc1ncc(cn1)c2nc3ccccc3[nH]2 271570a_100000068091_100009814255 [0,1,0,0,0,1|1,0,1]=4 1609 B18R3.30705 Nc1ncc(nn1)c2cc3ccccc3[nH]2 271570a_100010206980_100000691435 [0,1,0,0,0,1|1,0,1]=4 1610 B18R3.30705 Nc1ncc(nn1)c2nc3ccccc3s2 271570a_200000082171_100000691435 [0,1,0,0,0,1|1,0,1]=4 1611 B18R3.30705 O=c1ccc(c[nH]1)c2cc3ccccc3[nH]2 271570a_100010206980_100000212171 [0,1,0,0,0,1|2,0,0]=4 1612 B18R3.30705 O=c1ccc(c[nH]1)c2nc3ccccc3s2 271570a_200000082171_100000212171 [0,1,0,0,0,1|2,0,0]=4 1613 B18R3.30705 O=c1ccc(n[nH]1)C2=Cc3ccccc3C2 271570a_100010239756_100009820020 [0,1,0,0,0,1|2,0,0]=4 1614 B18R3.30705 O=c1ccc(n[nH]1)c2cc3ccccc3[nH]2 271570a_100010206980_100009820020 [0,1,0,0,0,1|1,0,0]=3 1615 B18R3.30705 O=c1ccc(n[nH]1)c2cc3ccccc3o2 271570a_100011328764_100009820020 [0,1,0,0,0,1|2,0,0]=4 1616 B18R3.30705 O=c1ccc(n[nH]1)c2cc3ccccc3s2 271570a_100000034353_100009820020 [0,1,0,0,0,1|2,0,0]=4 1617 B18R3.30705 O=c1ccc(n[nH]1)c2nc3ccccc3s2 271570a_200000082171_100009820020 [0,1,0,0,0,1|1,0,0]=3 1618 B18R3.30705 O=c1ncc(c[nH]1)c2cc3ccccc3[nH]2 271570a_100000079150_100010232065 [0,1,0,0,0,1|2,0,0]=4 1619 B18R3.30705 O=c1ncc(c[nH]1)c2cc3ccccc3[nH]2 271570a_100010206980_102495366499 [0,1,0,0,0,1|2,0,0]=4 1620 B18R3.30705 O=c1ncc(c[nH]1)c2nc3ccccc3[nH]2 271570a_100000079150_100009814255 [0,1,0,0,0,1|1,0,0]=3 1621 B18R3.30705 O=c1ncc(c[nH]1)c2nc3ccccc3s2 271570a_100000079150_100000751744 [0,1,0,0,0,1|2,0,0]=4 1622 B18R3.30705 O=c1ncc(c[nH]1)c2nc3ccccc3s2 271570a_200000082171_102495366499 [0,1,0,0,0,1|2,0,0]=4 1623 B18R3.30705 Oc1ccc(cc1)c2nc3ccccc3[nH]2 271570a_100015205159_100009814255 [0,1,0,0,0,1|2,0,0]=4 1624 B18R3.30705 Oc1ccc(cc1)c2nc3ccccc3[nH]2 271570a_203496583355_100000258273 [0,1,0,0,0,1|2,0,0]=4 1625 B18R3.30705 Oc1ccc(cn1)c2cc3ccccc3[nH]2 271570a_100000062254_100010232065 [0,1,0,0,0,1|2,0,0]=4 1626 B18R3.30705 Oc1ccc(cn1)c2nc3ccccc3[nH]2 271570a_100000062254_100009814255 [0,1,0,0,0,1|1,0,0]=3 1627 B18R3.30705 Oc1ccc(cn1)c2nc3ccccc3s2 271570a_100000062254_100000751744 [0,1,0,0,0,1|2,0,0]=4 1628 B18R3.30705 Oc1ccc(nc1)c2cc3ccccc3[nH]2 271570a_100010206980_100000685995 [0,1,0,0,0,1|2,0,0]=4 1629 B18R3.30705 Oc1ccc(nc1)c2nc3ccccc3s2 271570a_200000082171_100000685995 [0,1,0,0,0,1|2,0,0]=4 1630 B18R3.30705 Oc1cnc(nc1)c2cc3ccccc3[nH]2 271570a_100010206980_100000730009 [0,1,0,0,0,1|2,0,0]=4 1631 B18R3.30705 Oc1cnc(nc1)c2nc3ccccc3s2 271570a_200000082171_100000730009 [0,1,0,0,0,1|2,0,0]=4 1632 B18R3.31677 Brc1cccc(n1)c2cc3ccccc3[nH]2 271570a_100010206980_100000684672 [0,1,0,0,0,1|2,0,0]=4 1633 B18R3.31677 Brc1cccc(n1)c2nc3ccccc3s2 271570a_200000082171_100000684672 [0,1,0,0,0,1|2,0,0]=4 1634 B18R3.31677 Brc1cncc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_100000728054 [0,1,0,0,0,1|2,0,0]=4 1635 B18R3.31677 Brc1cncc(c1)c2cc3ccccc3[nH]2 271570a_200009814628_100010232065 [0,1,0,0,0,1|2,0,0]=4 1636 B18R3.31677 Brc1cncc(c1)c2nc3ccccc3[nH]2 271570a_200009814628_100009814255 [0,1,0,0,0,1|1,0,0]=3 1637 B18R3.31677 Brc1cncc(c1)c2nc3ccccc3s2 271570a_200000082171_100000728054 [0,1,0,0,0,1|2,0,0]=4 1638 B18R3.31677 Brc1cncc(c1)c2nc3ccccc3s2 271570a_200009814628_100000751744 [0,1,0,0,0,1|2,0,0]=4 1639 B18R3.31677 Cc1cc(ccn1)c2nc3ccccc3[nH]2 271570a_100011830414_100009814255 [0,1,0,0,0,1|1,0,1]=4 1640 B18R3.31677 Cc1cc(cnn1)c2cc3ccccc3[nH]2 271570a_100010138862_100010232065 [0,1,0,0,0,1|1,0,1]=4 1641 B18R3.31677 Cc1cc(cnn1)c2nc3ccccc3[nH]2 271570a_100010138862_100009814255 [0,1,0,0,0,1|0,0,1]=3 1642 B18R3.31677 Cc1cc(cnn1)c2nc3ccccc3s2 271570a_100010138862_100000751744 [0,1,0,0,0,1|1,0,1]=4 1643 B18R3.31677 Cc1cc(ncn1)c2cc3ccccc3[nH]2 271570a_100010206980_100000744208 [0,1,0,0,0,1|1,0,1]=4 1644 B18R3.31677 Cc1cc(ncn1)c2nc3ccccc3s2 271570a_200000082171_100000744208 [0,1,0,0,0,1|1,0,1]=4 1645 B18R3.31677 Cc1cccc(c1)c2nc3ccccc3[nH]2 271570a_100000749446_100009814255 [0,1,0,0,0,1|2,0,0]=4 1646 B18R3.31677 Cc1cccc(n1)c2cc3ccccc3[nH]2 271570a_100000046275_100010232065 [0,1,0,0,0,1|2,0,0]=4 1647 B18R3.31677 Cc1cccc(n1)c2cc3ccccc3[nH]2 271570a_100010206980_100000742759 [0,1,0,0,0,1|2,0,0]=4 1648 B18R3.31677 Cc1cccc(n1)c2nc3ccccc3[nH]2 271570a_100000046275_100009814255 [0,1,0,0,0,1|1,0,0]=3 1649 B18R3.31677 Cc1cccc(n1)c2nc3ccccc3s2 271570a_100000046275_100000751744 [0,1,0,0,0,1|2,0,0]=4 1650 B18R3.31677 Cc1cccc(n1)c2nc3ccccc3s2 271570a_200000082171_100000742759 [0,1,0,0,0,1|2,0,0]=4 1651 B18R3.31677 Cc1ccnc(c1)c2cc3ccccc3[nH]2 271570a_100000049243_100010232065 [0,1,0,0,0,1|2,0,0]=4 1652 B18R3.31677 Cc1ccnc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_100000750283 [0,1,0,0,0,1|2,0,0]=4 1653 B18R3.31677 Cc1ccnc(c1)c2nc3ccccc3[nH]2 271570a_100000049243_100009814255 [0,1,0,0,0,1|1,0,0]=3 1654 B18R3.31677 Cc1ccnc(c1)c2nc3ccccc3s2 271570a_100000049243_100000751744 [0,1,0,0,0,1|2,0,0]=4 1655 B18R3.31677 Cc1ccnc(c1)c2nc3ccccc3s2 271570a_200000082171_100000750283 [0,1,0,0,0,1|2,0,0]=4 1656 B18R3.31677 Cc1ccnc(n1)c2cc3ccccc3[nH]2 271570a_100010206980_100011243806 [0,1,0,0,0,1|2,0,0]=4 1657 B18R3.31677 Cc1ccnc(n1)c2nc3ccccc3s2 271570a_200000082171_100011243806 [0,1,0,0,0,1|2,0,0]=4 1658 B18R3.31677 Cc1cncc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_100000760492 [0,1,0,0,0,1|2,0,0]=4 1659 B18R3.31677 Cc1cncc(c1)c2cc3ccccc3[nH]2 271570a_100012355712_100010232065 [0,1,0,0,0,1|2,0,0]=4 1660 B18R3.31677 Cc1cncc(c1)c2nc3ccccc3[nH]2 271570a_100012355712_100009814255 [0,1,0,0,0,1|1,0,0]=3 1661 B18R3.31677 Cc1cncc(c1)c2nc3ccccc3s2 271570a_100012355712_100000751744 [0,1,0,0,0,1|2,0,0]=4 1662 B18R3.31677 Cc1cncc(c1)c2nc3ccccc3s2 271570a_200000082171_100000760492 [0,1,0,0,0,1|2,0,0]=4 1663 B18R3.31677 Cc1cncc(n1)c2cc3ccccc3[nH]2 271570a_100010206980_100009842155 [0,1,0,0,0,1|2,0,0]=4 1664 B18R3.31677 Cc1cncc(n1)c2nc3ccccc3s2 271570a_200000082171_100009842155 [0,1,0,0,0,1|2,0,0]=4 1665 B18R3.31677 Cc1cnnc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_100000070100 [0,1,0,0,0,1|1,0,1]=4 1666 B18R3.31677 Cc1cnnc(c1)c2nc3ccccc3s2 271570a_200000082171_100000070100 [0,1,0,0,0,1|1,0,1]=4 1667 B18R3.31677 Cc1nccc(n1)c2cc3ccccc3[nH]2 271570a_100010206980_100000749937 [0,1,0,0,0,1|1,0,1]=4 1668 B18R3.31677 Cc1nccc(n1)c2nc3ccccc3s2 271570a_200000082171_100000749937 [0,1,0,0,0,1|1,0,1]=4 1669 B18R3.31677 Clc1cc(ccn1)c2nc3ccccc3[nH]2 271570a_100000049459_100009814255 [0,1,0,0,0,1|1,0,1]=4 1670 B18R3.31677 Clc1cccc(c1)c2nc3ccccc3[nH]2 271570a_100011214927_100009814255 [0,1,0,0,0,1|2,0,0]=4 1671 B18R3.31677 Clc1cccc(n1)c2cc3ccccc3[nH]2 271570a_100000062326_100010232065 [0,1,0,0,0,1|2,0,0]=4 1672 B18R3.31677 Clc1cccc(n1)c2nc3ccccc3[nH]2 271570a_100000062326_100009814255 [0,1,0,0,0,1|1,0,0]=3 1673 B18R3.31677 Clc1cccc(n1)c2nc3ccccc3s2 271570a_100000062326_100000751744 [0,1,0,0,0,1|2,0,0]=4 1674 B18R3.31677 Clc1ccnc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_100010167805 [0,1,0,0,0,1|2,0,0]=4 1675 B18R3.31677 Clc1ccnc(c1)c2nc3ccccc3s2 271570a_200000082171_100010167805 [0,1,0,0,0,1|2,0,0]=4 1676 B18R3.31677 Clc1cncc(c1)c2cc3ccccc3[nH]2 271570a_100000049213_100010232065 [0,1,0,0,0,1|2,0,0]=4 1677 B18R3.31677 Clc1cncc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_100000049639 [0,1,0,0,0,1|2,0,0]=4 1678 B18R3.31677 Clc1cncc(c1)c2nc3ccccc3[nH]2 271570a_100000049213_100009814255 [0,1,0,0,0,1|1,0,0]=3 1679 B18R3.31677 Clc1cncc(c1)c2nc3ccccc3s2 271570a_100000049213_100000751744 [0,1,0,0,0,1|2,0,0]=4 1680 B18R3.31677 Clc1cncc(c1)c2nc3ccccc3s2 271570a_200000082171_100000049639 [0,1,0,0,0,1|2,0,0]=4 1681 B18R3.31677 Fc1cc(ccn1)c2nc3ccccc3[nH]2 271570a_100000062321_100009814255 [0,1,0,0,0,1|1,0,1]=4 1682 B18R3.31677 Fc1cc(ncn1)c2cc3ccccc3[nH]2 271570a_100010206980_200009880791 [0,1,0,0,0,1|1,0,1]=4 1683 B18R3.31677 Fc1cc(ncn1)c2nc3ccccc3s2 271570a_200000082171_200009880791 [0,1,0,0,0,1|1,0,1]=4 1684 B18R3.31677 Fc1cccc(c1)c2nc3ccccc3[nH]2 271570a_100012349223_100009814255 [0,1,0,0,0,1|2,0,0]=4 1685 B18R3.31677 Fc1cccc(n1)c2cc3ccccc3[nH]2 271570a_100000090185_100010232065 [0,1,0,0,0,1|2,0,0]=4 1686 B18R3.31677 Fc1cccc(n1)c2cc3ccccc3[nH]2 271570a_100010206980_100009815982 [0,1,0,0,0,1|2,0,0]=4 1687 B18R3.31677 Fc1cccc(n1)c2nc3ccccc3[nH]2 271570a_100000090185_100009814255 [0,1,0,0,0,1|1,0,0]=3 1688 B18R3.31677 Fc1cccc(n1)c2nc3ccccc3s2 271570a_100000090185_100000751744 [0,1,0,0,0,1|2,0,0]=4 1689 B18R3.31677 Fc1cccc(n1)c2nc3ccccc3s2 271570a_200000082171_100009815982 [0,1,0,0,0,1|2,0,0]=4 1690 B18R3.31677 Fc1ccnc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_100009817058 [0,1,0,0,0,1|2,0,0]=4 1691 B18R3.31677 Fc1ccnc(c1)c2cc3ccccc3[nH]2 271570a_200000087102_100010232065 [0,1,0,0,0,1|2,0,0]=4 1692 B18R3.31677 Fc1ccnc(c1)c2nc3ccccc3[nH]2 271570a_200000087102_100009814255 [0,1,0,0,0,1|1,0,0]=3 1693 B18R3.31677 Fc1ccnc(c1)c2nc3ccccc3s2 271570a_200000082171_100009817058 [0,1,0,0,0,1|2,0,0]=4 1694 B18R3.31677 Fc1ccnc(c1)c2nc3ccccc3s2 271570a_200000087102_100000751744 [0,1,0,0,0,1|2,0,0]=4 1695 B18R3.31677 Fc1cncc(c1)c2cc3ccccc3[nH]2 271570a_100000757375_100010232065 [0,1,0,0,0,1|2,0,0]=4 1696 B18R3.31677 Fc1cncc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_100000744099 [0,1,0,0,0,1|2,0,0]=4 1697 B18R3.31677 Fc1cncc(c1)c2nc3ccccc3[nH]2 271570a_100000757375_100009814255 [0,1,0,0,0,1|1,0,0]=3 1698 B18R3.31677 Fc1cncc(c1)c2nc3ccccc3s2 271570a_100000757375_100000751744 [0,1,0,0,0,1|2,0,0]=4 1699 B18R3.31677 Fc1cncc(c1)c2nc3ccccc3s2 271570a_200000082171_100000744099 [0,1,0,0,0,1|2,0,0]=4 1700 B18R3.31677 Fc1cncc(n1)c2cc3ccccc3[nH]2 271570a_100010206980_200009863489 [0,1,0,0,0,1|2,0,0]=4 1701 B18R3.31677 Fc1cncc(n1)c2nc3ccccc3s2 271570a_200000082171_200009863489 [0,1,0,0,0,1|2,0,0]=4 1702 B18R3.31677 Ic1cccc(c1)c2nc3ccccc3[nH]2 271570a_100000043368_100009814255 [0,1,0,0,0,1|2,0,0]=4 1703 B18R3.31677 Nc1cc(ccn1)c2nc3ccccc3[nH]2 271570a_102125402725_100009814255 [0,1,0,0,0,1|1,0,1]=4 1704 B18R3.31677 Nc1cc(cnn1)c2cc3ccccc3[nH]2 271570a_100010206980_100000130277 [0,1,0,0,0,1|1,0,1]=4 1705 B18R3.31677 Nc1cc(cnn1)c2nc3ccccc3s2 271570a_200000082171_100000130277 [0,1,0,0,0,1|1,0,1]=4 1706 B18R3.31677 Nc1cc(ncn1)c2cc3ccccc3[nH]2 271570a_100010206980_100000701291 [0,1,0,0,0,1|1,0,1]=4 1707 B18R3.31677 Nc1cc(ncn1)c2nc3ccccc3s2 271570a_200000082171_100000701291 [0,1,0,0,0,1|1,0,1]=4 1708 B18R3.31677 Nc1cccc(c1)c2nc3ccccc3[nH]2 271570a_100000699968_100009814255 [0,1,0,0,0,1|2,0,0]=4 1709 B18R3.31677 Nc1cccc(n1)c2cc3ccccc3[nH]2 271570a_100010206980_100000740741 [0,1,0,0,0,1|2,0,0]=4 1710 B18R3.31677 Nc1cccc(n1)c2nc3ccccc3s2 271570a_200000082171_100000740741 [0,1,0,0,0,1|2,0,0]=4 1711 B18R3.31677 Nc1ccnc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_100009814236 [0,1,0,0,0,1|2,0,0]=4 1712 B18R3.31677 Nc1ccnc(c1)c2nc3ccccc3s2 271570a_200000082171_100009814236 [0,1,0,0,0,1|2,0,0]=4 1713 B18R3.31677 Nc1ccnc(n1)c2cc3ccccc3[nH]2 271570a_100010206980_100000757536 [0,1,0,0,0,1|2,0,0]=4 1714 B18R3.31677 Nc1ccnc(n1)c2nc3ccccc3s2 271570a_200000082171_100000757536 [0,1,0,0,0,1|2,0,0]=4 1715 B18R3.31677 