0 B11R2.2 C1=CCN(C1)c2ncns2 27a_100015195280_100000693119 [0,0,0,0,0,0|2,0,2]=4 1 B11R2.2 C1=CCN(C1)c2nncs2 27a_100015195280_100000739804 [0,0,0,0,0,0|2,0,2]=4 2 B11R2.2 c1c[nH]c(n1)c2cc[nH]c2 271570a_100000102155_100025796157 [0,0,0,0,0,0|3,0,1]=4 3 B11R2.2 c1c[nH]c(n1)c2ccoc2 271570a_100011218838_100025796157 [0,0,0,0,0,0|3,0,1]=4 4 B11R2.2 c1c[nH]c(n1)c2ccoc2 271570a_100016988920_100011215275 [0,0,0,0,0,0|3,0,1]=4 5 B11R2.2 c1c[nH]c(n1)c2ccsc2 271570a_100011934443_100025796157 [0,0,0,0,0,0|3,0,1]=4 6 B11R2.2 c1c[nH]c(n1)c2ccsc2 271570a_100016988920_100000738268 [0,0,0,0,0,0|3,0,1]=4 7 B11R2.2 c1c[nH]c(n1)c2nc[nH]n2 271570a_100016988920_100000761765 [0,0,0,0,0,0|4,0,0]=4 8 B11R2.2 c1cc(c[nH]1)c2c[nH]cn2 271570a_100000102155_100000756875 [0,0,0,0,0,0|4,0,0]=4 9 B11R2.2 c1cc(c[nH]1)c2cc[nH]n2 271570a_100000102155_100000062575 [0,0,0,0,0,0|4,0,0]=4 10 B11R2.2 c1cc(c[nH]1)c2ccoc2 271570a_100000102155_100011215275 [0,0,0,0,0,0|4,0,0]=4 11 B11R2.2 c1cc(c[nH]1)c2ccsn2 271570a_100000102155_100009818082 [0,0,0,0,0,0|3,1,0]=4 12 B11R2.2 c1cc(c[nH]1)c2cscn2 271570a_100000102155_100000751502 [0,0,0,0,0,0|3,1,0]=4 13 B11R2.2 c1cc(c[nH]1)c2nc[nH]n2 271570a_100000102155_100000761765 [0,0,0,0,0,0|3,0,0]=3 14 B11R2.2 c1cc(c[nH]1)c2nncs2 271570a_100000102155_100000739804 [0,0,0,0,0,0|4,0,0]=4 15 B11R2.2 c1cc(co1)c2ccoc2 271570a_100011218838_100011215275 [0,0,0,0,0,0|4,0,0]=4 16 B11R2.2 c1cc(co1)c2ccsc2 271570a_100011218838_100000738268 [0,0,0,0,0,0|4,0,0]=4 17 B11R2.2 c1cc(co1)c2ccsc2 271570a_100011934443_100011215275 [0,0,0,0,0,0|4,0,0]=4 18 B11R2.2 c1cc(co1)c2ccsn2 271570a_100011218838_100009818082 [0,0,0,0,0,0|3,1,0]=4 19 B11R2.2 c1cc(co1)c2cscn2 271570a_100011218838_100000751502 [0,0,0,0,0,0|3,1,0]=4 20 B11R2.2 c1cc(co1)c2nncs2 271570a_100011218838_100000739804 [0,0,0,0,0,0|4,0,0]=4 21 B11R2.2 c1cc(cs1)c2ccsn2 271570a_100011934443_100009818082 [0,0,0,0,0,0|3,1,0]=4 22 B11R2.2 c1cc(cs1)c2cscn2 271570a_100011934443_100000751502 [0,0,0,0,0,0|3,1,0]=4 23 B11R2.2 c1cc(cs1)c2nncs2 271570a_100011934443_100000739804 [0,0,0,0,0,0|4,0,0]=4 24 B11R2.2 c1cc(n[nH]1)c2ccoc2 271570a_100000062414_100011215275 [0,0,0,0,0,0|4,0,0]=4 25 B11R2.2 c1cc(n[nH]1)c2ccoc2 