Nc1cncc(c1)c2cc3ccccc3[nH]2 271570a_100000069896_100010232065 [0,1,0,0,0,1|2,0,0]=4 1716 B18R3.31677 Nc1cncc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_100000687067 [0,1,0,0,0,1|2,0,0]=4 1717 B18R3.31677 Nc1cncc(c1)c2nc3ccccc3[nH]2 271570a_100000069896_100009814255 [0,1,0,0,0,1|1,0,0]=3 1718 B18R3.31677 Nc1cncc(c1)c2nc3ccccc3s2 271570a_100000069896_100000751744 [0,1,0,0,0,1|2,0,0]=4 1719 B18R3.31677 Nc1cncc(c1)c2nc3ccccc3s2 271570a_200000082171_100000687067 [0,1,0,0,0,1|2,0,0]=4 1720 B18R3.31677 Nc1cncc(n1)c2cc3ccccc3[nH]2 271570a_100010206980_100009819714 [0,1,0,0,0,1|2,0,0]=4 1721 B18R3.31677 Nc1cncc(n1)c2nc3ccccc3s2 271570a_200000082171_100009819714 [0,1,0,0,0,1|2,0,0]=4 1722 B18R3.31677 Nc1nccc(n1)c2cc3ccccc3[nH]2 271570a_100010206980_100009820717 [0,1,0,0,0,1|1,0,1]=4 1723 B18R3.31677 Nc1nccc(n1)c2nc3ccccc3s2 271570a_200000082171_100009820717 [0,1,0,0,0,1|1,0,1]=4 1724 B18R3.31677 O=C1C=C(CCC1)c2nc3ccccc3[nH]2 271570a_100000723966_100009814255 [0,1,0,0,0,1|2,0,0]=4 1725 B18R3.31677 O=c1cc(cc[nH]1)c2cc3ccccc3[nH]2 271570a_100010206980_100009816521 [0,1,0,0,0,1|2,0,0]=4 1726 B18R3.31677 O=c1cc(cc[nH]1)c2nc3ccccc3s2 271570a_200000082171_100009816521 [0,1,0,0,0,1|2,0,0]=4 1727 B18R3.31677 O=c1cc(cn[nH]1)C2=Cc3ccccc3C2 271570a_100010239756_100010197405 [0,1,0,0,0,1|2,0,0]=4 1728 B18R3.31677 O=c1cc(cn[nH]1)c2cc3ccccc3[nH]2 271570a_100010206980_100010197405 [0,1,0,0,0,1|1,0,0]=3 1729 B18R3.31677 O=c1cc(cn[nH]1)c2cc3ccccc3o2 271570a_100011328764_100010197405 [0,1,0,0,0,1|2,0,0]=4 1730 B18R3.31677 O=c1cc(cn[nH]1)c2cc3ccccc3s2 271570a_100000034353_100010197405 [0,1,0,0,0,1|2,0,0]=4 1731 B18R3.31677 O=c1cc(cn[nH]1)c2nc3ccccc3s2 271570a_200000082171_100010197405 [0,1,0,0,0,1|1,0,0]=3 1732 B18R3.31677 O=c1nc(cc[nH]1)C2=Cc3ccccc3C2 271570a_100010239756_200000134032 [0,1,0,0,0,1|2,0,0]=4 1733 B18R3.31677 O=c1nc(cc[nH]1)c2cc3ccccc3[nH]2 271570a_100010206980_200000134032 [0,1,0,0,0,1|1,0,0]=3 1734 B18R3.31677 O=c1nc(cc[nH]1)c2cc3ccccc3o2 271570a_100011328764_200000134032 [0,1,0,0,0,1|2,0,0]=4 1735 B18R3.31677 O=c1nc(cc[nH]1)c2cc3ccccc3s2 271570a_100000034353_200000134032 [0,1,0,0,0,1|2,0,0]=4 1736 B18R3.31677 O=c1nc(cc[nH]1)c2nc3ccccc3s2 271570a_200000082171_200000134032 [0,1,0,0,0,1|1,0,0]=3 1737 B18R3.31677 Oc1cc(ccn1)c2nc3ccccc3[nH]2 271570a_100010237957_100009814255 [0,1,0,0,0,1|1,0,1]=4 1738 B18R3.31677 Oc1cc(ncn1)c2cc3ccccc3[nH]2 271570a_100010206980_100000765262 [0,1,0,0,0,1|1,0,1]=4 1739 B18R3.31677 Oc1cc(ncn1)c2nc3ccccc3s2 271570a_200000082171_100000765262 [0,1,0,0,0,1|1,0,1]=4 1740 B18R3.31677 Oc1cccc(c1)c2nc3ccccc3[nH]2 271570a_100000693801_100009814255 [0,1,0,0,0,1|2,0,0]=4 1741 B18R3.31677 Oc1cccc(n1)c2cc3ccccc3[nH]2 271570a_100010195584_100010232065 [0,1,0,0,0,1|2,0,0]=4 1742 B18R3.31677 Oc1cccc(n1)c2nc3ccccc3[nH]2 271570a_100010195584_100009814255 [0,1,0,0,0,1|1,0,0]=3 1743 B18R3.31677 Oc1cccc(n1)c2nc3ccccc3s2 271570a_100010195584_100000751744 [0,1,0,0,0,1|2,0,0]=4 1744 B18R3.31677 Oc1ccnc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_100000762945 [0,1,0,0,0,1|2,0,0]=4 1745 B18R3.31677 Oc1ccnc(c1)c2nc3ccccc3s2 271570a_200000082171_100000762945 [0,1,0,0,0,1|2,0,0]=4 1746 B18R3.31677 Oc1ccnc(n1)c2cc3ccccc3[nH]2 271570a_100010206980_100011649813 [0,1,0,0,0,1|2,0,0]=4 1747 B18R3.31677 Oc1ccnc(n1)c2nc3ccccc3s2 271570a_200000082171_100011649813 [0,1,0,0,0,1|2,0,0]=4 1748 B18R3.31677 Oc1cncc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_100000754920 [0,1,0,0,0,1|2,0,0]=4 1749 B18R3.31677 Oc1cncc(c1)c2cc3ccccc3[nH]2 271570a_100010248756_100010232065 [0,1,0,0,0,1|2,0,0]=4 1750 B18R3.31677 Oc1cncc(c1)c2nc3ccccc3[nH]2 271570a_100010248756_100009814255 [0,1,0,0,0,1|1,0,0]=3 1751 B18R3.31677 Oc1cncc(c1)c2nc3ccccc3s2 271570a_100010248756_100000751744 [0,1,0,0,0,1|2,0,0]=4 1752 B18R3.31677 Oc1cncc(c1)c2nc3ccccc3s2 271570a_200000082171_100000754920 [0,1,0,0,0,1|2,0,0]=4 1753 B18R3.31677 Oc1cncc(n1)c2cc3ccccc3[nH]2 271570a_100010206980_100011269956 [0,1,0,0,0,1|2,0,0]=4 1754 B18R3.31677 Oc1cncc(n1)c2nc3ccccc3s2 271570a_200000082171_100011269956 [0,1,0,0,0,1|2,0,0]=4 1755 B18R3.31677 Oc1cnnc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_200010734679 [0,1,0,0,0,1|1,0,1]=4 1756 B18R3.31677 Oc1cnnc(c1)c2nc3ccccc3s2 271570a_200000082171_200010734679 [0,1,0,0,0,1|1,0,1]=4 1757 B18R3.31677 [O-][n+]1ccnc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_100009880115 [0,1,0,0,0,1|2,0,0]=4 1758 B18R3.31677 [O-][n+]1ccnc(c1)c2nc3ccccc3s2 271570a_200000082171_100009880115 [0,1,0,0,0,1|2,0,0]=4 1759 B18R3.32722 Brc1ccc2[nH]c(cc2c1)c3ccccn3 271570a_100011264011_100011012855 [0,1,0,0,0,1|2,0,0]=4 1760 B18R3.32722 Brc1ccc2[nH]c(cc2c1)c3cccnc3 271570a_100000757648_100011012855 [0,1,0,0,0,1|2,0,0]=4 1761 B18R3.32722 Brc1ccc2[nH]c(cc2c1)c3cnccn3 271570a_100011962566_100011012855 [0,1,0,0,0,1|2,0,0]=4 1762 B18R3.32722 Brc1ccc2cc([nH]c2c1)c3ccccn3 271570a_200010246288_100011216584 [0,1,0,0,0,1|2,0,0]=4 1763 B18R3.32722 Brc1ccc2cc([nH]c2c1)c3cccnc3 271570a_200010246288_100000752921 [0,1,0,0,0,1|2,0,0]=4 1764 B18R3.32722 Brc1ccc2cc([nH]c2c1)c3cccnn3 271570a_200010246288_100016991348 [0,1,0,0,0,1|1,0,1]=4 1765 B18R3.32722 Brc1ccc2cc([nH]c2c1)c3ccncn3 271570a_200010246288_100000703185 [0,1,0,0,0,1|1,0,1]=4 1766 B18R3.32722 Brc1ccc2cc([nH]c2c1)c3ccnnc3 271570a_200010246288_100000732662 [0,1,0,0,0,1|1,0,1]=4 1767 B18R3.32722 Brc1ccc2cc([nH]c2c1)c3cnccn3 271570a_200010246288_100000758340 [0,1,0,0,0,1|2,0,0]=4 1768 B18R3.32722 Brc1ccc2cc([nH]c2c1)c3ncccn3 271570a_200010246288_100000211032 [0,1,0,0,0,1|2,0,0]=4 1769 B18R3.32722 Cc1ccc2cc([nH]c2c1)c3ccccn3 271570a_100010246276_100011216584 [0,1,0,0,0,1|2,0,0]=4 1770 B18R3.32722 Cc1ccc2cc([nH]c2c1)c3cccnc3 271570a_100010246276_100000752921 [0,1,0,0,0,1|2,0,0]=4 1771 B18R3.32722 Cc1ccc2cc([nH]c2c1)c3cccnn3 271570a_100010246276_100016991348 [0,1,0,0,0,1|1,0,1]=4 1772 B18R3.32722 Cc1ccc2cc([nH]c2c1)c3ccncn3 271570a_100010246276_100000703185 [0,1,0,0,0,1|1,0,1]=4 1773 B18R3.32722 Cc1ccc2cc([nH]c2c1)c3ccnnc3 271570a_100010246276_100000732662 [0,1,0,0,0,1|1,0,1]=4 1774 B18R3.32722 Cc1ccc2cc([nH]c2c1)c3cnccn3 271570a_100010246276_100000758340 [0,1,0,0,0,1|2,0,0]=4 1775 B18R3.32722 Cc1ccc2cc([nH]c2c1)c3ncccn3 271570a_100010246276_100000211032 [0,1,0,0,0,1|2,0,0]=4 1776 B18R3.32722 Cc1ccc2nc(sc2c1)c3ccccn3 271570a_100011264011_100010186437 [0,1,0,0,0,1|2,0,0]=4 1777 B18R3.32722 Cc1ccc2nc(sc2c1)c3cccnc3 271570a_100000757648_100010186437 [0,1,0,0,0,1|2,0,0]=4 1778 B18R3.32722 Cc1ccc2nc(sc2c1)c3cnccn3 271570a_100011962566_100010186437 [0,1,0,0,0,1|2,0,0]=4 1779 B18R3.32722 Clc1ccc2[nH]c(cc2c1)c3ccccn3 271570a_100010246260_100011216584 [0,1,0,0,0,1|2,0,0]=4 1780 B18R3.32722 Clc1ccc2[nH]c(cc2c1)c3cccnc3 271570a_100010246260_100000752921 [0,1,0,0,0,1|2,0,0]=4 1781 B18R3.32722 Clc1ccc2[nH]c(cc2c1)c3cccnn3 271570a_100010246260_100016991348 [0,1,0,0,0,1|1,0,1]=4 1782 B18R3.32722 Clc1ccc2[nH]c(cc2c1)c3ccncn3 271570a_100010246260_100000703185 [0,1,0,0,0,1|1,0,1]=4 1783 B18R3.32722 Clc1ccc2[nH]c(cc2c1)c3ccnnc3 271570a_100010246260_100000732662 [0,1,0,0,0,1|1,0,1]=4 1784 B18R3.32722 Clc1ccc2[nH]c(cc2c1)c3cnccn3 271570a_100010246260_100000758340 [0,1,0,0,0,1|2,0,0]=4 1785 B18R3.32722 Clc1ccc2[nH]c(cc2c1)c3ncccn3 271570a_100010246260_100000211032 [0,1,0,0,0,1|2,0,0]=4 1786 B18R3.32722 Fc1ccc2[nH]c(cc2c1)c3ccccn3 271570a_100010246264_100011216584 [0,1,0,0,0,1|2,0,0]=4 1787 B18R3.32722 Fc1ccc2[nH]c(cc2c1)c3cccnc3 271570a_100010246264_100000752921 [0,1,0,0,0,1|2,0,0]=4 1788 B18R3.32722 Fc1ccc2[nH]c(cc2c1)c3cccnn3 271570a_100010246264_100016991348 [0,1,0,0,0,1|1,0,1]=4 1789 B18R3.32722 Fc1ccc2[nH]c(cc2c1)c3ccncn3 271570a_100010246264_100000703185 [0,1,0,0,0,1|1,0,1]=4 1790 B18R3.32722 Fc1ccc2[nH]c(cc2c1)c3ccnnc3 271570a_100010246264_100000732662 [0,1,0,0,0,1|1,0,1]=4 1791 B18R3.32722 Fc1ccc2[nH]c(cc2c1)c3cnccn3 271570a_100010246264_100000758340 [0,1,0,0,0,1|2,0,0]=4 1792 B18R3.32722 Fc1ccc2[nH]c(cc2c1)c3ncccn3 271570a_100010246264_100000211032 [0,1,0,0,0,1|2,0,0]=4 1793 B18R3.32722 Fc1ccc2nc(sc2c1)c3ccccn3 271570a_100011264011_100000751617 [0,1,0,0,0,1|2,0,0]=4 1794 B18R3.32722 Fc1ccc2nc(sc2c1)c3cccnc3 271570a_100000757648_100000751617 [0,1,0,0,0,1|2,0,0]=4 1795 B18R3.32722 Fc1ccc2nc(sc2c1)c3cnccn3 271570a_100011962566_100000751617 [0,1,0,0,0,1|2,0,0]=4 1796 B18R3.32722 Fc1ccc2sc(nc2c1)c3ccccn3 271570a_100011264011_200010206605 [0,1,0,0,0,1|2,0,0]=4 1797 B18R3.32722 Fc1ccc2sc(nc2c1)c3cccnc3 271570a_100000757648_200010206605 [0,1,0,0,0,1|2,0,0]=4 1798 B18R3.32722 Fc1ccc2sc(nc2c1)c3cnccn3 271570a_100011962566_200010206605 [0,1,0,0,0,1|2,0,0]=4 1799 B18R3.32722 Nc1ccc2nc(sc2c1)c3ccccn3 271570a_100011264011_100010253933 [0,1,0,0,0,1|2,0,0]=4 1800 B18R3.32722 Nc1ccc2nc(sc2c1)c3cccnc3 271570a_100000757648_100010253933 [0,1,0,0,0,1|2,0,0]=4 1801 B18R3.32722 Nc1ccc2nc(sc2c1)c3cnccn3 271570a_100011962566_100010253933 [0,1,0,0,0,1|2,0,0]=4 1802 B18R3.32722 Nc1ccc2sc(nc2c1)c3ccccn3 271570a_100011264011_100010329861 [0,1,0,0,0,1|2,0,0]=4 1803 B18R3.32722 Nc1ccc2sc(nc2c1)c3cccnc3 271570a_100000757648_100010329861 [0,1,0,0,0,1|2,0,0]=4 1804 B18R3.32722 Nc1ccc2sc(nc2c1)c3cnccn3 271570a_100011962566_100010329861 [0,1,0,0,0,1|2,0,0]=4 1805 B18R3.32722 Oc1ccc2[nH]c(nc2c1)c3ccccc3 271570a_203496583355_200005897884 [0,1,0,0,0,1|2,0,0]=4 1806 B18R3.32722 Oc1ccc2nc(sc2c1)c3ccccn3 271570a_100011264011_100010063415 [0,1,0,0,0,1|2,0,0]=4 1807 B18R3.32722 Oc1ccc2nc(sc2c1)c3cccnc3 271570a_100000757648_100010063415 [0,1,0,0,0,1|2,0,0]=4 1808 B18R3.32722 Oc1ccc2nc(sc2c1)c3cnccn3 271570a_100011962566_100010063415 [0,1,0,0,0,1|2,0,0]=4 1809 B18R3.47120 Brc1cccnc1c2cc3ccccc3[nH]2 271570a_100010206980_100000696092 [0,1,0,0,0,1|2,0,0]=4 1810 B18R3.47120 Brc1cccnc1c2nc3ccccc3s2 271570a_200000082171_100000696092 [0,1,0,0,0,1|2,0,0]=4 1811 B18R3.47120 Brc1ccncc1c2cc3ccccc3[nH]2 271570a_100010206980_100010138639 [0,1,0,0,0,1|2,0,0]=4 1812 B18R3.47120 Brc1ccncc1c2nc3ccccc3s2 271570a_200000082171_100010138639 [0,1,0,0,0,1|2,0,0]=4 1813 B18R3.47120 Brc1ncccc1c2cc3ccccc3[nH]2 271570a_100010206980_100010202626 [0,1,0,0,0,1|2,0,0]=4 1814 B18R3.47120 Brc1ncccc1c2nc3ccccc3s2 271570a_200000082171_100010202626 [0,1,0,0,0,1|2,0,0]=4 1815 B18R3.47120 Cc1ccccc1c2nc3ccccc3[nH]2 271570a_100000747142_100009814255 [0,1,0,0,0,1|2,0,0]=4 1816 B18R3.47120 Cc1cccnc1c2cc3ccccc3[nH]2 271570a_100010206980_100000751373 [0,1,0,0,0,1|2,0,0]=4 1817 B18R3.47120 Cc1cccnc1c2nc3ccccc3s2 271570a_200000082171_100000751373 [0,1,0,0,0,1|2,0,0]=4 1818 B18R3.47120 Cc1ccncc1c2cc3ccccc3[nH]2 271570a_100010206980_100000761580 [0,1,0,0,0,1|2,0,0]=4 1819 B18R3.47120 Cc1ccncc1c2cc3ccccc3[nH]2 271570a_100011935247_100010232065 [0,1,0,0,0,1|2,0,0]=4 1820 B18R3.47120 Cc1ccncc1c2nc3ccccc3[nH]2 271570a_100011935247_100009814255 [0,1,0,0,0,1|1,0,0]=3 1821 B18R3.47120 Cc1ccncc1c2nc3ccccc3s2 271570a_100011935247_100000751744 [0,1,0,0,0,1|2,0,0]=4 1822 B18R3.47120 Cc1ccncc1c2nc3ccccc3s2 271570a_200000082171_100000761580 [0,1,0,0,0,1|2,0,0]=4 1823 B18R3.47120 Cc1ccnnc1c2cc3ccccc3[nH]2 271570a_100010206980_100000089043 [0,1,0,0,0,1|1,0,1]=4 1824 B18R3.47120 Cc1ccnnc1c2nc3ccccc3s2 271570a_200000082171_100000089043 [0,1,0,0,0,1|1,0,1]=4 1825 B18R3.47120 Cc1cnccc1c2nc3ccccc3[nH]2 271570a_100000701363_100009814255 [0,1,0,0,0,1|1,0,1]=4 1826 B18R3.47120 Cc1cncnc1c2cc3ccccc3[nH]2 271570a_100010206980_100011998708 [0,1,0,0,0,1|1,0,1]=4 1827 B18R3.47120 Cc1cncnc1c2nc3ccccc3s2 271570a_200000082171_100011998708 [0,1,0,0,0,1|1,0,1]=4 1828 B18R3.47120 Cc1ncccc1c2cc3ccccc3[nH]2 271570a_100010206980_100000751574 [0,1,0,0,0,1|2,0,0]=4 1829 B18R3.47120 Cc1ncccc1c2cc3ccccc3[nH]2 271570a_100011934933_100010232065 [0,1,0,0,0,1|2,0,0]=4 1830 B18R3.47120 Cc1ncccc1c2nc3ccccc3[nH]2 271570a_100011934933_100009814255 [0,1,0,0,0,1|1,0,0]=3 1831 B18R3.47120 Cc1ncccc1c2nc3ccccc3s2 271570a_100011934933_100000751744 [0,1,0,0,0,1|2,0,0]=4 1832 B18R3.47120 Cc1ncccc1c2nc3ccccc3s2 271570a_200000082171_100000751574 [0,1,0,0,0,1|2,0,0]=4 1833 B18R3.47120 Cc1nccnc1c2cc3ccccc3[nH]2 271570a_100010206980_100011999405 [0,1,0,0,0,1|2,0,0]=4 1834 B18R3.47120 Cc1nccnc1c2nc3ccccc3s2 271570a_200000082171_100011999405 [0,1,0,0,0,1|2,0,0]=4 1835 B18R3.47120 Cc1ncncc1c2nc3ccccc3[nH]2 271570a_200010046012_100009814255 [0,1,0,0,0,1|1,0,1]=4 1836 B18R3.47120 Clc1ccccc1c2nc3ccccc3[nH]2 271570a_100011934419_100009814255 [0,1,0,0,0,1|2,0,0]=4 1837 B18R3.47120 Clc1cccnc1c2cc3ccccc3[nH]2 271570a_100009857861_100010232065 [0,1,0,0,0,1|2,0,0]=4 1838 B18R3.47120 Clc1cccnc1c2cc3ccccc3[nH]2 271570a_100010206980_100011356963 [0,1,0,0,0,1|2,0,0]=4 1839 B18R3.47120 Clc1cccnc1c2nc3ccccc3[nH]2 271570a_100009857861_100009814255 [0,1,0,0,0,1|1,0,0]=3 1840 B18R3.47120 Clc1cccnc1c2nc3ccccc3s2 271570a_100009857861_100000751744 [0,1,0,0,0,1|2,0,0]=4 1841 B18R3.47120 Clc1cccnc1c2nc3ccccc3s2 271570a_200000082171_100011356963 [0,1,0,0,0,1|2,0,0]=4 1842 B18R3.47120 Clc1ccncc1c2cc3ccccc3[nH]2 271570a_100000062317_100010232065 [0,1,0,0,0,1|2,0,0]=4 1843 B18R3.47120 Clc1ccncc1c2cc3ccccc3[nH]2 271570a_100010206980_100009995489 [0,1,0,0,0,1|2,0,0]=4 1844 B18R3.47120 Clc1ccncc1c2nc3ccccc3[nH]2 271570a_100000062317_100009814255 [0,1,0,0,0,1|1,0,0]=3 1845 B18R3.47120 Clc1ccncc1c2nc3ccccc3s2 271570a_100000062317_100000751744 [0,1,0,0,0,1|2,0,0]=4 1846 B18R3.47120 Clc1ccncc1c2nc3ccccc3s2 271570a_200000082171_100009995489 [0,1,0,0,0,1|2,0,0]=4 1847 B18R3.47120 Clc1cnccc1c2nc3ccccc3[nH]2 271570a_100000062318_100009814255 [0,1,0,0,0,1|1,0,1]=4 1848 B18R3.47120 Clc1ncccc1c2cc3ccccc3[nH]2 271570a_100000047009_100010232065 [0,1,0,0,0,1|2,0,0]=4 1849 B18R3.47120 Clc1ncccc1c2cc3ccccc3[nH]2 271570a_100010206980_100000036424 [0,1,0,0,0,1|2,0,0]=4 1850 B18R3.47120 Clc1ncccc1c2nc3ccccc3[nH]2 271570a_100000047009_100009814255 [0,1,0,0,0,1|1,0,0]=3 1851 B18R3.47120 Clc1ncccc1c2nc3ccccc3s2 271570a_100000047009_100000751744 [0,1,0,0,0,1|2,0,0]=4 1852 B18R3.47120 Clc1ncccc1c2nc3ccccc3s2 271570a_200000082171_100000036424 [0,1,0,0,0,1|2,0,0]=4 1853 B18R3.47120 Fc1ccccc1c2nc3ccccc3[nH]2 271570a_100000761933_100009814255 [0,1,0,0,0,1|2,0,0]=4 1854 B18R3.47120 Fc1cccnc1c2cc3ccccc3[nH]2 271570a_100010206980_100000685392 [0,1,0,0,0,1|2,0,0]=4 1855 B18R3.47120 Fc1cccnc1c2nc3ccccc3s2 271570a_200000082171_100000685392 [0,1,0,0,0,1|2,0,0]=4 1856 B18R3.47120 Fc1ccncc1c2cc3ccccc3[nH]2 271570a_100010206980_100009820683 [0,1,0,0,0,1|2,0,0]=4 1857 B18R3.47120 Fc1ccncc1c2nc3ccccc3s2 271570a_200000082171_100009820683 [0,1,0,0,0,1|2,0,0]=4 1858 B18R3.47120 Fc1cnccc1c2nc3ccccc3[nH]2 271570a_100011290801_100009814255 [0,1,0,0,0,1|1,0,1]=4 1859 B18R3.47120 Fc1cncnc1c2cc3ccccc3[nH]2 271570a_100010206980_100000069762 [0,1,0,0,0,1|1,0,1]=4 1860 B18R3.47120 Fc1cncnc1c2nc3ccccc3s2 271570a_200000082171_100000069762 [0,1,0,0,0,1|1,0,1]=4 1861 B18R3.47120 Fc1ncccc1c2cc3ccccc3[nH]2 271570a_100000042387_100010232065 [0,1,0,0,0,1|2,0,0]=4 1862 B18R3.47120 Fc1ncccc1c2cc3ccccc3[nH]2 271570a_100010206980_100009816115 [0,1,0,0,0,1|2,0,0]=4 1863 B18R3.47120 Fc1ncccc1c2nc3ccccc3[nH]2 271570a_100000042387_100009814255 [0,1,0,0,0,1|1,0,0]=3 1864 B18R3.47120 Fc1ncccc1c2nc3ccccc3s2 271570a_100000042387_100000751744 [0,1,0,0,0,1|2,0,0]=4 1865 B18R3.47120 Fc1ncccc1c2nc3ccccc3s2 271570a_200000082171_100009816115 [0,1,0,0,0,1|2,0,0]=4 1866 B18R3.47120 Fc1nccnc1c2cc3ccccc3[nH]2 271570a_100010206980_200010125657 [0,1,0,0,0,1|2,0,0]=4 1867 B18R3.47120 Fc1nccnc1c2nc3ccccc3s2 271570a_200000082171_200010125657 [0,1,0,0,0,1|2,0,0]=4 1868 B18R3.47120 Ic1ccccc1c2nc3ccccc3[nH]2 271570a_100000069755_100009814255 [0,1,0,0,0,1|2,0,0]=4 1869 B18R3.47120 Nc1ccccc1c2nc3ccccc3[nH]2 271570a_100000034411_100009814255 [0,1,0,0,0,1|2,0,0]=4 1870 B18R3.47120 Nc1cccnc1c2cc3ccccc3[nH]2 271570a_100010206980_100000688686 [0,1,0,0,0,1|2,0,0]=4 1871 B18R3.47120 Nc1cccnc1c2nc3ccccc3s2 271570a_200000082171_100000688686 [0,1,0,0,0,1|2,0,0]=4 1872 B18R3.47120 Nc1ccncc1c2cc3ccccc3[nH]2 271570a_100010206980_100000047001 [0,1,0,0,0,1|2,0,0]=4 1873 B18R3.47120 Nc1ccncc1c2cc3ccccc3[nH]2 271570a_200010248739_100010232065 [0,1,0,0,0,1|2,0,0]=4 1874 B18R3.47120 Nc1ccncc1c2nc3ccccc3[nH]2 271570a_200010248739_100009814255 [0,1,0,0,0,1|1,0,0]=3 1875 B18R3.47120 Nc1ccncc1c2nc3ccccc3s2 271570a_200000082171_100000047001 [0,1,0,0,0,1|2,0,0]=4 1876 B18R3.47120 Nc1ccncc1c2nc3ccccc3s2 271570a_200010248739_100000751744 [0,1,0,0,0,1|2,0,0]=4 1877 B18R3.47120 Nc1cncnc1c2cc3ccccc3[nH]2 271570a_100010206980_100000709731 [0,1,0,0,0,1|1,0,1]=4 1878 B18R3.47120 Nc1cncnc1c2nc3ccccc3s2 271570a_200000082171_100000709731 [0,1,0,0,0,1|1,0,1]=4 1879 B18R3.47120 Nc1cnncc1c2cc3ccccc3[nH]2 271570a_100010206980_100009829405 [0,1,0,0,0,1|1,0,1]=4 1880 B18R3.47120 Nc1cnncc1c2nc3ccccc3s2 271570a_200000082171_100009829405 [0,1,0,0,0,1|1,0,1]=4 1881 B18R3.47120 Nc1ncccc1c2cc3ccccc3[nH]2 271570a_100000071976_100010232065 [0,1,0,0,0,1|2,0,0]=4 1882 B18R3.47120 Nc1ncccc1c2cc3ccccc3[nH]2 271570a_100010206980_100000045569 [0,1,0,0,0,1|2,0,0]=4 1883 B18R3.47120 Nc1ncccc1c2nc3ccccc3[nH]2 271570a_100000071976_100009814255 [0,1,0,0,0,1|1,0,0]=3 1884 B18R3.47120 Nc1ncccc1c2nc3ccccc3s2 271570a_100000071976_100000751744 [0,1,0,0,0,1|2,0,0]=4 1885 B18R3.47120 Nc1ncccc1c2nc3ccccc3s2 271570a_200000082171_100000045569 [0,1,0,0,0,1|2,0,0]=4 1886 B18R3.47120 Nc1nccnc1c2cc3ccccc3[nH]2 271570a_100010206980_100000747729 [0,1,0,0,0,1|2,0,0]=4 1887 B18R3.47120 Nc1nccnc1c2nc3ccccc3s2 271570a_200000082171_100000747729 [0,1,0,0,0,1|2,0,0]=4 1888 B18R3.47120 O=c1[nH]cccc1c2cc3ccccc3[nH]2 271570a_100000099769_100010232065 [0,1,0,0,0,1|2,0,0]=4 1889 B18R3.47120 O=c1[nH]cccc1c2cc3ccccc3[nH]2 271570a_100010206980_100000050042 [0,1,0,0,0,1|2,0,0]=4 1890 B18R3.47120 O=c1[nH]cccc1c2nc3ccccc3[nH]2 271570a_100000099769_100009814255 [0,1,0,0,0,1|1,0,0]=3 1891 B18R3.47120 O=c1[nH]cccc1c2nc3ccccc3s2 271570a_100000099769_100000751744 [0,1,0,0,0,1|2,0,0]=4 1892 B18R3.47120 O=c1[nH]cccc1c2nc3ccccc3s2 271570a_200000082171_100000050042 [0,1,0,0,0,1|2,0,0]=4 1893 B18R3.47120 O=c1[nH]ccnc1c2cc3ccccc3[nH]2 271570a_100010206980_100000763361 [0,1,0,0,0,1|2,0,0]=4 1894 B18R3.47120 O=c1[nH]ccnc1c2nc3ccccc3s2 271570a_200000082171_100000763361 [0,1,0,0,0,1|2,0,0]=4 1895 B18R3.47120 O=c1[nH]nccc1c2cc3ccccc3[nH]2 271570a_100010206980_100000087129 [0,1,0,0,0,1|2,0,0]=4 1896 B18R3.47120 O=c1[nH]nccc1c2nc3ccccc3s2 271570a_200000082171_100000087129 [0,1,0,0,0,1|2,0,0]=4 1897 B18R3.47120 O=c1cc[nH]cc1c2cc3ccccc3[nH]2 271570a_100010206980_100009998708 [0,1,0,0,0,1|2,0,0]=4 1898 B18R3.47120 O=c1cc[nH]cc1c2nc3ccccc3s2 271570a_200000082171_100009998708 [0,1,0,0,0,1|2,0,0]=4 1899 B18R3.47120 Oc1ccccc1c2nc3ccccc3[nH]2 271570a_100000035170_100009814255 [0,1,0,0,0,1|2,0,0]=4 1900 B18R3.47120 Oc1ccccc1c2nc3ccccc3[nH]2 271570a_203496583355_100000258283 [0,1,0,0,0,1|2,0,0]=4 1901 B18R3.47120 Oc1cccnc1c2cc3ccccc3[nH]2 271570a_100010206980_100000034122 [0,1,0,0,0,1|2,0,0]=4 1902 B18R3.47120 Oc1cccnc1c2nc3ccccc3s2 271570a_200000082171_100000034122 [0,1,0,0,0,1|2,0,0]=4 1903 B18R3.47120 S=c1cc[nH]cc1c2cc3ccccc3[nH]2 271570a_100010206980_200012280681 [0,1,0,0,0,1|2,0,0]=4 1904 B18R3.47120 S=c1cc[nH]cc1c2nc3ccccc3s2 271570a_200000082171_200012280681 [0,1,0,0,0,1|2,0,0]=4 1905 B18R3.2914 Cc1c(oc2c1cccc2)c3cc([nH]n3)N 271570a_100009874717_100009822546 [0,2,0,0,0,0|2,0,0]=4 1906 B18R3.2914 Cc1c(oc2c1cccc2)c3ccn(n3)C 271570a_100009874717_100000752436 [0,2,0,0,0,0|2,0,0]=4 1907 B18R3.2914 Cc1c(sc2c1cccc2)c3ccn(n3)C 271570a_100012348833_200010198769 [0,2,0,0,0,0|2,0,0]=4 1908 B18R3.2914 Cc1cc(cs1)c2nc3ccccc3n2C 271570a_100000699828_200000239431 [0,2,0,0,0,0|2,0,0]=4 1909 B18R3.2914 Cc1cc(n[nH]1)c2cc3ccccc3n2C 271570a_100010171889_100015199547 [0,2,0,0,0,0|1,0,0]=3 1910 B18R3.2914 Cc1cc(n[nH]1)c2nc3ccccc3n2C 271570a_100009872134_200000239431 [0,2,0,0,0,0|0,0,0]=2 1911 B18R3.2914 Cc1cc(n[nH]1)c2oc3ccccc3c2C 271570a_100009874717_100015199547 [0,2,0,0,0,0|2,0,0]=4 1912 B18R3.2914 Cc1cc(n[nH]1)c2sc3ccccc3c2C 271570a_100009872134_200010198769 [0,2,0,0,0,0|2,0,0]=4 1913 B18R3.2914 Cc1ccc(o1)c2nc3ccccc3n2C 271570a_100000061910_200000239431 [0,2,0,0,0,0|2,0,0]=4 1914 B18R3.2914 Cc1ccc(s1)c2nc3ccccc3n2C 271570a_100011934456_200000239431 [0,2,0,0,0,0|2,0,0]=4 1915 B18R3.2914 Cc1csc(c1)c2nc3ccccc3n2C 271570a_100000038307_200000239431 [0,2,0,0,0,0|2,0,0]=4 1916 B18R3.2914 Cc1nc(n[nH]1)c2cc3ccccc3n2C 271570a_100010171889_100000732540 [0,2,0,0,0,0|2,0,0]=4 1917 B18R3.2914 Cn1c(cc2c1cccc2)c3cc([nH]n3)N 271570a_100010171889_100009822546 [0,2,0,0,0,0|1,0,0]=3 1918 B18R3.2914 Cn1c(cc2c1cccc2)c3n[nH]c(n3)N 271570a_100010171889_100015184587 [0,2,0,0,0,0|2,0,0]=4 1919 B18R3.2914 Cn1c(nc2c1cccc2)C3=CC(=O)CC3 271570a_100010737933_200000239431 [0,2,0,0,0,0|2,0,0]=4 1920 B18R3.2914 Cn1c(nc2c1cccc2)c3ccc(s3)Cl 271570a_100000708867_200000239431 [0,2,0,0,0,0|2,0,0]=4 1921 B18R3.2914 Cn1cc(cn1)c2nc3ccccc3n2C 271570a_100000685319_200000239431 [0,2,0,0,0,0|2,0,0]=4 1922 B18R3.2914 Cn1ccc(c1)c2nc3ccccc3n2C 271570a_100010172022_200000239431 [0,2,0,0,0,0|1,0,0]=3 1923 B18R3.2914 Cn1ccc(n1)c2cc3ccccc3n2C 271570a_100010171889_100000752436 [0,2,0,0,0,0|1,0,0]=3 1924 B18R3.2914 Cn1ccc(n1)c2nc3ccccc3n2C 271570a_100012348833_200000239431 [0,2,0,0,0,0|0,0,0]=2 1925 B18R3.2914 Cn1cnc(n1)c2cc3ccccc3n2C 271570a_100010171889_100009819955 [0,2,0,0,0,0|2,0,0]=4 1926 B18R3.2914 Cn1ncc(n1)c2cc3ccccc3n2C 271570a_100010171889_100000733932 [0,2,0,0,0,0|2,0,0]=4 1927 B18R3.3313 Cc1c(oc2c1cccc2)c3n[nH]cc3Br 271570a_100009874717_100015839836 [0,2,0,0,0,0|2,0,0]=4 1928 B18R3.3313 Cc1c(oc2c1cccc2)c3n[nH]cc3N 271570a_100009874717_100010894806 [0,2,0,0,0,0|2,0,0]=4 1929 B18R3.3313 Cc1c[nH]nc1c2cc3ccccc3n2C 271570a_100010171889_100009871783 [0,2,0,0,0,0|1,0,0]=3 1930 B18R3.3313 Cc1c[nH]nc1c2nc3ccccc3n2C 271570a_100102527747_200000239431 [0,2,0,0,0,0|0,0,0]=2 1931 B18R3.3313 Cc1c[nH]nc1c2oc3ccccc3c2C 271570a_100009874717_100009871783 [0,2,0,0,0,0|2,0,0]=4 1932 B18R3.3313 Cc1c[nH]nc1c2sc3ccccc3c2C 271570a_100102527747_200010198769 [0,2,0,0,0,0|2,0,0]=4 1933 