271570a_100011218838_100000062575 [0,0,0,0,0,0|4,0,0]=4 26 B11R2.2 c1cc(n[nH]1)c2ccsc2 271570a_100000062414_100000738268 [0,0,0,0,0,0|4,0,0]=4 27 B11R2.2 c1cc(n[nH]1)c2ccsc2 271570a_100011934443_100000062575 [0,0,0,0,0,0|4,0,0]=4 28 B11R2.2 c1cc(n[nH]1)c2nc[nH]n2 271570a_100000062414_100000761765 [0,0,0,0,0,0|4,0,0]=4 29 B11R2.2 c1coc(c1)c2c[nH]cn2 271570a_100000750936_100000756875 [0,0,0,0,0,0|4,0,0]=4 30 B11R2.2 c1coc(c1)c2cc[nH]n2 271570a_100000062414_100009814098 [0,0,0,0,0,0|4,0,0]=4 31 B11R2.2 c1coc(c1)c2cc[nH]n2 271570a_100000750936_100000062575 [0,0,0,0,0,0|4,0,0]=4 32 B11R2.2 c1coc(c1)c2ccoc2 271570a_100000750936_100011215275 [0,0,0,0,0,0|4,0,0]=4 33 B11R2.2 c1coc(c1)c2ccoc2 271570a_100011218838_100009814098 [0,0,0,0,0,0|4,0,0]=4 34 B11R2.2 c1coc(c1)c2ccsn2 271570a_100000750936_100009818082 [0,0,0,0,0,0|3,1,0]=4 35 B11R2.2 c1coc(c1)c2cscn2 271570a_100000750936_100000751502 [0,0,0,0,0,0|3,1,0]=4 36 B11R2.2 c1coc(c1)c2nc[nH]n2 271570a_100000750936_100000761765 [0,0,0,0,0,0|3,0,0]=3 37 B11R2.2 c1coc(c1)c2ncc[nH]2 271570a_100000750936_100025796157 [0,0,0,0,0,0|3,0,1]=4 38 B11R2.2 c1coc(c1)c2ncc[nH]2 271570a_100016988920_100009814098 [0,0,0,0,0,0|3,0,1]=4 39 B11R2.2 c1coc(c1)c2ncco2 271570a_100000750936_100011787736 [0,0,0,0,0,0|4,0,0]=4 40 B11R2.2 c1coc(c1)c2nccs2 271570a_100000750936_100000211983 [0,0,0,0,0,0|4,0,0]=4 41 B11R2.2 c1coc(c1)c2ncns2 271570a_100000750936_100000693119 [0,0,0,0,0,0|4,0,0]=4 42 B11R2.2 c1coc(c1)c2nncs2 271570a_100000750936_100000739804 [0,0,0,0,0,0|4,0,0]=4 43 B11R2.2 c1coc(n1)c2cc[nH]c2 271570a_100000102155_100011787736 [0,0,0,0,0,0|4,0,0]=4 44 B11R2.2 c1coc(n1)c2ccoc2 271570a_100011218838_100011787736 [0,0,0,0,0,0|4,0,0]=4 45 B11R2.2 c1coc(n1)c2ccsc2 271570a_100011934443_100011787736 [0,0,0,0,0,0|4,0,0]=4 46 B11R2.2 c1csc(c1)c2c[nH]cn2 271570a_100000742291_100000756875 [0,0,0,0,0,0|4,0,0]=4 47 B11R2.2 c1csc(c1)c2cc[nH]n2 271570a_100000062414_100011215356 [0,0,0,0,0,0|4,0,0]=4 48 B11R2.2 c1csc(c1)c2cc[nH]n2 271570a_100000742291_100000062575 [0,0,0,0,0,0|4,0,0]=4 49 B11R2.2 c1csc(c1)c2ccoc2 271570a_100000742291_100011215275 [0,0,0,0,0,0|4,0,0]=4 50 B11R2.2 c1csc(c1)c2ccoc2 271570a_100011218838_100011215356 [0,0,0,0,0,0|4,0,0]=4 51 B11R2.2 c1csc(c1)c2ccsn2 271570a_100000742291_100009818082 [0,0,0,0,0,0|3,1,0]=4 52 B11R2.2 c1csc(c1)c2cscn2 271570a_100000742291_100000751502 [0,0,0,0,0,0|3,1,0]=4 53 B11R2.2 c1csc(c1)c2nc[nH]n2 271570a_100000742291_100000761765 [0,0,0,0,0,0|3,0,0]=3 54 B11R2.2 c1csc(c1)c2ncc[nH]2 271570a_100000742291_100025796157 [0,0,0,0,0,0|3,0,1]=4 55 B11R2.2 c1csc(c1)c2ncc[nH]2 271570a_100016988920_100011215356 [0,0,0,0,0,0|3,0,1]=4 56 B11R2.2 c1csc(c1)c2ncco2 271570a_100000742291_100011787736 [0,0,0,0,0,0|4,0,0]=4 57 B11R2.2 c1csc(c1)c2nccs2 271570a_100000742291_100000211983 [0,0,0,0,0,0|4,0,0]=4 58 B11R2.2 c1csc(c1)c2ncns2 271570a_100000742291_100000693119 [0,0,0,0,0,0|4,0,0]=4 59 B11R2.2 c1csc(c1)c2nncs2 271570a_100000742291_100000739804 [0,0,0,0,0,0|4,0,0]=4 60 B11R2.2 c1csc(n1)c2cc[nH]c2 271570a_100000102155_100000211983 [0,0,0,0,0,0|4,0,0]=4 61 B11R2.2 c1csc(n1)c2ccoc2 271570a_100011218838_100000211983 [0,0,0,0,0,0|4,0,0]=4 62 B11R2.2 c1csc(n1)c2ccsc2 271570a_100011934443_100000211983 [0,0,0,0,0,0|4,0,0]=4 63 B11R2.2 c1nc(c[nH]1)c2ccoc2 271570a_100011218838_100000756875 [0,0,0,0,0,0|4,0,0]=4 64 B11R2.2 c1nc(c[nH]1)c2ccsc2 271570a_100011934443_100000756875 [0,0,0,0,0,0|4,0,0]=4 65 B11R2.2 c1nc(n[nH]1)c2ccoc2 271570a_100011218838_100000761765 [0,0,0,0,0,0|3,0,0]=3 66 B11R2.2 c1nc(n[nH]1)c2ccsc2 271570a_100011934443_100000761765 [0,0,0,0,0,0|3,0,0]=3 67 B11R2.2 c1nc(n[nH]1)c2cn[nH]c2 271570a_100000041997_100000761765 [0,0,0,0,0,0|4,0,0]=4 68 B11R2.2 c1nc(n[nH]1)c2cncs2 271570a_100010231675_100000761765 [0,0,0,0,0,0|4,0,0]=4 69 B11R2.2 c1nsc(n1)c2cc[nH]c2 271570a_100000102155_100000693119 [0,0,0,0,0,0|4,0,0]=4 70 B11R2.2 c1nsc(n1)c2ccoc2 271570a_100011218838_100000693119 [0,0,0,0,0,0|4,0,0]=4 71 B11R2.2 c1nsc(n1)c2ccsc2 271570a_100011934443_100000693119 [0,0,0,0,0,0|4,0,0]=4 72 B12R2.6 Cc1cc(cs1)c2nc[nH]n2 271570a_100000699828_100000761765 [0,1,0,0,0,0|3,0,0]=4 73 B12R2.6 Cc1ccc(o1)c2nc[nH]n2 271570a_100000061910_100000761765 [0,1,0,0,0,0|3,0,0]=4 74 B12R2.6 Cc1ccc(s1)c2nc[nH]n2 271570a_100011934456_100000761765 [0,1,0,0,0,0|3,0,0]=4 75 B12R2.6 Cc1csc(c1)c2nc[nH]n2 271570a_100000038307_100000761765 [0,1,0,0,0,0|3,0,0]=4 76 B12R2.6 Cc1nc(n[nH]1)c2cc[nH]c2 