B18R3.3313 Cc1ccsc1c2nc3ccccc3n2C 271570a_100000734444_200000239431 [0,2,0,0,0,0|2,0,0]=4 1934 B18R3.3313 Cc1cscc1c2nc3ccccc3n2C 271570a_100000069996_200000239431 [0,2,0,0,0,0|2,0,0]=4 1935 B18R3.3313 Cc1n[nH]cc1c2nc3ccccc3n2C 271570a_100000069033_200000239431 [0,2,0,0,0,0|2,0,0]=4 1936 B18R3.3313 Cc1occc1c2nc3ccccc3n2C 271570a_100000070625_200000239431 [0,2,0,0,0,0|2,0,0]=4 1937 B18R3.3313 Cc1sccc1c2nc3ccccc3n2C 271570a_100012356473_200000239431 [0,2,0,0,0,0|2,0,0]=4 1938 B18R3.3313 Cn1c(cc2c1cccc2)c3n[nH]cc3Br 271570a_100010171889_100015839836 [0,2,0,0,0,0|1,0,0]=3 1939 B18R3.3313 Cn1c(cc2c1cccc2)c3n[nH]cc3N 271570a_100010171889_100010894806 [0,2,0,0,0,0|1,0,0]=3 1940 B18R3.3313 Cn1c(nc2c1cccc2)c3ccsc3Cl 271570a_100000117213_200000239431 [0,2,0,0,0,0|2,0,0]=4 1941 B18R3.3313 Cn1cccc1c2nc3ccccc3n2C 271570a_100000068268_200000239431 [0,2,0,0,0,0|1,0,1]=4 1942 B18R3.3313 Cn1nccc1c2nc3ccccc3n2C 271570a_100000707534_200000239431 [0,2,0,0,0,0|0,0,2]=4 1943 B18R3.32261 Cn1c(cc2c1cc(cc2)Cl)c3cc[nH]n3 271570a_100000070589_100000062575 [0,2,0,0,0,0|1,0,0]=3 1944 B18R3.32261 Cn1c(cc2c1cc(cc2)Cl)c3ccsn3 271570a_100000070589_100009818082 [0,2,0,0,0,0|2,0,0]=4 1945 B18R3.32261 Cn1c(cc2c1cc(cc2)Cl)c3nc[nH]n3 271570a_100000070589_100000761765 [0,2,0,0,0,0|2,0,0]=4 1946 B18R3.88201 Cn1c(cc2c1cccc2Cl)c3cc[nH]n3 271570a_100010156460_100000062575 [0,2,0,0,0,0|1,0,0]=3 1947 B18R3.88201 Cn1c(cc2c1cccc2Cl)c3ccsn3 271570a_100010156460_100009818082 [0,2,0,0,0,0|2,0,0]=4 1948 B18R3.88201 Cn1c(cc2c1cccc2Cl)c3nc[nH]n3 271570a_100010156460_100000761765 [0,2,0,0,0,0|2,0,0]=4 1949 B18R3.559811 Cn1c(cc2c1ccc(c2)Br)c3cc[nH]n3 271570a_200010168143_100000062575 [0,2,0,0,0,0|1,0,0]=3 1950 B18R3.559811 Cn1c(cc2c1ccc(c2)Br)c3ccsn3 271570a_200010168143_100009818082 [0,2,0,0,0,0|2,0,0]=4 1951 B18R3.559811 Cn1c(cc2c1ccc(c2)Br)c3nc[nH]n3 271570a_200010168143_100000761765 [0,2,0,0,0,0|2,0,0]=4 1952 B18R3.2908 Cc1cc(n[nH]1)c2cc3c(cccc3[nH]2)Cl 271570a_100010246266_100015199547 [0,2,0,0,0,0|1,0,0]=3 1953 B18R3.2908 Cc1cc(n[nH]1)c2cc3c(cccc3[nH]2)F 271570a_100010071326_100015199547 [0,2,0,0,0,0|1,0,0]=3 1954 B18R3.2908 Cc1cc(n[nH]1)c2cc3c(cccc3o2)F 271570a_200011102740_100015199547 [0,2,0,0,0,0|2,0,0]=4 1955 B18R3.2908 Cc1cc(n[nH]1)c2cc3c(ccnc3[nH]2)Cl 271570a_100009872134_100010234028 [0,2,0,0,0,0|2,0,0]=4 1956 B18R3.2908 Cc1cc(n[nH]1)c2cc3cccc(c3[nH]2)Br 271570a_100009872134_100135389745 [0,2,0,0,0,0|1,0,0]=3 1957 B18R3.2908 Cc1cc(n[nH]1)c2cc3cccc(c3[nH]2)Br 271570a_200010246277_100015199547 [0,2,0,0,0,0|1,0,0]=3 1958 B18R3.2908 Cc1cc(n[nH]1)c2cc3cccc(c3[nH]2)C 271570a_100010246273_100015199547 [0,2,0,0,0,0|1,0,0]=3 1959 B18R3.2908 Cc1cc(n[nH]1)c2cc3cccc(c3[nH]2)Cl 271570a_100015811879_100015199547 [0,2,0,0,0,0|1,0,0]=3 1960 B18R3.2908 Cc1cc(n[nH]1)c2cc3cccc(c3[nH]2)F 271570a_100010082618_100015199547 [0,2,0,0,0,0|1,0,0]=3 1961 B18R3.2908 Cc1cc(n[nH]1)c2nc3c(cccc3s2)C 271570a_100009872134_100010008827 [0,2,0,0,0,0|1,0,0]=3 1962 B18R3.2908 Cc1cc(n[nH]1)c2nc3c(cccc3s2)F 271570a_100009872134_100010008856 [0,2,0,0,0,0|1,0,0]=3 1963 B18R3.2908 Cc1cc(n[nH]1)c2nc3ncnc(c3[nH]2)N 271570a_100009872134_100009817290 [0,2,0,0,0,0|2,0,0]=4 1964 B18R3.2908 Cc1cccc2c1[nH]c(c2)c3cc([nH]n3)N 271570a_100010246273_100009822546 [0,2,0,0,0,0|1,0,0]=3 1965 B18R3.2908 Cc1cccc2c1[nH]c(c2)c3ccn(n3)C 271570a_100010246273_100000752436 [0,2,0,0,0,0|1,0,0]=3 1966 B18R3.2908 Cc1cccc2c1[nH]c(c2)c3cnn(n3)C 271570a_100010246273_100000733932 [0,2,0,0,0,0|2,0,0]=4 1967 B18R3.2908 Cc1cccc2c1[nH]c(c2)c3n[nH]c(n3)N 271570a_100010246273_100015184587 [0,2,0,0,0,0|2,0,0]=4 1968 B18R3.2908 Cc1cccc2c1[nH]c(c2)c3ncn(n3)C 271570a_100010246273_100009819955 [0,2,0,0,0,0|2,0,0]=4 1969 B18R3.2908 Cc1cccc2c1nc(s2)c3ccn(c3)C 271570a_100010172022_100010008827 [0,2,0,0,0,0|2,0,0]=4 1970 B18R3.2908 Cc1cccc2c1nc(s2)c3ccn(n3)C 271570a_100012348833_100010008827 [0,2,0,0,0,0|1,0,0]=3 1971 B18R3.2908 Cc1nc(n[nH]1)c2cc3c(cccc3[nH]2)Cl 271570a_100010246266_100000732540 [0,2,0,0,0,0|2,0,0]=4 1972 B18R3.2908 Cc1nc(n[nH]1)c2cc3c(cccc3[nH]2)F 271570a_100010071326_100000732540 [0,2,0,0,0,0|2,0,0]=4 1973 B18R3.2908 Cc1nc(n[nH]1)c2cc3cccc(c3[nH]2)Br 271570a_200010246277_100000732540 [0,2,0,0,0,0|2,0,0]=4 1974 B18R3.2908 Cc1nc(n[nH]1)c2cc3cccc(c3[nH]2)C 271570a_100010246273_100000732540 [0,2,0,0,0,0|2,0,0]=4 1975 B18R3.2908 Cc1nc(n[nH]1)c2cc3cccc(c3[nH]2)Cl 271570a_100015811879_100000732540 [0,2,0,0,0,0|2,0,0]=4 1976 B18R3.2908 Cc1nc(n[nH]1)c2cc3cccc(c3[nH]2)F 271570a_100010082618_100000732540 [0,2,0,0,0,0|2,0,0]=4 1977 B18R3.2908 Cn1ccc(c1)c2cc3cccc(c3[nH]2)Br 271570a_100010172022_100135389745 [0,2,0,0,0,0|2,0,0]=4 1978 B18R3.2908 Cn1ccc(c1)c2nc3c(cccc3s2)F 271570a_100010172022_100010008856 [0,2,0,0,0,0|2,0,0]=4 1979 B18R3.2908 Cn1ccc(n1)c2cc3c(cccc3[nH]2)Cl 271570a_100010246266_100000752436 [0,2,0,0,0,0|1,0,0]=3 1980 B18R3.2908 Cn1ccc(n1)c2cc3c(cccc3[nH]2)F 271570a_100010071326_100000752436 [0,2,0,0,0,0|1,0,0]=3 1981 B18R3.2908 Cn1ccc(n1)c2cc3c(cccc3o2)F 271570a_200011102740_100000752436 [0,2,0,0,0,0|2,0,0]=4 1982 B18R3.2908 Cn1ccc(n1)c2cc3c(ccnc3[nH]2)Cl 271570a_100012348833_100010234028 [0,2,0,0,0,0|2,0,0]=4 1983 B18R3.2908 Cn1ccc(n1)c2cc3cccc(c3[nH]2)Br 271570a_100012348833_100135389745 [0,2,0,0,0,0|1,0,0]=3 1984 B18R3.2908 Cn1ccc(n1)c2cc3cccc(c3[nH]2)Br 271570a_200010246277_100000752436 [0,2,0,0,0,0|1,0,0]=3 1985 B18R3.2908 Cn1ccc(n1)c2cc3cccc(c3[nH]2)Cl 271570a_100015811879_100000752436 [0,2,0,0,0,0|1,0,0]=3 1986 B18R3.2908 Cn1ccc(n1)c2cc3cccc(c3[nH]2)F 271570a_100010082618_100000752436 [0,2,0,0,0,0|1,0,0]=3 1987 B18R3.2908 Cn1ccc(n1)c2nc3c(cccc3s2)F 271570a_100012348833_100010008856 [0,2,0,0,0,0|1,0,0]=3 1988 B18R3.2908 Cn1ccc(n1)c2nc3ncnc(c3[nH]2)N 271570a_100012348833_100009817290 [0,2,0,0,0,0|2,0,0]=4 1989 B18R3.2908 Cn1cnc(n1)c2cc3c(cccc3[nH]2)Cl 271570a_100010246266_100009819955 [0,2,0,0,0,0|2,0,0]=4 1990 B18R3.2908 Cn1cnc(n1)c2cc3c(cccc3[nH]2)F 271570a_100010071326_100009819955 [0,2,0,0,0,0|2,0,0]=4 1991 B18R3.2908 Cn1cnc(n1)c2cc3cccc(c3[nH]2)Br 271570a_200010246277_100009819955 [0,2,0,0,0,0|2,0,0]=4 1992 B18R3.2908 Cn1cnc(n1)c2cc3cccc(c3[nH]2)Cl 271570a_100015811879_100009819955 [0,2,0,0,0,0|2,0,0]=4 1993 B18R3.2908 Cn1cnc(n1)c2cc3cccc(c3[nH]2)F 271570a_100010082618_100009819955 [0,2,0,0,0,0|2,0,0]=4 1994 B18R3.2908 Cn1ncc(n1)c2cc3c(cccc3[nH]2)Cl 271570a_100010246266_100000733932 [0,2,0,0,0,0|2,0,0]=4 1995 B18R3.2908 Cn1ncc(n1)c2cc3c(cccc3[nH]2)F 271570a_100010071326_100000733932 [0,2,0,0,0,0|2,0,0]=4 1996 B18R3.2908 Cn1ncc(n1)c2cc3cccc(c3[nH]2)Br 271570a_200010246277_100000733932 [0,2,0,0,0,0|2,0,0]=4 1997 B18R3.2908 Cn1ncc(n1)c2cc3cccc(c3[nH]2)Cl 271570a_100015811879_100000733932 [0,2,0,0,0,0|2,0,0]=4 1998 B18R3.2908 Cn1ncc(n1)c2cc3cccc(c3[nH]2)F 271570a_100010082618_100000733932 [0,2,0,0,0,0|2,0,0]=4 1999 B18R3.2908 Nc1cc(n[nH]1)c2cc3c(cccc3[nH]2)Cl 271570a_100010246266_100009822546 [0,2,0,0,0,0|1,0,0]=3 2000 B18R3.2908 Nc1cc(n[nH]1)c2cc3c(cccc3[nH]2)F 271570a_100010071326_100009822546 [0,2,0,0,0,0|1,0,0]=3 2001 B18R3.2908 Nc1cc(n[nH]1)c2cc3c(cccc3o2)F 271570a_200011102740_100009822546 [0,2,0,0,0,0|2,0,0]=4 2002 B18R3.2908 Nc1cc(n[nH]1)c2cc3cccc(c3[nH]2)Br 271570a_200010246277_100009822546 [0,2,0,0,0,0|1,0,0]=3 2003 B18R3.2908 Nc1cc(n[nH]1)c2cc3cccc(c3[nH]2)Cl 271570a_100015811879_100009822546 [0,2,0,0,0,0|1,0,0]=3 2004 B18R3.2908 Nc1cc(n[nH]1)c2cc3cccc(c3[nH]2)F 271570a_100010082618_100009822546 [0,2,0,0,0,0|1,0,0]=3 2005 B18R3.2908 Nc1nc(n[nH]1)c2cc3c(cccc3[nH]2)Cl 271570a_100010246266_100015184587 [0,2,0,0,0,0|2,0,0]=4 2006 B18R3.2908 Nc1nc(n[nH]1)c2cc3c(cccc3[nH]2)F 271570a_100010071326_100015184587 [0,2,0,0,0,0|2,0,0]=4 2007 B18R3.2908 Nc1nc(n[nH]1)c2cc3cccc(c3[nH]2)Br 271570a_200010246277_100015184587 [0,2,0,0,0,0|2,0,0]=4 2008 B18R3.2908 Nc1nc(n[nH]1)c2cc3cccc(c3[nH]2)Cl 271570a_100015811879_100015184587 [0,2,0,0,0,0|2,0,0]=4 2009 B18R3.2908 Nc1nc(n[nH]1)c2cc3cccc(c3[nH]2)F 271570a_100010082618_100015184587 [0,2,0,0,0,0|2,0,0]=4 2010 B18R3.3796 Brc1c[nH]nc1c2cc3cccc(c3[nH]2)Br 271570a_200010246277_100015839836 [0,2,0,0,0,0|1,0,0]=3 2011 B18R3.3796 Cc1c[nH]nc1c2cc3c(cccc3[nH]2)Cl 271570a_100010246266_100009871783 [0,2,0,0,0,0|1,0,0]=3 2012 B18R3.3796 Cc1c[nH]nc1c2cc3c(cccc3[nH]2)F 271570a_100010071326_100009871783 [0,2,0,0,0,0|1,0,0]=3 2013 B18R3.3796 Cc1c[nH]nc1c2cc3c(cccc3o2)F 271570a_200011102740_100009871783 [0,2,0,0,0,0|2,0,0]=4 2014 B18R3.3796 Cc1c[nH]nc1c2cc3c(ccnc3[nH]2)Cl 271570a_100102527747_100010234028 [0,2,0,0,0,0|2,0,0]=4 2015 B18R3.3796 Cc1c[nH]nc1c2cc3cccc(c3[nH]2)Br 271570a_100102527747_100135389745 [0,2,0,0,0,0|1,0,0]=3 2016 B18R3.3796 Cc1c[nH]nc1c2cc3cccc(c3[nH]2)Br 271570a_200010246277_100009871783 [0,2,0,0,0,0|1,0,0]=3 2017 B18R3.3796 Cc1c[nH]nc1c2cc3cccc(c3[nH]2)C 271570a_100010246273_100009871783 [0,2,0,0,0,0|1,0,0]=3 2018 B18R3.3796 Cc1c[nH]nc1c2cc3cccc(c3[nH]2)Cl 271570a_100015811879_100009871783 [0,2,0,0,0,0|1,0,0]=3 2019 B18R3.3796 Cc1c[nH]nc1c2cc3cccc(c3[nH]2)F 271570a_100010082618_100009871783 [0,2,0,0,0,0|1,0,0]=3 2020 B18R3.3796 Cc1c[nH]nc1c2nc3c(cccc3s2)C 271570a_100102527747_100010008827 [0,2,0,0,0,0|1,0,0]=3 2021 B18R3.3796 Cc1c[nH]nc1c2nc3c(cccc3s2)F 271570a_100102527747_100010008856 [0,2,0,0,0,0|1,0,0]=3 2022 B18R3.3796 Cc1c[nH]nc1c2nc3ncnc(c3[nH]2)N 271570a_100102527747_100009817290 [0,2,0,0,0,0|2,0,0]=4 2023 B18R3.3796 Cc1cccc2c1[nH]c(c2)c3n[nH]cc3Br 271570a_100010246273_100015839836 [0,2,0,0,0,0|1,0,0]=3 2024 B18R3.3796 Cc1cccc2c1[nH]c(c2)c3n[nH]cc3N 271570a_100010246273_100010894806 [0,2,0,0,0,0|1,0,0]=3 2025 B18R3.3796 Clc1cccc2c1[nH]c(c2)c3n[nH]cc3Br 271570a_100015811879_100015839836 [0,2,0,0,0,0|1,0,0]=3 2026 B18R3.3796 Clc1cccc2c1cc([nH]2)c3n[nH]cc3Br 271570a_100010246266_100015839836 [0,2,0,0,0,0|1,0,0]=3 2027 B18R3.3796 Fc1cccc2c1[nH]c(c2)c3n[nH]cc3Br 271570a_100010082618_100015839836 [0,2,0,0,0,0|1,0,0]=3 2028 B18R3.3796 Fc1cccc2c1cc([nH]2)c3n[nH]cc3Br 271570a_100010071326_100015839836 [0,2,0,0,0,0|1,0,0]=3 2029 B18R3.3796 Fc1cccc2c1cc(o2)c3n[nH]cc3Br 271570a_200011102740_100015839836 [0,2,0,0,0,0|2,0,0]=4 2030 B18R3.3796 Nc1c[nH]nc1c2cc3c(cccc3[nH]2)Cl 271570a_100010246266_100010894806 [0,2,0,0,0,0|1,0,0]=3 2031 B18R3.3796 Nc1c[nH]nc1c2cc3c(cccc3[nH]2)F 271570a_100010071326_100010894806 [0,2,0,0,0,0|1,0,0]=3 2032 B18R3.3796 Nc1c[nH]nc1c2cc3c(cccc3o2)F 271570a_200011102740_100010894806 [0,2,0,0,0,0|2,0,0]=4 2033 B18R3.3796 Nc1c[nH]nc1c2cc3cccc(c3[nH]2)Br 271570a_200010246277_100010894806 [0,2,0,0,0,0|1,0,0]=3 2034 B18R3.3796 Nc1c[nH]nc1c2cc3cccc(c3[nH]2)Cl 271570a_100015811879_100010894806 [0,2,0,0,0,0|1,0,0]=3 2035 B18R3.3796 Nc1c[nH]nc1c2cc3cccc(c3[nH]2)F 271570a_100010082618_100010894806 [0,2,0,0,0,0|1,0,0]=3 2036 B18R3.9712 COc1cccc2c1cc([nH]2)c3cc[nH]n3 271570a_100010246284_100000062575 [0,2,0,0,0,0|1,0,0]=3 2037 B18R3.9712 COc1cccc2c1cc([nH]2)c3ccsn3 271570a_100010246284_100009818082 [0,2,0,0,0,0|2,0,0]=4 2038 B18R3.9712 COc1cccc2c1cc([nH]2)c3nc[nH]n3 271570a_100010246284_100000761765 [0,2,0,0,0,0|2,0,0]=4 2039 B18R3.9712 COc1cccc2c1nc(s2)c3cc[nH]c3 271570a_100000102155_100010195968 [0,2,0,0,0,0|2,0,0]=4 2040 B18R3.9712 COc1cccc2c1nc(s2)c3cc[nH]n3 271570a_100000062414_100010195968 [0,2,0,0,0,0|1,0,0]=3 2041 B18R3.9712 N#Cc1cccc2c1cc([nH]2)c3cc[nH]n3 271570a_100010246290_100000062575 [0,2,0,0,0,0|1,0,0]=3 2042 B18R3.9712 N#Cc1cccc2c1cc([nH]2)c3ccsn3 271570a_100010246290_100009818082 [0,2,0,0,0,0|2,0,0]=4 2043 B18R3.9712 N#Cc1cccc2c1cc([nH]2)c3nc[nH]n3 271570a_100010246290_100000761765 [0,2,0,0,0,0|2,0,0]=4 2044 B18R3.612671 Nc1nc2[nH]c(nc2c(=O)[nH]1)c3cc[nH]n3 271570a_100000062414_200009813169 [0,2,0,0,0,0|2,0,0]=4 2045 B18R3.612671 O=c1[nH]c(=O)c2nc([nH]c2[nH]1)c3cc[nH]n3 271570a_100000062414_100010005409 [0,2,0,0,0,0|2,0,0]=4 2046 B18R3.2907 Cc1cc(n[nH]1)c2cc3cc(ccc3[nH]2)Br 271570a_100009872134_100011012855 [0,2,0,0,0,0|1,0,0]=3 2047 B18R3.2907 Cc1cc(n[nH]1)c2cc3cc(ccc3[nH]2)Cl 271570a_100010246260_100015199547 [0,2,0,0,0,0|1,0,0]=3 2048 B18R3.2907 Cc1cc(n[nH]1)c2cc3cc(ccc3[nH]2)F 271570a_100010246264_100015199547 [0,2,0,0,0,0|1,0,0]=3 2049 B18R3.2907 Cc1cc(n[nH]1)c2cc3cc(ccc3o2)Br 271570a_100010176198_100015199547 [0,2,0,0,0,0|2,0,0]=4 2050 B18R3.2907 Cc1cc(n[nH]1)c2cc3cc(ccc3o2)Cl 271570a_100012186365_100015199547 [0,2,0,0,0,0|2,0,0]=4 2051 B18R3.2907 Cc1cc(n[nH]1)c2cc3cc(ccc3o2)F 271570a_100012185221_100015199547 [0,2,0,0,0,0|2,0,0]=4 2052 B18R3.2907 Cc1cc(n[nH]1)c2cc3cc(ccc3s2)Br 271570a_100009872134_200010198765 [0,2,0,0,0,0|2,0,0]=4 2053 B18R3.2907 Cc1cc(n[nH]1)c2cc3ccc(cc3[nH]2)Br 271570a_200010246288_100015199547 [0,2,0,0,0,0|1,0,0]=3 2054 B18R3.2907 Cc1cc(n[nH]1)c2cc3ccc(cc3s2)Br 271570a_100015653926_100015199547 [0,2,0,0,0,0|2,0,0]=4 2055 B18R3.2907 Cc1cc(n[nH]1)c2cn3cc(ccc3n2)F 271570a_100009872134_100010231931 [0,2,0,0,0,0|2,0,0]=4 2056 B18R3.2907 Cc1cc(n[nH]1)c2nc3cc(ccc3s2)F 271570a_100009872134_200010206605 [0,2,0,0,0,0|1,0,0]=3 2057 B18R3.2907 Cc1cc(n[nH]1)c2nc3cc(ccc3s2)N 271570a_100009872134_100010329861 [0,2,0,0,0,0|1,0,0]=3 2058 B18R3.2907 Cc1cc(n[nH]1)c2nc3ccc(cc3s2)F 271570a_100009872134_100000751617 [0,2,0,0,0,0|1,0,0]=3 2059 B18R3.2907 Cc1cc(n[nH]1)c2nc3ccc(cc3s2)N 271570a_100009872134_100010253933 [0,2,0,0,0,0|1,0,0]=3 2060 B18R3.2907 Cc1cc(n[nH]1)c2nc3ccc(cc3s2)O 271570a_100009872134_100010063415 [0,2,0,0,0,0|1,0,0]=3 2061 B18R3.2907 Cc1cc(n[nH]1)c2nc3ccc(nc3s2)F 271570a_100009872134_200010738066 [0,2,0,0,0,0|2,0,0]=4 2062 B18R3.2907 Cc1ccc2cc([nH]c2c1)c3cc([nH]n3)C 271570a_100010246276_100015199547 [0,2,0,0,0,0|1,0,0]=3 2063 B18R3.2907 Cc1ccc2cc([nH]c2c1)c3cc([nH]n3)N 271570a_100010246276_100009822546 [0,2,0,0,0,0|1,0,0]=3 2064 B18R3.2907 Cc1ccc2cc([nH]c2c1)c3ccn(n3)C 271570a_100010246276_100000752436 [0,2,0,0,0,0|1,0,0]=3 2065 B18R3.2907 Cc1ccc2cc([nH]c2c1)c3cnn(n3)C 271570a_100010246276_100000733932 [0,2,0,0,0,0|2,0,0]=4 2066 B18R3.2907 Cc1ccc2cc([nH]c2c1)c3n[nH]c(n3)C 271570a_100010246276_100000732540 [0,2,0,0,0,0|2,0,0]=4 2067 B18R3.2907 Cc1ccc2cc([nH]c2c1)c3n[nH]c(n3)N 271570a_100010246276_100015184587 [0,2,0,0,0,0|2,0,0]=4 2068 B18R3.2907 Cc1ccc2cc([nH]c2c1)c3ncn(n3)C 271570a_100010246276_100009819955 [0,2,0,0,0,0|2,0,0]=4 2069 B18R3.2907 Cc1ccc2nc(sc2c1)c3cc([nH]n3)C 271570a_100009872134_100010186437 [0,2,0,0,0,0|1,0,0]=3 2070 B18R3.2907 Cc1ccc2nc(sc2c1)c3ccn(c3)C 271570a_100010172022_100010186437 [0,2,0,0,0,0|2,0,0]=4 2071 B18R3.2907 Cc1ccc2nc(sc2c1)c3ccn(n3)C 271570a_100012348833_100010186437 [0,2,0,0,0,0|1,0,0]=3 2072 B18R3.2907 Cc1ccc2oc(cc2c1)c3cc([nH]n3)C 271570a_200013722915_100015199547 [0,2,0,0,0,0|2,0,0]=4 2073 B18R3.2907 Cc1ccc2oc(cc2c1)c3cc([nH]n3)N 271570a_200013722915_100009822546 [0,2,0,0,0,0|2,0,0]=4 2074 B18R3.2907 Cc1ccc2oc(cc2c1)c3ccn(n3)C 271570a_200013722915_100000752436 [0,2,0,0,0,0|2,0,0]=4 2075 B18R3.2907 Cc1ccc2sc(cc2c1)c3cc([nH]n3)C 271570a_100000057607_100015199547 [0,2,0,0,0,0|2,0,0]=4 2076 B18R3.2907 Cc1ccc2sc(cc2c1)c3cc([nH]n3)N 271570a_100000057607_100009822546 [0,2,0,0,0,0|2,0,0]=4 2077 B18R3.2907 Cc1ccc2sc(cc2c1)c3ccn(n3)C 271570a_100000057607_100000752436 [0,2,0,0,0,0|2,0,0]=4 2078 B18R3.2907 Cc1nc(n[nH]1)c2cc3cc(ccc3[nH]2)Cl 271570a_100010246260_100000732540 [0,2,0,0,0,0|2,0,0]=4 2079 B18R3.2907 Cc1nc(n[nH]1)c2cc3cc(ccc3[nH]2)F 271570a_100010246264_100000732540 [0,2,0,0,0,0|2,0,0]=4 2080 B18R3.2907 Cc1nc(n[nH]1)c2cc3ccc(cc3[nH]2)Br 271570a_200010246288_100000732540 [0,2,0,0,0,0|2,0,0]=4 2081 B18R3.2907 Cn1ccc(c1)c2cc3cc(ccc3[nH]2)Br 271570a_100010172022_100011012855 [0,2,0,0,0,0|2,0,0]=4 2082 B18R3.2907 Cn1ccc(c1)c2nc3cc(ccc3s2)F 271570a_100010172022_200010206605 [0,2,0,0,0,0|2,0,0]=4 2083 B18R3.2907 Cn1ccc(c1)c2nc3cc(ccc3s2)N 271570a_100010172022_100010329861 [0,2,0,0,0,0|2,0,0]=4 2084 B18R3.2907 Cn1ccc(c1)c2nc3ccc(cc3s2)F 271570a_100010172022_100000751617 [0,2,0,0,0,0|2,0,0]=4 2085 B18R3.2907 Cn1ccc(c1)c2nc3ccc(cc3s2)N 271570a_100010172022_100010253933 [0,2,0,0,0,0|2,0,0]=4 2086 B18R3.2907 Cn1ccc(c1)c2nc3ccc(cc3s2)O 271570a_100010172022_100010063415 [0,2,0,0,0,0|2,0,0]=4 2087 B18R3.2907 Cn1ccc(n1)c2cc3cc(ccc3[nH]2)Br 271570a_100012348833_100011012855 [0,2,0,0,0,0|1,0,0]=3 2088 B18R3.2907 Cn1ccc(n1)c2cc3cc(ccc3[nH]2)Cl 271570a_100010246260_100000752436 [0,2,0,0,0,0|1,0,0]=3 2089 B18R3.2907 Cn1ccc(n1)c2cc3cc(ccc3[nH]2)F 271570a_100010246264_100000752436 [0,2,0,0,0,0|1,0,0]=3 2090 B18R3.2907 Cn1ccc(n1)c2cc3cc(ccc3o2)Br 271570a_100010176198_100000752436 [0,2,0,0,0,0|2,0,0]=4 2091 B18R3.2907 Cn1ccc(n1)c2cc3cc(ccc3o2)Cl 271570a_100012186365_100000752436 [0,2,0,0,0,0|2,0,0]=4 2092 B18R3.2907 Cn1ccc(n1)c2cc3cc(ccc3o2)F 271570a_100012185221_100000752436 [0,2,0,0,0,0|2,0,0]=4 2093 B18R3.2907 Cn1ccc(n1)c2cc3cc(ccc3s2)Br 271570a_100012348833_200010198765 [0,2,0,0,0,0|2,0,0]=4 2094 B18R3.2907 Cn1ccc(n1)c2cc3ccc(cc3[nH]2)Br 271570a_200010246288_100000752436 [0,2,0,0,0,0|1,0,0]=3 2095 B18R3.2907 Cn1ccc(n1)c2cc3ccc(cc3s2)Br 271570a_100015653926_100000752436 [0,2,0,0,0,0|2,0,0]=4 2096 B18R3.2907 Cn1ccc(n1)c2cn3cc(ccc3n2)F 271570a_100012348833_100010231931 [0,2,0,0,0,0|2,0,0]=4 2097 B18R3.2907 Cn1ccc(n1)c2nc3cc(ccc3s2)F 271570a_100012348833_200010206605 [0,2,0,0,0,0|1,0,0]=3 2098 B18R3.2907 Cn1ccc(n1)c2nc3cc(ccc3s2)N 271570a_100012348833_100010329861 [0,2,0,0,0,0|1,0,0]=3 2099 B18R3.2907 Cn1ccc(n1)c2nc3ccc(cc3s2)F 271570a_100012348833_100000751617 [0,2,0,0,0,0|1,0,0]=3 2100 B18R3.2907 Cn1ccc(n1)c2nc3ccc(cc3s2)N 271570a_100012348833_100010253933 [0,2,0,0,0,0|1,0,0]=3 2101 B18R3.2907 Cn1ccc(n1)c2nc3ccc(cc3s2)O 271570a_100012348833_100010063415 [0,2,0,0,0,0|1,0,0]=3 2102 B18R3.2907 Cn1ccc(n1)c2nc3ccc(nc3s2)F 271570a_100012348833_200010738066 [0,2,0,0,0,0|2,0,0]=4 2103 B18R3.2907 Cn1cnc(n1)c2cc3cc(ccc3[nH]2)Cl 271570a_100010246260_100009819955 [0,2,0,0,0,0|2,0,0]=4 2104 B18R3.2907 Cn1cnc(n1)c2cc3cc(ccc3[nH]2)F 271570a_100010246264_100009819955 [0,2,0,0,0,0|2,0,0]=4 2105 B18R3.2907 Cn1cnc(n1)c2cc3ccc(cc3[nH]2)Br 271570a_200010246288_100009819955 [0,2,0,0,0,0|2,0,0]=4 2106 B18R3.2907 Cn1ncc(n1)c2cc3cc(ccc3[nH]2)Cl 271570a_100010246260_100000733932 [0,2,0,0,0,0|2,0,0]=4 2107 B18R3.2907 Cn1ncc(n1)c2cc3cc(ccc3[nH]2)F 271570a_100010246264_100000733932 [0,2,0,0,0,0|2,0,0]=4 2108 B18R3.2907 Cn1ncc(n1)c2cc3ccc(cc3[nH]2)Br 271570a_200010246288_100000733932 [0,2,0,0,0,0|2,0,0]=4 2109 B18R3.2907 Nc1cc(n[nH]1)c2cc3cc(ccc3[nH]2)Cl 271570a_100010246260_100009822546 [0,2,0,0,0,0|1,0,0]=3 2110 B18R3.2907 Nc1cc(n[nH]1)c2cc3cc(ccc3[nH]2)F 271570a_100010246264_100009822546 [0,2,0,0,0,0|1,0,0]=3 2111 B18R3.2907 Nc1cc(n[nH]1)c2cc3cc(ccc3o2)Br 271570a_100010176198_100009822546 [0,2,0,0,0,0|2,0,0]=4 2112 B18R3.2907 Nc1cc(n[nH]1)c2cc3cc(ccc3o2)Cl 271570a_100012186365_100009822546 [0,2,0,0,0,0|2,0,0]=4 2113 B18R3.2907 Nc1cc(n[nH]1)c2cc3cc(ccc3o2)F 271570a_100012185221_100009822546 [0,2,0,0,0,0|2,0,0]=4 2114 B18R3.2907 Nc1cc(n[nH]1)c2cc3ccc(cc3[nH]2)Br 271570a_200010246288_100009822546 [0,2,0,0,0,0|1,0,0]=3 2115 B18R3.2907 Nc1cc(n[nH]1)c2cc3ccc(cc3s2)Br 271570a_100015653926_100009822546 [0,2,0,0,0,0|2,0,0]=4 2116 B18R3.2907 Nc1nc(n[nH]1)c2cc3cc(ccc3[nH]2)Cl 271570a_100010246260_100015184587 [0,2,0,0,0,0|2,0,0]=4 2117 B18R3.2907 Nc1nc(n[nH]1)c2cc3cc(ccc3[nH]2)F 271570a_100010246264_100015184587 [0,2,0,0,0,0|2,0,0]=4 2118 B18R3.2907 Nc1nc(n[nH]1)c2cc3ccc(cc3[nH]2)Br 271570a_200010246288_100015184587 [0,2,0,0,0,0|2,0,0]=4 2119 B18R3.15174 CCc1csc(c1)c2nc3ccccc3[nH]2 271570a_100009871738_100009814255 [0,2,0,0,0,0|2,0,0]=4 2120 B18R3.15174 CCn1cc(cn1)c2nc3ccccc3[nH]2 271570a_100011935084_100009814255 [0,2,0,0,0,0|2,0,0]=4 2121 B18R3.15174 CCn1ccc(n1)C2=Cc3ccccc3C2 271570a_100010239756_100012350556 [0,2,0,0,0,0|2,0,0]=4 2122 B18R3.15174 CCn1ccc(n1)c2cc3ccccc3[nH]2 271570a_100010206980_100012350556 [0,2,0,0,0,0|1,0,0]=3 2123 B18R3.15174 CCn1ccc(n1)c2cc3ccccc3o2 271570a_100011328764_100012350556 [0,2,0,0,0,0|2,0,0]=4 2124 B18R3.15174 CCn1ccc(n1)c2cc3ccccc3s2 271570a_100000034353_100012350556 [0,2,0,0,0,0|2,0,0]=4 2125 B18R3.15174 CCn1ccc(n1)c2nc3ccccc3s2 271570a_200000082171_100012350556 [0,2,0,0,0,0|1,0,0]=3 2126 B18R3.15174 COc1csc(c1)c2nc3ccccc3[nH]2 271570a_100010068968_100009814255 [0,2,0,0,0,0|2,0,0]=4 2127 B18R3.15174 N#Cc1cc(c[nH]1)c2cc3ccccc3[nH]2 271570a_100010206980_100009952751 [0,2,0,0,0,0|2,0,0]=4 2128 B18R3.15174 N#Cc1cc(c[nH]1)c2nc3ccccc3s2 271570a_200000082171_100009952751 [0,2,0,0,0,0|2,0,0]=4 2129 B18R3.15174 N#Cc1ccc(s1)c2nc3ccccc3[nH]2 271570a_100000035585_100009814255 [0,2,0,0,0,0|2,0,0]=4 2130 B18R3.15174 O=Cc1cc(co1)c2nc3ccccc3[nH]2 271570a_100000068347_100009814255 [0,2,0,0,0,0|2,0,0]=4 2131 B18R3.15174 O=Cc1cc(cs1)c2nc3ccccc3[nH]2 271570a_100000067010_100009814255 [0,2,0,0,0,0|2,0,0]=4 2132 B18R3.15174 O=Cc1ccc(o1)c2nc3ccccc3[nH]2 271570a_100000034841_100009814255 [0,2,0,0,0,0|2,0,0]=4 2133 B18R3.15174 O=Cc1ccc(s1)c2nc3ccccc3[nH]2 271570a_100000033420_100009814255 [0,2,0,0,0,0|2,0,0]=4 2134 B18R3.15174 O=Cc1coc(c1)c2nc3ccccc3[nH]2 271570a_200000066965_100009814255 [0,2,0,0,0,0|2,0,0]=4 2135 B18R3.15174 OCc1cc(cs1)c2nc3ccccc3[nH]2 271570a_100010198488_100009814255 [0,2,0,0,0,0|2,0,0]=4 2136 B18R3.15174 OCc1ccc(o1)c2nc3ccccc3[nH]2 271570a_200000079978_100009814255 [0,2,0,0,0,0|2,0,0]=4 2137 B18R3.15174 OCc1ccc(s1)c2nc3ccccc3[nH]2 271570a_100010143978_100009814255 [0,2,0,0,0,0|2,0,0]=4 2138 B18R3.31448 Cc1cc(c(s1)C)c2nc3ccccc3[nH]2 271570a_100010068963_100009814255 [0,2,0,0,0,0|2,0,0]=4 2139 B18R3.31448 Cc1cc(n(n1)C)c2nc3ccccc3[nH]2 271570a_100010162543_100009814255 [0,2,0,0,0,0|0,0,2]=4 2140 B18R3.31448 Cc1cn(nc1C2=Cc3ccccc3C2)C 271570a_100010239756_100012644376 [0,2,0,0,0,0|2,0,0]=4 2141 B18R3.31448 Cc1cn(nc1c2cc3ccccc3[nH]2)C 271570a_100010206980_100012644376 [0,2,0,0,0,0|1,0,0]=3 2142 B18R3.31448 Cc1cn(nc1c2cc3ccccc3o2)C 271570a_100011328764_100012644376 [0,2,0,0,0,0|2,0,0]=4 2143 B18R3.31448 Cc1cn(nc1c2cc3ccccc3s2)C 271570a_100000034353_100012644376 [0,2,0,0,0,0|2,0,0]=4 2144 B18R3.31448 Cc1cn(nc1c2nc3ccccc3s2)C 271570a_200000082171_100012644376 [0,2,0,0,0,0|1,0,0]=3 2145 B18R3.31448 Cc1nn(cc1c2nc3ccccc3[nH]2)C 271570a_100011935086_100009814255 [0,2,0,0,0,0|2,0,0]=4 2146 B18R3.31448 Cc1nn(nc1c2cc3ccccc3[nH]2)C 271570a_100010206980_200009884731 [0,2,0,0,0,0|2,0,0]=4 2147 B18R3.31448 Cc1nn(nc1c2nc3ccccc3s2)C 271570a_200000082171_200009884731 [0,2,0,0,0,0|2,0,0]=4 2148 B18R3.31448 Clc1cc(c(s1)Cl)c2nc3ccccc3[nH]2 271570a_100000094514_100009814255 [0,2,0,0,0,0|2,0,0]=4 2149 B18R3.400251 Cc1cc(nn1C)C2=Cc3ccccc3C2 271570a_100010239756_100012001299 [0,2,0,0,0,0|2,0,0]=4 2150 B18R3.400251 Cc1cc(nn1C)c2cc3ccccc3[nH]2 271570a_100010206980_100012001299 [0,2,0,0,0,0|1,0,0]=3 2151 B18R3.400251 Cc1cc(nn1C)c2cc3ccccc3o2 271570a_100011328764_100012001299 [0,2,0,0,0,0|2,0,0]=4 2152 B18R3.400251 Cc1cc(nn1C)c2cc3ccccc3s2 271570a_100000034353_100012001299 [0,2,0,0,0,0|2,0,0]=4 2153 B18R3.400251 Cc1cc(nn1C)c2nc3ccccc3s2 271570a_200000082171_100012001299 [0,2,0,0,0,0|1,0,0]=3 2154 B18R3.400251 Cc1cc(sc1Cl)c2nc3ccccc3[nH]2 271570a_202125692827_100009814255 [0,2,0,0,0,0|2,0,0]=4 2155 B18R3.400251 Cn1nc(cc1N)C2=Cc3ccccc3C2 271570a_100010239756_100000734454 [0,2,0,0,0,0|2,0,0]=4 2156 B18R3.400251 Cn1nc(cc1N)c2cc3ccccc3[nH]2 271570a_100010206980_100000734454 [0,2,0,0,0,0|1,0,0]=3 2157 B18R3.400251 Cn1nc(cc1N)c2cc3ccccc3o2 271570a_100011328764_100000734454 [0,2,0,0,0,0|2,0,0]=4 2158 B18R3.400251 Cn1nc(cc1N)c2cc3ccccc3s2 271570a_100000034353_100000734454 [0,2,0,0,0,0|2,0,0]=4 2159 B18R3.400251 Cn1nc(cc1N)c2nc3ccccc3s2 271570a_200000082171_100000734454 [0,2,0,0,0,0|1,0,0]=3 2160 B18R3.400251 Cn1nc(nc1N)c2cc3ccccc3[nH]2 271570a_100010206980_200010296169 [0,2,0,0,0,0|2,0,0]=4 2161 B18R3.400251 Cn1nc(nc1N)c2nc3ccccc3s2 271570a_200000082171_200010296169 [0,2,0,0,0,0|2,0,0]=4 2162 B18R3.2560847 Cc1[nH]nc(c1C)C2=Cc3ccccc3C2 271570a_100010239756_100015309786 [0,2,0,0,0,0|2,0,0]=4 2163 B18R3.2560847 Cc1[nH]nc(c1C)c2cc3ccccc3[nH]2 271570a_100010206980_100015309786 [0,2,0,0,0,0|1,0,0]=3 2164 B18R3.2560847 Cc1[nH]nc(c1C)c2cc3ccccc3o2 271570a_100011328764_100015309786 [0,2,0,0,0,0|2,0,0]=4 2165 B18R3.2560847 Cc1[nH]nc(c1C)c2cc3ccccc3s2 271570a_100000034353_100015309786 [0,2,0,0,0,0|2,0,0]=4 2166 B18R3.2560847 Cc1[nH]nc(c1C)c2nc3ccccc3s2 271570a_200000082171_100015309786 [0,2,0,0,0,0|1,0,0]=3 2167 B18R3.2560847 Cc1c(cnn1C)c2nc3ccccc3[nH]2 271570a_100011935085_100009814255 [0,2,0,0,0,0|2,0,0]=4 2168 B18R3.11787 Cc1cnn(c1c2nc3ccccc3[nH]2)C 271570a_100010063681_100009814255 [0,2,0,0,0,0|0,0,2]=4 2169 B18R3.11787 Cc1n[nH]c(c1c2nc3ccccc3[nH]2)C 271570a_100000067762_100009814255 [0,2,0,0,0,0|2,0,0]=4 2170 B18R3.19662 CCn1nccc1c2nc3ccccc3[nH]2 271570a_100000701364_100009814255 [0,2,0,0,0,0|0,0,2]=4 2171 B18R3.19662 COc1ccsc1c2nc3ccccc3[nH]2 271570a_100000069662_100009814255 [0,2,0,0,0,0|2,0,0]=4 2172 B18R3.19662 O=Cc1ccoc1c2nc3ccccc3[nH]2 271570a_200000039635_100009814255 [0,2,0,0,0,0|2,0,0]=4 2173 B18R3.19662 O=Cc1ccsc1c2nc3ccccc3[nH]2 271570a_100000034323_100009814255 [0,2,0,0,0,0|2,0,0]=4 2174 B18R3.19662 O=Cc1cscc1c2nc3ccccc3[nH]2 271570a_100000077414_100009814255 [0,2,0,0,0,0|2,0,0]=4 2175 B18R3.19662 O=Cc1sccc1c2nc3ccccc3[nH]2 271570a_100010083059_100009814255 [0,2,0,0,0,0|2,0,0]=4 2176 B18R3.19662 OCc1sccc1c2nc3ccccc3[nH]2 271570a_200009850424_100009814255 [0,2,0,0,0,0|2,0,0]=4 2177 B18R3.560742 Brc1ccc2cc([nH]c2c1)c3n[nH]cc3Br 271570a_200010246288_100015839836 [0,2,0,0,0,0|1,0,0]=3 2178 B18R3.560742 Brc1ccc2cc(sc2c1)c3n[nH]cc3Br 271570a_100015653926_100015839836 [0,2,0,0,0,0|2,0,0]=4 2179 B18R3.560742 Brc1ccc2oc(cc2c1)c3n[nH]cc3Br 271570a_100010176198_100015839836 [0,2,0,0,0,0|2,0,0]=4 2180 B18R3.560742 Cc1c[nH]nc1c2cc3cc(ccc3[nH]2)Br 271570a_100102527747_100011012855 [0,2,0,0,0,0|1,0,0]=3 2181 B18R3.560742 Cc1c[nH]nc1c2cc3cc(ccc3[nH]2)Cl 271570a_100010246260_100009871783 [0,2,0,0,0,0|1,0,0]=3 2182 B18R3.560742 Cc1c[nH]nc1c2cc3cc(ccc3[nH]2)F 271570a_100010246264_100009871783 [0,2,0,0,0,0|1,0,0]=3 2183 B18R3.560742 Cc1c[nH]nc1c2cc3cc(ccc3o2)Br 271570a_100010176198_100009871783 [0,2,0,0,0,0|2,0,0]=4 2184 B18R3.560742 Cc1c[nH]nc1c2cc3cc(ccc3o2)Cl 271570a_100012186365_100009871783 [0,2,0,0,0,0|2,0,0]=4 2185 B18R3.560742 Cc1c[nH]nc1c2cc3cc(ccc3o2)F 271570a_100012185221_100009871783 [0,2,0,0,0,0|2,0,0]=4 2186 B18R3.560742 Cc1c[nH]nc1c2cc3cc(ccc3s2)Br 271570a_100102527747_200010198765 [0,2,0,0,0,0|2,0,0]=4 2187 B18R3.560742 Cc1c[nH]nc1c2cc3ccc(cc3[nH]2)Br 271570a_200010246288_100009871783 [0,2,0,0,0,0|1,0,0]=3 2188 B18R3.560742 Cc1c[nH]nc1c2cc3ccc(cc3s2)Br 271570a_100015653926_100009871783 [0,2,0,0,0,0|2,0,0]=4 2189 B18R3.560742 Cc1c[nH]nc1c2cn3cc(ccc3n2)F 271570a_100102527747_100010231931 [0,2,0,0,0,0|2,0,0]=4 2190 B18R3.560742 Cc1c[nH]nc1c2nc3cc(ccc3s2)F 271570a_100102527747_200010206605 [0,2,0,0,0,0|1,0,0]=3 2191 B18R3.560742 Cc1c[nH]nc1c2nc3cc(ccc3s2)N 271570a_100102527747_100010329861 [0,2,0,0,0,0|1,0,0]=3 2192 B18R3.560742 Cc1c[nH]nc1c2nc3ccc(cc3s2)F 271570a_100102527747_100000751617 [0,2,0,0,0,0|1,0,0]=3 2193 B18R3.560742 Cc1c[nH]nc1c2nc3ccc(cc3s2)N 271570a_100102527747_100010253933 [0,2,0,0,0,0|1,0,0]=3 2194 B18R3.560742 Cc1c[nH]nc1c2nc3ccc(cc3s2)O 271570a_100102527747_100010063415 [0,2,0,0,0,0|1,0,0]=3 2195 B18R3.560742 Cc1c[nH]nc1c2nc3ccc(nc3s2)F 271570a_100102527747_200010738066 [0,2,0,0,0,0|2,0,0]=4 2196 B18R3.560742 Cc1ccc2cc([nH]c2c1)c3n[nH]cc3Br 271570a_100010246276_100015839836 [0,2,0,0,0,0|1,0,0]=3 2197 B18R3.560742 Cc1ccc2cc([nH]c2c1)c3n[nH]cc3C 271570a_100010246276_100009871783 [0,2,0,0,0,0|1,0,0]=3 2198 B18R3.560742 Cc1ccc2cc([nH]c2c1)c3n[nH]cc3N 271570a_100010246276_100010894806 [0,2,0,0,0,0|1,0,0]=3 2199 B18R3.560742 Cc1ccc2nc(sc2c1)c3n[nH]cc3C 271570a_100102527747_100010186437 [0,2,0,0,0,0|1,0,0]=3 2200 B18R3.560742 Cc1ccc2oc(cc2c1)c3n[nH]cc3Br 271570a_200013722915_100015839836 [0,2,0,0,0,0|2,0,0]=4 2201 B18R3.560742 Cc1ccc2oc(cc2c1)c3n[nH]cc3C 271570a_200013722915_100009871783 [0,2,0,0,0,0|2,0,0]=4 2202 B18R3.560742 Cc1ccc2oc(cc2c1)c3n[nH]cc3N 271570a_200013722915_100010894806 [0,2,0,0,0,0|2,0,0]=4 2203 B18R3.560742 Cc1ccc2sc(cc2c1)c3n[nH]cc3Br 271570a_100000057607_100015839836 [0,2,0,0,0,0|2,0,0]=4 2204 B18R3.560742 Cc1ccc2sc(cc2c1)c3n[nH]cc3C 271570a_100000057607_100009871783 [0,2,0,0,0,0|2,0,0]=4 2205 B18R3.560742 Cc1ccc2sc(cc2c1)c3n[nH]cc3N 271570a_100000057607_100010894806 [0,2,0,0,0,0|2,0,0]=4 2206 B18R3.560742 Clc1ccc2[nH]c(cc2c1)c3n[nH]cc3Br 271570a_100010246260_100015839836 [0,2,0,0,0,0|1,0,0]=3 2207 B18R3.560742 Clc1ccc2oc(cc2c1)c3n[nH]cc3Br 271570a_100012186365_100015839836 [0,2,0,0,0,0|2,0,0]=4 2208 B18R3.560742 Fc1ccc2[nH]c(cc2c1)c3n[nH]cc3Br 271570a_100010246264_100015839836 [0,2,0,0,0,0|1,0,0]=3 2209 B18R3.560742 Fc1ccc2oc(cc2c1)c3n[nH]cc3Br 271570a_100012185221_100015839836 [0,2,0,0,0,0|2,0,0]=4 2210 B18R3.560742 Nc1c[nH]nc1c2cc3cc(ccc3[nH]2)Cl 271570a_100010246260_100010894806 [0,2,0,0,0,0|1,0,0]=3 2211 B18R3.560742 Nc1c[nH]nc1c2cc3cc(ccc3[nH]2)F 271570a_100010246264_100010894806 [0,2,0,0,0,0|1,0,0]=3 2212 B18R3.560742 Nc1c[nH]nc1c2cc3cc(ccc3o2)Br 271570a_100010176198_100010894806 [0,2,0,0,0,0|2,0,0]=4 2213 B18R3.560742 Nc1c[nH]nc1c2cc3cc(ccc3o2)Cl 271570a_100012186365_100010894806 [0,2,0,0,0,0|2,0,0]=4 2214 B18R3.560742 Nc1c[nH]nc1c2cc3cc(ccc3o2)F 271570a_100012185221_100010894806 [0,2,0,0,0,0|2,0,0]=4 2215 B18R3.560742 Nc1c[nH]nc1c2cc3ccc(cc3[nH]2)Br 271570a_200010246288_100010894806 [0,2,0,0,0,0|1,0,0]=3 2216 B18R3.560742 Nc1c[nH]nc1c2cc3ccc(cc3s2)Br 271570a_100015653926_100010894806 [0,2,0,0,0,0|2,0,0]=4 2217 B18R3.173304 COc1ccc2[nH]c(cc2c1)c3cc[nH]n3 271570a_100010246265_100000062575 [0,2,0,0,0,0|1,0,0]=3 2218 B18R3.173304 COc1ccc2[nH]c(cc2c1)c3ccsn3 271570a_100010246265_100009818082 [0,2,0,0,0,0|2,0,0]=4 2219 B18R3.173304 COc1ccc2[nH]c(cc2c1)c3nc[nH]n3 271570a_100010246265_100000761765 [0,2,0,0,0,0|2,0,0]=4 2220 B18R3.173304 COc1ccc2cc([nH]c2c1)c3cc[nH]n3 271570a_200010223215_100000062575 [0,2,0,0,0,0|1,0,0]=3 2221 B18R3.173304 COc1ccc2cc([nH]c2c1)c3ccsn3 271570a_200010223215_100009818082 [0,2,0,0,0,0|2,0,0]=4 2222 B18R3.173304 COc1ccc2cc([nH]c2c1)c3nc[nH]n3 271570a_200010223215_100000761765 [0,2,0,0,0,0|2,0,0]=4 2223 B18R3.173304 COc1ccc2cc(oc2c1)c3cc[nH]n3 271570a_200009860666_100000062575 [0,2,0,0,0,0|2,0,0]=4 2224 B18R3.173304 COc1ccc2nc(sc2c1)c3cc[nH]c3 271570a_100000102155_100010195960 [0,2,0,0,0,0|2,0,0]=4 2225 B18R3.173304 COc1ccc2nc(sc2c1)c3cc[nH]n3 271570a_100000062414_100010195960 [0,2,0,0,0,0|1,0,0]=3 2226 B18R3.173304 COc1ccc2oc(cc2c1)c3cc[nH]n3 271570a_100000045403_100000062575 [0,2,0,0,0,0|2,0,0]=4 2227 B18R3.173304 N#Cc1ccc2oc(cc2c1)c3cc[nH]n3 271570a_100009878197_100000062575 [0,2,0,0,0,0|2,0,0]=4 2228 B18R3.173304 N#Cc1ccc2sc(cc2c1)c3cc[nH]n3 271570a_200010193479_100000062575 [0,2,0,0,0,0|2,0,0]=4 2229 B18R3.173304 O=Cc1ccc2nc(sc2c1)c3cc[nH]c3 271570a_100000102155_200010272093 [0,2,0,0,0,0|2,0,0]=4 2230 B18R3.173304 O=Cc1ccc2nc(sc2c1)c3cc[nH]n3 271570a_100000062414_200010272093 [0,2,0,0,0,0|1,0,0]=3 2231 B18R3.173304 O=Cc1ccc2sc(cc2c1)c3cc[nH]n3 271570a_200010177800_100000062575 [0,2,0,0,0,0|2,0,0]=4 2232 B16R3.8 c1ccc2c(n[nH]c2c1)c3cc[nH]n3 271570a_100000062414_100000050141 [0,0,1,1,0,0|2,0,0]=4 2233 B16R3.8 c1ccn2c(cnc2c1)c3cc[nH]n3 271570a_100000062414_100011219245 [0,0,1,1,0,0|2,0,0]=4 2234 B16R3.8 c1ccn2c(nnc2c1)c3cc[nH]c3 271570a_100000102155_100000699609 [0,0,1,1,0,0|2,0,0]=4 2235 B16R3.8 c1ccn2c(nnc2c1)c3cc[nH]n3 271570a_100000062414_100000699609 [0,0,1,1,0,0|1,0,0]=3 2236 B16R3.8 c1ccn2cnc(c2c1)c3cc[nH]n3 271570a_100000062414_100000688344 [0,0,1,1,0,0|2,0,0]=4 2237 B16R3.1779 c1cc(n[nH]1)c2cc3[nH]ccc3cn2 271570a_100000062414_100000089685 [0,0,1,1,0,0|2,0,0]=4 2238 B16R3.1779 c1cc(n[nH]1)c2cc3cc[nH]c3cn2 271570a_100000062414_100009864809 [0,0,1,1,0,0|2,0,0]=4 2239 B16R3.1779 c1cc(n[nH]1)c2cc3sccc3cn2 271570a_100000062414_200016184645 [0,0,1,1,0,0|2,0,0]=4 2240 B16R3.1779 c1cc(n[nH]1)c2ccc3[nH]ccc3n2 271570a_100000062414_100000087148 [0,0,1,1,0,0|2,0,0]=4 2241 B16R3.1779 c1cc(n[nH]1)c2ccc3cc[nH]c3n2 271570a_100000062414_100009814870 [0,0,1,1,0,0|2,0,0]=4 2242 B16R3.1779 c1cc(n[nH]1)c2ccc3occc3n2 271570a_100000062414_100009851292 [0,0,1,1,0,0|2,0,0]=4 2243 B16R3.1779 c1cc(n[nH]1)c2ccc3sccc3n2 271570a_100000062414_100012000956 [0,0,1,1,0,0|2,0,0]=4 2244 B16R3.1779 c1cc(n[nH]1)c2ncc3ccsc3n2 271570a_100000062414_100009840870 [0,0,1,1,0,0|1,0,1]=4 2245 B16R3.1779 c1cc(n[nH]1)c2ncc3sccc3n2 271570a_100000062414_100000117912 [0,0,1,1,0,0|1,0,1]=4 2246 B16R3.5924 c1cc(n2ccnc2c1)c3cc[nH]n3 271570a_100000062414_100000762677 [0,0,1,1,0,0|2,0,0]=4 2247 B16R3.5924 c1cc(n2cncc2c1)c3cc[nH]n3 271570a_100000062414_100009817730 [0,0,1,1,0,0|2,0,0]=4 2248 B16R3.5924 c1cc(n2nccc2c1)c3cc[nH]n3 271570a_100000062414_100009817731 [0,0,1,1,0,0|2,0,0]=4 2249 B16R3.5924 c1cc2[nH]ccc2c(n1)c3cc[nH]n3 271570a_100000062414_100000086534 [0,0,1,1,0,0|2,0,0]=4 2250 B16R3.5924 c1cc2c(nccn2c1)c3cc[nH]n3 271570a_100000062414_100000094558 [0,0,1,1,0,0|2,0,0]=4 2251 B16R3.5924 c1cc2cc[nH]c2c(n1)c3cc[nH]n3 271570a_100000062414_100009816714 [0,0,1,1,0,0|2,0,0]=4 