271570a_100000102155_100000732540 [0,1,0,0,0,0|3,0,0]=4 77 B12R2.6 Cc1nc(n[nH]1)c2ccco2 271570a_100000750936_100000732540 [0,1,0,0,0,0|3,0,0]=4 78 B12R2.6 Cc1nc(n[nH]1)c2cccs2 271570a_100000742291_100000732540 [0,1,0,0,0,0|3,0,0]=4 79 B12R2.6 Cc1nc(n[nH]1)c2ccoc2 271570a_100011218838_100000732540 [0,1,0,0,0,0|3,0,0]=4 80 B12R2.6 Cc1nc(n[nH]1)c2ccsc2 271570a_100011934443_100000732540 [0,1,0,0,0,0|3,0,0]=4 81 B12R2.6 Cc1nc(no1)N2CC=CC2 27a_100015195280_100012003639 [0,1,0,0,0,0|0,0,2]=3 82 B12R2.6 Cc1nc(no1)c2cc[nH]c2 270196a_100000766402_100000070787 [0,1,0,0,0,0|2,0,0]=3 83 B12R2.6 Cc1nc(no1)c2cc[nH]c2 271570a_100000102155_100012003639 [0,1,0,0,0,0|2,0,0]=3 84 B12R2.6 Cc1nc(no1)c2cc[nH]n2 271570a_100000062414_100012003639 [0,1,0,0,0,0|3,0,0]=4 85 B12R2.6 Cc1nc(no1)c2ccc[nH]2 270196a_100000764488_100000070787 [0,1,0,0,0,0|2,0,0]=3 86 B12R2.6 Cc1nc(no1)c2ccco2 270196a_100000735424_100000070787 [0,1,0,0,0,0|2,0,0]=3 87 B12R2.6 Cc1nc(no1)c2ccco2 271570a_100000750936_100012003639 [0,1,0,0,0,0|2,0,0]=3 88 B12R2.6 Cc1nc(no1)c2cccs2 270196a_100000184399_100000070787 [0,1,0,0,0,0|2,0,0]=3 89 B12R2.6 Cc1nc(no1)c2cccs2 271570a_100000742291_100012003639 [0,1,0,0,0,0|2,0,0]=3 90 B12R2.6 Cc1nc(no1)c2ccn[nH]2 270196a_100011804834_100000070787 [0,1,0,0,0,0|3,0,0]=4 91 B12R2.6 Cc1nc(no1)c2ccoc2 270196a_100011215940_100000070787 [0,1,0,0,0,0|2,0,0]=3 92 B12R2.6 Cc1nc(no1)c2ccoc2 271570a_100011218838_100012003639 [0,1,0,0,0,0|2,0,0]=3 93 B12R2.6 Cc1nc(no1)c2ccon2 270196a_100000765845_100000070787 [0,1,0,0,0,0|3,0,0]=4 94 B12R2.6 Cc1nc(no1)c2ccsc2 270196a_100000188589_100000070787 [0,1,0,0,0,0|2,0,0]=3 95 B12R2.6 Cc1nc(no1)c2ccsc2 271570a_100011934443_100012003639 [0,1,0,0,0,0|2,0,0]=3 96 B12R2.6 Cc1nc(no1)c2cn[nH]c2 270196a_100000699142_100000070787 [0,1,0,0,0,0|3,0,0]=4 97 B12R2.6 Cc1nc(no1)c2cn[nH]c2 271570a_100000041997_100012003639 [0,1,0,0,0,0|3,0,0]=4 98 B12R2.6 Cc1nc(no1)c2cnc[nH]2 270196a_100000062572_100000070787 [0,1,0,0,0,0|3,0,0]=4 99 B12R2.6 Cc1nc(no1)c2cncs2 270196a_100000766501_100000070787 [0,1,0,0,0,0|3,0,0]=4 100 B12R2.6 Cc1nc(no1)c2cncs2 271570a_100010231675_100012003639 [0,1,0,0,0,0|3,0,0]=4 101 B12R2.6 Cc1nc(no1)c2cnsc2 270196a_100000143276_100000070787 [0,1,0,0,0,0|3,0,0]=4 102 B12R2.6 Cc1nc(no1)c2cocn2 270196a_100000062591_100000070787 [0,1,0,0,0,0|3,0,0]=4 103 B12R2.6 Cc1nc(no1)c2cscn2 270196a_100000687538_100000070787 [0,1,0,0,0,0|3,0,0]=4 104 B12R2.6 Cc1nc(no1)c2ncc[nH]2 270196a_100016994188_100000070787 [0,1,0,0,0,0|3,0,0]=4 105 B12R2.6 Cc1nc(no1)c2ncc[nH]2 271570a_100016988920_100012003639 [0,1,0,0,0,0|3,0,0]=4 106 B12R2.6 Cc1nc(no1)c2nccs2 270196a_100011834065_100000070787 [0,1,0,0,0,0|3,0,0]=4 107 B12R2.6 Clc1ccc(s1)c2nc[nH]n2 271570a_100000708867_100000761765 [0,1,0,0,0,0|3,0,0]=4 108 B12R2.6 Cn1ccc(c1)c2nc[nH]n2 271570a_100010172022_100000761765 [0,1,0,0,0,0|3,0,0]=4 109 B12R2.6 Cn1cnc(n1)c2cc[nH]c2 271570a_100000102155_100009819955 [0,1,0,0,0,0|3,0,0]=4 110 B12R2.6 Cn1cnc(n1)c2ccco2 271570a_100000750936_100009819955 [0,1,0,0,0,0|3,0,0]=4 111 B12R2.6 Cn1cnc(n1)c2cccs2 271570a_100000742291_100009819955 [0,1,0,0,0,0|3,0,0]=4 112 B12R2.6 Cn1cnc(n1)c2ccoc2 271570a_100011218838_100009819955 [0,1,0,0,0,0|3,0,0]=4 113 B12R2.6 Cn1cnc(n1)c2ccsc2 271570a_100011934443_100009819955 [0,1,0,0,0,0|3,0,0]=4 114 B12R2.6 Nc1nc(n[nH]1)c2cc[nH]c2 271570a_100000102155_100015184587 [0,1,0,0,0,0|3,0,0]=4 115 B12R2.6 Nc1nc(n[nH]1)c2ccco2 271570a_100000750936_100015184587 [0,1,0,0,0,0|3,0,0]=4 116 B12R2.6 Nc1nc(n[nH]1)c2cccs2 271570a_100000742291_100015184587 [0,1,0,0,0,0|3,0,0]=4 117 B12R2.6 Nc1nc(n[nH]1)c2ccoc2 271570a_100011218838_100015184587 [0,1,0,0,0,0|3,0,0]=4 118 B12R2.6 Nc1nc(n[nH]1)c2ccsc2 271570a_100011934443_100015184587 [0,1,0,0,0,0|3,0,0]=4 119 B12R2.6 Oc1nc(no1)c2cc[nH]c2 270196a_100000766402_100015183105 [0,1,0,0,0,0|2,0,0]=3 120 B12R2.6 Oc1nc(no1)c2ccc[nH]2 270196a_100000764488_100015183105 [0,1,0,0,0,0|2,0,0]=3 121 B12R2.6 Oc1nc(no1)c2ccco2 270196a_100000735424_100015183105 [0,1,0,0,0,0|2,0,0]=3 122 B12R2.6 Oc1nc(no1)c2cccs2 270196a_100000184399_100015183105 [0,1,0,0,0,0|2,0,0]=3 123 B12R2.6 Oc1nc(no1)c2ccn[nH]2 270196a_100011804834_100015183105 [0,1,0,0,0,0|3,0,0]=4 124 B12R2.6 Oc1nc(no1)c2ccoc2 270196a_100011215940_100015183105 [0,1,0,0,0,0|2,0,0]=3 125 B12R2.6 Oc1nc(no1)c2ccon2 270196a_100000765845_100015183105 [0,1,0,0,0,0|3,0,0]=4 126 B12R2.6 Oc1nc(no1)c2ccsc2 270196a_100000188589_100015183105 [0,1,0,0,0,0|2,0,0]=3 127 B12R2.6 Oc1nc(no1)c2cn[nH]c2 270196a_100000699142_100015183105 [0,1,0,0,0,0|3,0,0]=4 128 B12R2.6 Oc1nc(no1)c2cnc[nH]2 270196a_100000062572_100015183105 [0,1,0,0,0,0|3,0,0]=4 129 B12R2.6 Oc1nc(no1)c2cncs2 270196a_100000766501_100015183105 [0,1,0,0,0,0|3,0,0]=4 130 B12R2.6 Oc1nc(no1)c2cnsc2 270196a_100000143276_100015183105 [0,1,0,0,0,0|3,0,0]=4 131 B12R2.6 Oc1nc(no1)c2cocn2 270196a_100000062591_100015183105 [0,1,0,0,0,0|3,0,0]=4 132 B12R2.6 Oc1nc(no1)c2cscn2 270196a_100000687538_100015183105 [0,1,0,0,0,0|3,0,0]=4 133 B12R2.6 Oc1nc(no1)c2ncc[nH]2 270196a_100016994188_100015183105 [0,1,0,0,0,0|3,0,0]=4 134 B12R2.6 Oc1nc(no1)c2nccs2 270196a_100011834065_100015183105 [0,1,0,0,0,0|3,0,0]=4 135 B12R2.10 Cc1ccsc1c2nc[nH]n2 271570a_100000734444_100000761765 [0,1,0,0,0,0|3,0,0]=4 136 B12R2.10 Cc1cscc1c2nc[nH]n2 271570a_100000069996_100000761765 [0,1,0,0,0,0|3,0,0]=4 137 B12R2.10 Cc1occc1c2nc[nH]n2 271570a_100000070625_100000761765 [0,1,0,0,0,0|3,0,0]=4 138 B12R2.10 Cc1sccc1c2nc[nH]n2 271570a_100012356473_100000761765 [0,1,0,0,0,0|3,0,0]=4 139 B12R2.10 Clc1sccc1c2nc[nH]n2 271570a_100000117213_100000761765 [0,1,0,0,0,0|3,0,0]=4 140 B12R2.10 Cn1cccc1c2nc[nH]n2 271570a_100000068268_100000761765 [0,1,0,0,0,0|3,0,0]=4 141 B10R1.21 C=CCOCc1ncon1 34a_200000210373_100000233494 [0,0,1,0,0,0|2,0,1]=4 142 B10R1.21 C=CCSCc1ncon1 62a_100000210623_100000233494 [0,0,1,0,0,0|2,0,1]=4 143 B10R1.21 C=CCSCc1ncon1 62a_100000233494_100000210623 [0,0,1,0,0,0|2,0,1]=4 144 B12R2.2 C1=CCN(C1)c2cnccn2 27a_100015195280_100000211759 [0,0,0,0,0,1|1,0,2]=4 145 B12R2.2 C1=CCN(C1)c2ncccn2 27a_100015195280_100000211032 [0,0,0,0,0,1|1,0,2]=4 146 B12R2.2 c1cc(ccn1)c2c[nH]cn2 271570a_100000752145_100000756875 [0,0,0,0,0,1|3,0,0]=4 147 B12R2.2 c1cc(ccn1)c2cc[nH]n2 271570a_100000062414_100000035832 [0,0,0,0,0,1|3,0,0]=4 148 B12R2.2 c1cc(ccn1)c2cc[nH]n2 271570a_100000752145_100000062575 [0,0,0,0,0,1|3,0,0]=4 149 B12R2.2 c1cc(ccn1)c2ccoc2 271570a_100000752145_100011215275 [0,0,0,0,0,1|3,0,0]=4 150 B12R2.2 c1cc(ccn1)c2ccoc2 271570a_100011218838_100000035832 [0,0,0,0,0,1|3,0,0]=4 151 B12R2.2 c1cc(ccn1)c2ccsn2 271570a_100000752145_100009818082 [0,0,0,0,0,1|2,1,0]=4 