2252 B16R3.5924 c1cc2ccsc2c(n1)c3cc[nH]n3 271570a_100000062414_100000117209 [0,0,1,1,0,0|2,0,0]=4 2253 B16R3.5924 c1cc2occc2c(n1)c3cc[nH]n3 271570a_100000062414_100000041166 [0,0,1,1,0,0|2,0,0]=4 2254 B16R3.5924 c1cc2sccc2c(n1)c3cc[nH]n3 271570a_100000062414_100000047778 [0,0,1,1,0,0|2,0,0]=4 2255 B14R2.114 C=C(c1ccccc1)c2cc[nH]n2 271570a_100000068269_100000062575 [0,0,1,0,1,0|1,0,0]=3 2256 B14R2.114 C=C(c1ccccc1)c2ccsn2 271570a_100000068269_100009818082 [0,0,1,0,1,0|2,0,0]=4 2257 B14R2.114 C=C(c1ccccc1)c2nc[nH]n2 271570a_100000068269_100000761765 [0,0,1,0,1,0|2,0,0]=4 2258 B14R2.50 Brc1ccccc1Sc2cc[nH]n2 62a_100000062575_100000695589 [0,0,1,0,1,0|2,0,0]=4 2259 B14R2.50 Brc1ccccc1Sc2cc[nH]n2 62a_100000695589_100000062575 [0,0,1,0,1,0|2,0,0]=4 2260 B14R2.50 Cc1ccccc1Sc2cc[nH]n2 62a_100000062575_100000210755 [0,0,1,0,1,0|2,0,0]=4 2261 B14R2.50 Cc1ccccc1Sc2cc[nH]n2 62a_100000210755_100000062575 [0,0,1,0,1,0|2,0,0]=4 2262 B14R2.50 Clc1ccccc1Sc2cc[nH]n2 62a_100000062575_100000764095 [0,0,1,0,1,0|2,0,0]=4 2263 B14R2.50 Clc1ccccc1Sc2cc[nH]n2 62a_100000764095_100000062575 [0,0,1,0,1,0|2,0,0]=4 2264 B14R2.50 Fc1ccccc1Sc2cc[nH]n2 62a_100000062575_100011215700 [0,0,1,0,1,0|2,0,0]=4 2265 B14R2.50 Fc1ccccc1Sc2cc[nH]n2 62a_100011215700_100000062575 [0,0,1,0,1,0|2,0,0]=4 2266 B14R2.50 Nc1ccccc1Sc2cc[nH]n2 62a_100000062575_100000210017 [0,0,1,0,1,0|1,0,0]=3 2267 B14R2.50 Nc1ccccc1Sc2cc[nH]n2 62a_100000210017_100000062575 [0,0,1,0,1,0|1,0,0]=3 2268 B14R2.50 Nc1ccccc1Sc2ccon2 62a_100000210017_100009818083 [0,0,1,0,1,0|2,0,0]=4 2269 B14R2.50 Nc1ccccc1Sc2ccon2 62a_100009818083_100000210017 [0,0,1,0,1,0|2,0,0]=4 2270 B14R2.50 Nc1ccccc1Sc2ccsn2 62a_100000210017_100009818082 [0,0,1,0,1,0|2,0,0]=4 2271 B14R2.50 Nc1ccccc1Sc2ccsn2 62a_100009818082_100000210017 [0,0,1,0,1,0|2,0,0]=4 2272 B14R2.50 Nc1ccccc1Sc2nc[nH]n2 62a_100000210017_100000761765 [0,0,1,0,1,0|2,0,0]=4 2273 B14R2.50 Nc1ccccc1Sc2nc[nH]n2 62a_100000761765_100000210017 [0,0,1,0,1,0|2,0,0]=4 2274 B14R2.50 Nc1cccnc1Sc2cc[nH]n2 62a_100000062575_100000688686 [0,0,1,0,1,0|2,0,0]=4 2275 B14R2.50 Nc1cccnc1Sc2cc[nH]n2 62a_100000688686_100000062575 [0,0,1,0,1,0|2,0,0]=4 2276 B14R2.50 Nc1ccncc1Sc2cc[nH]n2 62a_100000047001_100000062575 [0,0,1,0,1,0|2,0,0]=4 2277 B14R2.50 Nc1ccncc1Sc2cc[nH]n2 62a_100000062575_100000047001 [0,0,1,0,1,0|2,0,0]=4 2278 B14R2.50 Nc1cnccc1Sc2cc[nH]n2 62a_100000062575_100000756074 [0,0,1,0,1,0|2,0,0]=4 2279 B14R2.50 Nc1cnccc1Sc2cc[nH]n2 62a_100000756074_100000062575 [0,0,1,0,1,0|2,0,0]=4 2280 B14R2.50 Nc1ncccc1Sc2cc[nH]n2 62a_100000045569_100000062575 [0,0,1,0,1,0|2,0,0]=4 2281 B14R2.50 Nc1ncccc1Sc2cc[nH]n2 62a_100000062575_100000045569 [0,0,1,0,1,0|2,0,0]=4 2282 B14R2.50 Oc1ccccc1Sc2cc[nH]n2 62a_100000062575_100000739446 [0,0,1,0,1,0|2,0,0]=4 2283 B14R2.50 Oc1ccccc1Sc2cc[nH]n2 62a_100000739446_100000062575 [0,0,1,0,1,0|2,0,0]=4 2284 B16R2.2238 CC(=NNc1ccccc1)c2cc[nH]c2 4a_100015195140_100000753940 [0,0,1,0,0,1|2,0,0]=4 2285 B16R2.71 Nc1ccccc1C=Cc2cccnc2 271570a_100102525586_100000210017 [0,0,1,0,0,1|2,0,0]=4 2286 B16R2.2959 Brc1ccccc1CNCc2cc[nH]n2 207a_100000689332_100000738523 [0,0,1,0,0,1|1,0,1]=4 2287 B16R2.2959 Brc1ccccc1CNCc2cc[nH]n2 207a_100000739516_100000211189 [0,0,1,0,0,1|1,0,1]=4 2288 B16R2.2959 Brc1ccccc1CNCc2cc[nH]n2 270004a_100000689332_100000738523 [0,0,1,0,0,1|1,0,1]=4 2289 B16R2.2959 Brc1ccccc1NN=Cc2cc[nH]c2 4a_100000241748_100000760201 [0,0,1,0,0,1|2,0,0]=4 2290 B16R2.2959 Brc1ccccc1NN=Cc2cc[nH]n2 4a_100000241748_100000738523 [0,0,1,0,0,1|1,0,0]=3 2291 B16R2.2959 Brc1cccnc1NN=Cc2cc[nH]n2 4a_100011464834_100000738523 [0,0,1,0,0,1|2,0,0]=4 2292 B16R2.2959 Brc1cnccc1NN=Cc2cc[nH]n2 4a_100013404636_100000738523 [0,0,1,0,0,1|2,0,0]=4 2293 B16R2.2959 Cc1ccccc1CNCc2cc[nH]n2 207a_100000174972_100000738523 [0,0,1,0,0,1|1,0,1]=4 2294 B16R2.2959 Cc1ccccc1CNCc2cc[nH]n2 207a_100000739516_100000211143 [0,0,1,0,0,1|1,0,1]=4 2295 B16R2.2959 Cc1ccccc1CNCc2cc[nH]n2 270004a_100000174972_100000738523 [0,0,1,0,0,1|1,0,1]=4 2296 B16R2.2959 Cc1ccccc1NN=Cc2cc[nH]c2 4a_100000184220_100000760201 [0,0,1,0,0,1|2,0,0]=4 2297 B16R2.2959 Cc1ccccc1NN=Cc2cc[nH]n2 4a_100000184220_100000738523 [0,0,1,0,0,1|1,0,0]=3 2298 B16R2.2959 Cc1cccnc1NN=Cc2cc[nH]n2 4a_100000708268_100000738523 [0,0,1,0,0,1|2,0,0]=4 2299 B16R2.2959 Cc1cnccc1NN=Cc2cc[nH]n2 4a_100011935204_100000738523 [0,0,1,0,0,1|2,0,0]=4 2300 B16R2.2959 Cc1ncccc1NN=Cc2cc[nH]n2 4a_100000730703_100000738523 [0,0,1,0,0,1|2,0,0]=4 2301 B16R2.2959 Clc1ccccc1CNCc2cc[nH]n2 207a_100000174879_100000738523 [0,0,1,0,0,1|1,0,1]=4 2302 B16R2.2959 Clc1ccccc1CNCc2cc[nH]n2 207a_100000739516_100000210073 [0,0,1,0,0,1|1,0,1]=4 2303 B16R2.2959 Clc1ccccc1CNCc2cc[nH]n2 270004a_100000174879_100000738523 [0,0,1,0,0,1|1,0,1]=4 2304 B16R2.2959 Clc1ccccc1NN=Cc2cc[nH]c2 4a_100000683529_100000760201 [0,0,1,0,0,1|2,0,0]=4 2305 B16R2.2959 Clc1ccccc1NN=Cc2cc[nH]n2 4a_100000683529_100000738523 [0,0,1,0,0,1|1,0,0]=3 2306 B16R2.2959 Clc1cccnc1NN=Cc2cc[nH]n2 4a_100000741667_100000738523 [0,0,1,0,0,1|2,0,0]=4 2307 B16R2.2959 Fc1ccccc1CNCc2cc[nH]n2 207a_100000174869_100000738523 [0,0,1,0,0,1|1,0,1]=4 2308 B16R2.2959 Fc1ccccc1CNCc2cc[nH]n2 207a_100000739516_100000210811 [0,0,1,0,0,1|1,0,1]=4 2309 B16R2.2959 Fc1ccccc1CNCc2cc[nH]n2 270004a_100000174869_100000738523 [0,0,1,0,0,1|1,0,1]=4 2310 B16R2.2959 Fc1ccccc1NN=Cc2cc[nH]c2 4a_100000239246_100000760201 [0,0,1,0,0,1|2,0,0]=4 2311 B16R2.2959 Fc1ccccc1NN=Cc2cc[nH]n2 4a_100000239246_100000738523 [0,0,1,0,0,1|1,0,0]=3 2312 B16R2.2959 Fc1cccnc1NN=Cc2cc[nH]n2 4a_100000717775_100000738523 [0,0,1,0,0,1|2,0,0]=4 2313 B16R2.2959 Ic1ccccc1CNCc2cc[nH]n2 207a_100000739516_100000010305 [0,0,1,0,0,1|1,0,1]=4 2314 B16R2.2959 Ic1ccccc1CNCc2cc[nH]n2 207a_100015347259_100000738523 [0,0,1,0,0,1|1,0,1]=4 2315 B16R2.2959 Ic1ccccc1CNCc2cc[nH]n2 270004a_100015347259_100000738523 [0,0,1,0,0,1|1,0,1]=4 2316 B16R2.2959 Ic1ccccc1NN=Cc2cc[nH]c2 4a_100011218156_100000760201 [0,0,1,0,0,1|2,0,0]=4 2317 B16R2.2959 Ic1ccccc1NN=Cc2cc[nH]n2 4a_100011218156_100000738523 [0,0,1,0,0,1|1,0,0]=3 2318 B16R2.2959 Ic1cccnc1NN=Cc2cc[nH]n2 4a_100010221029_100000738523 [0,0,1,0,0,1|2,0,0]=4 2319 B16R2.2959 Oc1ccccc1CNCc2cc[nH]n2 207a_100000185550_100000738523 [0,0,1,0,0,1|1,0,1]=4 2320 B16R2.2959 Oc1ccccc1CNCc2cc[nH]n2 270004a_100000185550_100000738523 [0,0,1,0,0,1|1,0,1]=4 2321 B18R3.2123 c1ccc(nc1)c2cc3ccccc3cn2 271570a_100011264011_100000047361 [0,0,0,0,0,2|2,0,0]=4 2322 B18R3.2123 c1ccc(nc1)c2ccc3ccccc3n2 271570a_100011264011_100011291633 [0,0,0,0,0,2|2,0,0]=4 2323 B18R3.2123 c1ccc(nc1)c2cnc3ccccc3c2 271570a_100011264011_100000737414 [0,0,0,0,0,2|2,0,0]=4 2324 B18R3.2123 c1ccc(nc1)c2cnc3ccccc3c2 271570a_100012350238_100011216584 [0,0,0,0,0,2|2,0,0]=4 2325 B18R3.2123 c1ccc(nc1)c2cnc3ccccc3n2 271570a_100011264011_100000756483 [0,0,0,0,0,2|1,0,1]=4 2326 B18R3.2123 c1ccc(nc1)c2ncc3ccccc3n2 271570a_100011264011_100000097389 [0,0,0,0,0,2|1,0,1]=4 2327 B18R3.2123 c1ccc2cc(ncc2c1)c3cnccn3 271570a_100011962566_100000047361 [0,0,0,0,0,2|2,0,0]=4 2328 B18R3.2123 c1ccc2nc(ccc2c1)c3cnccn3 271570a_100011962566_100011291633 [0,0,0,0,0,2|2,0,0]=4 2329 B18R3.2123 c1ccc2nc(cnc2c1)c3cnccn3 271570a_100011962566_100000756483 [0,0,0,0,0,2|1,0,1]=4 2330 B18R3.2123 c1ccc2nc(ncc2c1)c3cnccn3 271570a_100011962566_100000097389 [0,0,0,0,0,2|1,0,1]=4 2331 B18R3.2123 c1ccc2ncc(cc2c1)c3ccncn3 271570a_100012350238_100000703185 [0,0,0,0,0,2|1,0,1]=4 2332 B18R3.2123 c1ccc2ncc(cc2c1)c3ccnnc3 271570a_100012350238_100000732662 [0,0,0,0,0,2|1,0,1]=4 2333 B18R3.2123 c1ccc2ncc(cc2c1)c3cnccn3 271570a_100011962566_100000737414 [0,0,0,0,0,2|2,0,0]=4 2334 B18R3.2123 c1ccc2ncc(cc2c1)c3cnccn3 271570a_100012350238_100000758340 [0,0,0,0,0,2|2,0,0]=4 2335 B18R3.2123 c1cnc(nc1)c2cnc3ccccc3c2 271570a_100012350238_100000211032 [0,0,0,0,0,2|2,0,0]=4 2336 B18R3.2123 c1cncc(c1)c2cc3ccccc3cn2 271570a_100000757648_100000047361 [0,0,0,0,0,2|2,0,0]=4 2337 B18R3.2123 c1cncc(c1)c2ccc3ccccc3n2 271570a_100000757648_100011291633 [0,0,0,0,0,2|2,0,0]=4 2338 B18R3.2123 c1cncc(c1)c2cnc3ccccc3c2 271570a_100000757648_100000737414 [0,0,0,0,0,2|2,0,0]=4 2339 B18R3.2123 c1cncc(c1)c2cnc3ccccc3c2 271570a_100012350238_100000752921 [0,0,0,0,0,2|2,0,0]=4 2340 B18R3.2123 c1cncc(c1)c2cnc3ccccc3n2 271570a_100000757648_100000756483 [0,0,0,0,0,2|1,0,1]=4 2341 B18R3.2123 c1cncc(c1)c2ncc3ccccc3n2 271570a_100000757648_100000097389 [0,0,0,0,0,2|1,0,1]=4 2342 B18R3.2123 c1cnnc(c1)c2cnc3ccccc3c2 271570a_100012350238_100016991348 [0,0,0,0,0,2|1,0,1]=4 2343 B18R3.36580 c1cc2ccc(nc2cn1)Sc3cc[nH]n3 62a_100000062575_100000020162 [0,0,0,0,0,2|2,0,0]=4 2344 B18R3.36580 c1ccc2cc(ccc2c1)Sc3cc[nH]n3 62a_100000062575_100000233703 [0,0,0,0,0,2|2,0,0]=4 2345 B18R3.36580 c1ccc2cc(ncc2c1)Sc3cc[nH]n3 62a_100000062575_100000047361 [0,0,0,0,0,2|1,0,0]=3 2346 B18R3.36580 c1ccc2cc(ncc2c1)Sc3cc[nH]n3 62a_100009816522_100000062575 [0,0,0,0,0,2|1,0,0]=3 2347 B18R3.36580 c1ccc2cc(ncc2c1)Sc3ccon3 62a_100009816522_100009818083 [0,0,0,0,0,2|2,0,0]=4 2348 B18R3.36580 c1ccc2cc(ncc2c1)Sc3ccon3 62a_100009818083_100000047361 [0,0,0,0,0,2|2,0,0]=4 2349 B18R3.36580 c1ccc2cc(ncc2c1)Sc3ccsn3 62a_100009816522_100009818082 [0,0,0,0,0,2|2,0,0]=4 2350 B18R3.36580 c1ccc2cc(ncc2c1)Sc3ccsn3 62a_100009818082_100000047361 [0,0,0,0,0,2|2,0,0]=4 2351 B18R3.36580 c1ccc2cc(ncc2c1)Sc3nc[nH]n3 62a_100000761765_100000047361 [0,0,0,0,0,2|2,0,0]=4 2352 B18R3.36580 c1ccc2cc(ncc2c1)Sc3nc[nH]n3 62a_100009816522_100000761765 [0,0,0,0,0,2|2,0,0]=4 2353 B18R3.36580 c1ccc2nc(ccc2c1)Sc3cc[nH]n3 62a_100000062575_100011291633 [0,0,0,0,0,2|1,0,0]=3 2354 B18R3.36580 c1ccc2nc(ccc2c1)Sc3cc[nH]n3 62a_100011291633_100000062575 [0,0,0,0,0,2|1,0,0]=3 2355 B18R3.36580 c1ccc2nc(ccc2c1)Sc3ccon3 62a_100009818083_100011291633 [0,0,0,0,0,2|2,0,0]=4 2356 B18R3.36580 c1ccc2nc(ccc2c1)Sc3ccon3 62a_100011291633_100009818083 [0,0,0,0,0,2|2,0,0]=4 2357 B18R3.36580 c1ccc2nc(ccc2c1)Sc3ccsn3 62a_100009818082_100011291633 [0,0,0,0,0,2|2,0,0]=4 2358 B18R3.36580 c1ccc2nc(ccc2c1)Sc3ccsn3 62a_100011291633_100009818082 [0,0,0,0,0,2|2,0,0]=4 2359 B18R3.36580 c1ccc2nc(ccc2c1)Sc3nc[nH]n3 62a_100000761765_100011291633 [0,0,0,0,0,2|2,0,0]=4 2360 B18R3.36580 c1ccc2nc(ccc2c1)Sc3nc[nH]n3 62a_100011291633_100000761765 [0,0,0,0,0,2|2,0,0]=4 2361 B18R3.36580 c1ccc2nc(cnc2c1)Sc3cc[nH]n3 62a_100000062575_100000756483 [0,0,0,0,0,2|0,0,1]=3 2362 B18R3.36580 c1ccc2nc(cnc2c1)Sc3cc[nH]n3 62a_100000756483_100000062575 [0,0,0,0,0,2|0,0,1]=3 2363 B18R3.36580 c1ccc2nc(cnc2c1)Sc3ccon3 62a_100000756483_100009818083 [0,0,0,0,0,2|1,0,1]=4 2364 B18R3.36580 c1ccc2nc(cnc2c1)Sc3ccon3 62a_100009818083_100000756483 [0,0,0,0,0,2|1,0,1]=4 2365 B18R3.36580 c1ccc2nc(cnc2c1)Sc3ccsn3 62a_100000756483_100009818082 [0,0,0,0,0,2|1,0,1]=4 2366 B18R3.36580 c1ccc2nc(cnc2c1)Sc3ccsn3 62a_100009818082_100000756483 [0,0,0,0,0,2|1,0,1]=4 2367 B18R3.36580 c1ccc2nc(cnc2c1)Sc3nc[nH]n3 62a_100000756483_100000761765 [0,0,0,0,0,2|1,0,1]=4 2368 B18R3.36580 c1ccc2nc(cnc2c1)Sc3nc[nH]n3 62a_100000761765_100000756483 [0,0,0,0,0,2|1,0,1]=4 2369 B18R3.36580 c1ccc2nc(ncc2c1)Sc3cc[nH]n3 62a_100000062575_100000097389 [0,0,0,0,0,2|0,0,1]=3 2370 B18R3.36580 c1ccc2nc(ncc2c1)Sc3ccon3 62a_100009818083_100000097389 [0,0,0,0,0,2|1,0,1]=4 2371 B18R3.36580 c1ccc2nc(ncc2c1)Sc3ccsn3 62a_100009818082_100000097389 [0,0,0,0,0,2|1,0,1]=4 2372 B18R3.36580 c1ccc2nc(ncc2c1)Sc3nc[nH]n3 62a_100000761765_100000097389 [0,0,0,0,0,2|1,0,1]=4 2373 B18R3.36580 c1ccc2ncc(cc2c1)Sc3cc[nH]n3 62a_100000062575_100000737414 [0,0,0,0,0,2|1,0,0]=3 2374 B18R3.36580 c1ccc2ncc(cc2c1)Sc3ccon3 62a_100009818083_100000737414 [0,0,0,0,0,2|2,0,0]=4 2375 B18R3.36580 c1ccc2ncc(cc2c1)Sc3ccsn3 62a_100009818082_100000737414 [0,0,0,0,0,2|2,0,0]=4 2376 B18R3.36580 c1ccc2ncc(cc2c1)Sc3nc[nH]n3 62a_100000761765_100000737414 [0,0,0,0,0,2|2,0,0]=4 2377 B18R3.36580 c1cnc2cc(cnc2c1)Sc3cc[nH]n3 62a_100000062575_100010246316 [0,0,0,0,0,2|2,0,0]=4 2378 B18R3.36580 c1cnc2cc(cnc2c1)Sc3cc[nH]n3 62a_100010246316_100000062575 [0,0,0,0,0,2|2,0,0]=4 2379 B18R3.36580 c1cnc2ccc(nc2c1)Sc3cc[nH]n3 62a_100000062575_100000073381 [0,0,0,0,0,2|2,0,0]=4 2380 B18R3.36580 c1cnc2nc(ccc2c1)Sc3cc[nH]n3 62a_100000062575_100000075685 [0,0,0,0,0,2|2,0,0]=4 2381 B18R3.36580 c1cnc2nc(ccc2c1)Sc3cc[nH]n3 62a_100000075685_100000062575 [0,0,0,0,0,2|2,0,0]=4 2382 B18R3.36580 c1cnc2nc(cnc2c1)Sc3cc[nH]n3 62a_100000062575_200010275043 [0,0,0,0,0,2|1,0,1]=4 2383 B18R3.36580 c1cnc2nc(cnc2c1)Sc3cc[nH]n3 62a_200010275043_100000062575 [0,0,0,0,0,2|1,0,1]=4 2384 B18R3.36580 c1cnc2nc(ncc2c1)Sc3cc[nH]n3 62a_100000062575_100009875485 [0,0,0,0,0,2|1,0,1]=4 2385 B18R3.36580 c1cnc2nc(ncc2c1)Sc3cc[nH]n3 62a_100009875485_100000062575 [0,0,0,0,0,2|1,0,1]=4 2386 B18R3.36580 c1cnc2ncc(nc2c1)Sc3cc[nH]n3 62a_100000062575_100000084304 [0,0,0,0,0,2|1,0,1]=4 2387 B18R3.36580 c1cnc2ncc(nc2c1)Sc3cc[nH]n3 62a_100000084304_100000062575 [0,0,0,0,0,2|1,0,1]=4 2388 B18R3.12728 C1=CC(=NNc2nc3ccccc3[nH]2)CC1 4a_100000188875_100000239507 [0,0,0,0,0,2|2,0,0]=4 2389 B18R3.12728 c1ccc2[nH]c(cc2c1)SCc3ccon3 62a_100000234950_100010232065 [0,0,0,0,0,2|2,0,0]=4 2390 B18R3.12728 c1ccc2[nH]c(nc2c1)CNc3nncs3 27a_100000729406_100000739804 [0,0,0,0,0,2|1,0,1]=4 2391 B18R3.12728 c1ccc2[nH]c(nc2c1)COc3ccsc3 7a_100000106738_100000737899 [0,0,0,0,0,2|2,0,0]=4 2392 B18R3.12728 c1ccc2[nH]c(nc2c1)CSc3c[nH]cn3 62a_100000756875_100000737899 [0,0,0,0,0,2|2,0,0]=4 2393 B18R3.12728 c1ccc2[nH]c(nc2c1)CSc3c[nH]nn3 62a_100009819707_100000737899 [0,0,0,0,0,2|1,0,1]=4 2394 B18R3.12728 c1ccc2[nH]c(nc2c1)CSc3cc[nH]n3 62a_100000062575_100000737899 [0,0,0,0,0,2|0,0,0]=2 2395 B18R3.12728 c1ccc2[nH]c(nc2c1)CSc3ccoc3 62a_100011215275_100000737899 [0,0,0,0,0,2|2,0,0]=4 2396 B18R3.12728 c1ccc2[nH]c(nc2c1)CSc3ccon3 62a_100009818083_100000737899 [0,0,0,0,0,2|1,0,0]=3 2397 B18R3.12728 c1ccc2[nH]c(nc2c1)CSc3ccsc3 62a_100000738268_100000737899 [0,0,0,0,0,2|2,0,0]=4 2398 B18R3.12728 c1ccc2[nH]c(nc2c1)CSc3ccsn3 62a_100009818082_100000737899 [0,0,0,0,0,2|1,0,0]=3 2399 B18R3.12728 c1ccc2[nH]c(nc2c1)CSc3cn[nH]c3 62a_100000238712_100000737899 [0,0,0,0,0,2|2,0,0]=4 2400 B18R3.12728 c1ccc2[nH]c(nc2c1)CSc3cscn3 62a_100000751502_100000737899 [0,0,0,0,0,2|2,0,0]=4 2401 B18R3.12728 c1ccc2[nH]c(nc2c1)CSc3nc[nH]n3 62a_100000761765_100000737899 [0,0,0,0,0,2|1,0,0]=3 2402 B18R3.12728 c1ccc2[nH]c(nc2c1)CSc3ncc[nH]3 62a_100025796157_100000737899 [0,0,0,0,0,2|2,0,0]=4 2403 B18R3.12728 c1ccc2[nH]c(nc2c1)CSc3ncco3 62a_100011787736_100000737899 [0,0,0,0,0,2|2,0,0]=4 2404 B18R3.12728 c1ccc2[nH]c(nc2c1)CSc3nccs3 62a_100000211983_100000737899 [0,0,0,0,0,2|2,0,0]=4 2405 B18R3.12728 c1ccc2[nH]c(nc2c1)CSc3nncs3 62a_100000739804_100000737899 [0,0,0,0,0,2|1,0,1]=4 2406 B18R3.12728 c1ccc2[nH]c(nc2c1)NCc3c[nH]cn3 27a_100000758547_100009814255 [0,0,0,0,0,2|2,0,0]=4 2407 B18R3.12728 c1ccc2[nH]c(nc2c1)NCc3c[nH]nn3 27a_100020620823_100009814255 [0,0,0,0,0,2|1,0,1]=4 2408 B18R3.12728 c1ccc2[nH]c(nc2c1)NCc3cc[nH]n3 27a_100000739516_100009814255 [0,0,0,0,0,2|0,0,0]=2 2409 B18R3.12728 c1ccc2[nH]c(nc2c1)NCc3ccoc3 27a_100015206860_100009814255 [0,0,0,0,0,2|2,0,0]=4 2410 B18R3.12728 c1ccc2[nH]c(nc2c1)NCc3ccon3 27a_100000688301_100009814255 [0,0,0,0,0,2|1,0,0]=3 2411 B18R3.12728 c1ccc2[nH]c(nc2c1)NCc3ccsc3 27a_100000186416_100009814255 [0,0,0,0,0,2|2,0,0]=4 2412 B18R3.12728 c1ccc2[nH]c(nc2c1)NCc3cn[nH]c3 27a_100000737208_100009814255 [0,0,0,0,0,2|2,0,0]=4 2413 B18R3.12728 c1ccc2[nH]c(nc2c1)NCc3cocn3 27a_100015188801_100009814255 [0,0,0,0,0,2|2,0,0]=4 2414 B18R3.12728 c1ccc2[nH]c(nc2c1)NCc3cscn3 27a_100015185402_100009814255 [0,0,0,0,0,2|2,0,0]=4 2415 B18R3.12728 c1ccc2[nH]c(nc2c1)NCc3ncc[nH]3 27a_100000754540_100009814255 [0,0,0,0,0,2|2,0,0]=4 2416 B18R3.12728 c1ccc2[nH]c(nc2c1)NCc3ncco3 27a_100016994969_100009814255 [0,0,0,0,0,2|2,0,0]=4 2417 B18R3.12728 c1ccc2[nH]c(nc2c1)NCc3nccs3 27a_100000740555_100009814255 [0,0,0,0,0,2|2,0,0]=4 2418 B18R3.12728 c1ccc2[nH]c(nc2c1)NCc3nnc[nH]3 27a_200015183720_100009814255 [0,0,0,0,0,2|1,0,1]=4 2419 B18R3.12728 c1ccc2[nH]c(nc2c1)SCc3c[nH]cn3 62a_100000707719_100009814255 [0,0,0,0,0,2|2,0,0]=4 2420 B18R3.12728 c1ccc2[nH]c(nc2c1)SCc3ccn[nH]3 62a_100000728653_100009814255 [0,0,0,0,0,2|0,0,2]=4 2421 B18R3.12728 c1ccc2[nH]c(nc2c1)SCc3ccon3 62a_100000234950_100009814255 [0,0,0,0,0,2|1,0,0]=3 2422 B18R3.12728 c1ccc2[nH]c(nc2c1)SCc3ccsc3 62a_100011261437_100009814255 [0,0,0,0,0,2|2,0,0]=4 2423 B18R3.12728 c1ccc2[nH]c(nc2c1)SCc3cscn3 62a_100000205941_100009814255 [0,0,0,0,0,2|2,0,0]=4 2424 B18R3.12728 c1ccc2[nH]c(nc2c1)SCc3ncc[nH]3 62a_100016991755_100009814255 [0,0,0,0,0,2|2,0,0]=4 2425 B18R3.12728 c1ccc2[nH]c(nc2c1)SCc3ncco3 62a_103436540062_100009814255 [0,0,0,0,0,2|2,0,0]=4 2426 B18R3.12728 c1ccc2[nH]c(nc2c1)SCc3nccs3 62a_100015184050_100009814255 [0,0,0,0,0,2|2,0,0]=4 2427 B18R3.12728 c1ccc2[nH]c(nc2c1)SCc3ncon3 62a_100000233494_100009814255 [0,0,0,0,0,2|2,0,0]=4 2428 B18R3.12728 c1ccc2oc(nc2c1)CSc3cc[nH]n3 62a_100000062575_100000195508 [0,0,0,0,0,2|1,0,0]=3 2429 B18R3.12728 c1ccc2oc(nc2c1)CSc3ccon3 62a_100009818083_100000195508 [0,0,0,0,0,2|2,0,0]=4 2430 B18R3.12728 c1ccc2oc(nc2c1)CSc3ccsn3 62a_100009818082_100000195508 [0,0,0,0,0,2|2,0,0]=4 2431 B18R3.12728 c1ccc2oc(nc2c1)CSc3nc[nH]n3 62a_100000761765_100000195508 [0,0,0,0,0,2|2,0,0]=4 2432 B18R3.12728 c1ccc2sc(nc2c1)CSc3cc[nH]n3 62a_100000062575_100000766747 [0,0,0,0,0,2|1,0,0]=3 2433 B18R3.12728 c1ccc2sc(nc2c1)CSc3cc[nH]n3 62a_100011217541_100000062575 [0,0,0,0,0,2|1,0,0]=3 2434 B18R3.12728 c1ccc2sc(nc2c1)CSc3ccon3 62a_100009818083_100000766747 [0,0,0,0,0,2|2,0,0]=4 2435 B18R3.12728 c1ccc2sc(nc2c1)CSc3ccon3 62a_100011217541_100009818083 [0,0,0,0,0,2|2,0,0]=4 2436 B18R3.12728 c1ccc2sc(nc2c1)CSc3ccsn3 62a_100009818082_100000766747 [0,0,0,0,0,2|2,0,0]=4 2437 B18R3.12728 c1ccc2sc(nc2c1)CSc3ccsn3 62a_100011217541_100009818082 [0,0,0,0,0,2|2,0,0]=4 2438 B18R3.12728 c1ccc2sc(nc2c1)CSc3nc[nH]n3 62a_100000761765_100000766747 [0,0,0,0,0,2|2,0,0]=4 2439 B18R3.12728 c1ccc2sc(nc2c1)CSc3nc[nH]n3 62a_100011217541_100000761765 [0,0,0,0,0,2|2,0,0]=4 2440 B18R3.12728 c1ccc2sc(nc2c1)NCc3cc[nH]n3 27a_100000739516_100000751744 [0,0,0,0,0,2|1,0,0]=3 2441 B18R3.12728 c1ccc2sc(nc2c1)NCc3ccon3 27a_100000688301_100000751744 [0,0,0,0,0,2|2,0,0]=4 2442 B18R3.12728 c1ccc2sc(nc2c1)SCc3ccon3 62a_100000234950_100000751744 [0,0,0,0,0,2|2,0,0]=4 2443 B18R3.12728 c1ccn2cc(nc2c1)CSc3cc[nH]n3 62a_100000062575_100000689847 [0,0,0,0,0,2|2,0,0]=4 2444 B18R3.12728 c1ccn2cc(nc2c1)CSc3cc[nH]n3 62a_100000689847_100000062575 [0,0,0,0,0,2|2,0,0]=4 2445 B18R3.12728 c1cnc2[nH]c(nc2c1)CSc3cc[nH]n3 62a_100011549802_100000062575 [0,0,0,0,0,2|1,0,0]=3 2446 B18R3.12728 c1cnc2[nH]c(nc2c1)CSc3ccon3 62a_100011549802_100009818083 [0,0,0,0,0,2|2,0,0]=4 2447 B18R3.12728 c1cnc2[nH]c(nc2c1)CSc3ccsn3 62a_100011549802_100009818082 [0,0,0,0,0,2|2,0,0]=4 2448 B18R3.12728 c1cnc2[nH]c(nc2c1)CSc3nc[nH]n3 62a_100011549802_100000761765 [0,0,0,0,0,2|2,0,0]=4 2449 B18R3.12728 c1cnc2nc(oc2c1)CSc3cc[nH]n3 62a_100000062575_100000696355 [0,0,0,0,0,2|2,0,0]=4 2450 B18R3.12728 c1cnc2sc(nc2c1)NCc3cc[nH]n3 27a_100000739516_100010188088 [0,0,0,0,0,2|2,0,0]=4 2451 B18R3.12728 c1coc(c1)CNc2nc3ccccc3[nH]2 27a_100000185738_100009814255 [0,0,0,0,0,2|2,0,0]=4 2452 B18R3.12728 c1coc(c1)SCc2nc3ccccc3[nH]2 62a_100009814098_100000737899 [0,0,0,0,0,2|2,0,0]=4 2453 B18R3.12728 c1csc(c1)CNc2nc3ccccc3[nH]2 27a_100000211653_100009814255 [0,0,0,0,0,2|2,0,0]=4 2454 B18R3.12728 c1csc(c1)SCc2nc3ccccc3[nH]2 62a_100011215356_100000737899 [0,0,0,0,0,2|2,0,0]=4 2455 B18R3.12875 c1ccc(cc1)Nc2nc3ccccc3[nH]2 27a_100000106764_100009814255 [0,0,0,0,0,2|2,0,0]=4 2456 B18R3.12875 c1ccc(cc1)Sc2nc3ccccc3[nH]2 62a_100000719477_100009814255 [0,0,0,0,0,2|2,0,0]=4 2457 B18R3.12875 c1ccc(nc1)Sc2cc3ccccc3[nH]2 62a_100011216584_100010232065 [0,0,0,0,0,2|2,0,0]=4 2458 B18R3.12875 c1ccc(nc1)Sc2nc3ccccc3[nH]2 62a_100011216584_100009814255 [0,0,0,0,0,2|1,0,0]=3 2459 B18R3.12875 c1ccc(nc1)Sc2nc3ccccc3s2 62a_100011216584_100000751744 [0,0,0,0,0,2|2,0,0]=4 2460 B18R3.12875 c1ccc2[nH]c(cc2c1)Sc3ccncn3 62a_100000703185_100010232065 [0,0,0,0,0,2|1,0,1]=4 2461 B18R3.12875 c1ccc2[nH]c(cc2c1)Sc3ccnnc3 62a_100000732662_100010232065 [0,0,0,0,0,2|1,0,1]=4 2462 B18R3.12875 c1ccc2[nH]c(cc2c1)Sc3cnccn3 62a_100000211759_100010232065 [0,0,0,0,0,2|2,0,0]=4 2463 B18R3.12875 c1ccc2[nH]c(nc2c1)Sc3ccncc3 62a_100000728582_100009814255 [0,0,0,0,0,2|1,0,1]=4 2464 B18R3.12875 c1ccc2[nH]c(nc2c1)Sc3ccncn3 62a_100000703185_100009814255 [0,0,0,0,0,2|0,0,1]=3 2465 B18R3.12875 c1ccc2[nH]c(nc2c1)Sc3ccnnc3 62a_100000732662_100009814255 [0,0,0,0,0,2|0,0,1]=3 2466 B18R3.12875 c1ccc2[nH]c(nc2c1)Sc3cnccn3 62a_100000211759_100009814255 [0,0,0,0,0,2|1,0,0]=3 2467 B18R3.12875 c1ccc2[nH]c(nc2c1)Sc3cncnc3 62a_100011206942_100009814255 [0,0,0,0,0,2|1,0,1]=4 2468 B18R3.12875 c1ccc2[nH]c(nc2c1)Sc3cnnnc3 62a_100009846058_100009814255 [0,0,0,0,0,2|1,0,1]=4 2469 B18R3.12875 c1ccc2sc(nc2c1)Sc3ccncn3 62a_100000703185_100000751744 [0,0,0,0,0,2|1,0,1]=4 2470 B18R3.12875 c1ccc2sc(nc2c1)Sc3ccnnc3 62a_100000732662_100000751744 [0,0,0,0,0,2|1,0,1]=4 2471 B18R3.12875 c1ccc2sc(nc2c1)Sc3cnccn3 62a_100000211759_100000751744 [0,0,0,0,0,2|2,0,0]=4 2472 B18R3.12875 c1cnc(nc1)Sc2cc3ccccc3[nH]2 62a_100000211032_100010232065 [0,0,0,0,0,2|2,0,0]=4 2473 B18R3.12875 c1cnc(nc1)Sc2nc3ccccc3[nH]2 62a_100000211032_100009814255 [0,0,0,0,0,2|1,0,0]=3 2474 B18R3.12875 c1cnc(nc1)Sc2nc3ccccc3s2 62a_100000211032_100000751744 [0,0,0,0,0,2|2,0,0]=4 2475 B18R3.12875 c1cncc(c1)Sc2cc3ccccc3[nH]2 62a_100000210063_100010232065 [0,0,0,0,0,2|2,0,0]=4 2476 B18R3.12875 c1cncc(c1)Sc2nc3ccccc3[nH]2 62a_100000210063_100009814255 [0,0,0,0,0,2|1,0,0]=3 2477 B18R3.12875 c1cncc(c1)Sc2nc3ccccc3s2 62a_100000210063_100000751744 [0,0,0,0,0,2|2,0,0]=4 2478 B18R3.12875 c1cnnc(c1)Sc2cc3ccccc3[nH]2 62a_100016991348_100010232065 [0,0,0,0,0,2|1,0,1]=4 2479 B18R3.12875 c1cnnc(c1)Sc2nc3ccccc3[nH]2 62a_100016991348_100009814255 [0,0,0,0,0,2|0,0,1]=3 2480 B18R3.12875 c1cnnc(c1)Sc2nc3ccccc3s2 62a_100016991348_100000751744 [0,0,0,0,0,2|1,0,1]=4