152 B12R2.2 c1cc(ccn1)c2cscn2 271570a_100000752145_100000751502 [0,0,0,0,0,1|2,1,0]=4 153 B12R2.2 c1cc(ccn1)c2nc[nH]n2 271570a_100000752145_100000761765 [0,0,0,0,0,1|2,0,0]=3 154 B12R2.2 c1cc(ccn1)c2ncc[nH]2 271570a_100000752145_100025796157 [0,0,0,0,0,1|2,0,1]=4 155 B12R2.2 c1cc(ccn1)c2ncc[nH]2 271570a_100016988920_100000035832 [0,0,0,0,0,1|2,0,1]=4 156 B12R2.2 c1cc(ccn1)c2ncco2 271570a_100000752145_100011787736 [0,0,0,0,0,1|3,0,0]=4 157 B12R2.2 c1cc(ccn1)c2nccs2 271570a_100000752145_100000211983 [0,0,0,0,0,1|3,0,0]=4 158 B12R2.2 c1cc(ccn1)c2ncns2 271570a_100000752145_100000693119 [0,0,0,0,0,1|3,0,0]=4 159 B12R2.2 c1cc(ccn1)c2nncs2 271570a_100000752145_100000739804 [0,0,0,0,0,1|3,0,0]=4 160 B12R2.2 c1ccc(cc1)c2c[nH]cn2 271570a_100011218836_100000756875 [0,0,0,0,0,1|3,0,0]=4 161 B12R2.2 c1ccc(cc1)c2cc[nH]n2 271570a_100000062414_100000210277 [0,0,0,0,0,1|3,0,0]=4 162 B12R2.2 c1ccc(cc1)c2cc[nH]n2 271570a_100011218836_100000062575 [0,0,0,0,0,1|3,0,0]=4 163 B12R2.2 c1ccc(cc1)c2ccoc2 271570a_100011218836_100011215275 [0,0,0,0,0,1|3,0,0]=4 164 B12R2.2 c1ccc(cc1)c2ccoc2 271570a_100011218838_100000210277 [0,0,0,0,0,1|3,0,0]=4 165 B12R2.2 c1ccc(cc1)c2ccsn2 271570a_100011218836_100009818082 [0,0,0,0,0,1|2,1,0]=4 166 B12R2.2 c1ccc(cc1)c2cscn2 271570a_100011218836_100000751502 [0,0,0,0,0,1|2,1,0]=4 167 B12R2.2 c1ccc(cc1)c2nc[nH]n2 271570a_100011218836_100000761765 [0,0,0,0,0,1|2,0,0]=3 168 B12R2.2 c1ccc(cc1)c2ncc[nH]2 271570a_100011218836_100025796157 [0,0,0,0,0,1|2,0,1]=4 169 B12R2.2 c1ccc(cc1)c2ncc[nH]2 271570a_100016988920_100000210277 [0,0,0,0,0,1|2,0,1]=4 170 B12R2.2 c1ccc(cc1)c2ncco2 271570a_100011218836_100011787736 [0,0,0,0,0,1|3,0,0]=4 171 B12R2.2 c1ccc(cc1)c2nccs2 271570a_100011218836_100000211983 [0,0,0,0,0,1|3,0,0]=4 172 B12R2.2 c1ccc(cc1)c2ncns2 271570a_100011218836_100000693119 [0,0,0,0,0,1|3,0,0]=4 173 B12R2.2 c1ccc(cc1)c2nncs2 271570a_100011218836_100000739804 [0,0,0,0,0,1|3,0,0]=4 174 B12R2.2 c1ccc(nc1)c2c[nH]cn2 271570a_100011264011_100000756875 [0,0,0,0,0,1|3,0,0]=4 175 B12R2.2 c1ccc(nc1)c2cc[nH]n2 271570a_100000062414_100011216584 [0,0,0,0,0,1|3,0,0]=4 176 B12R2.2 c1ccc(nc1)c2cc[nH]n2 271570a_100011264011_100000062575 [0,0,0,0,0,1|3,0,0]=4 177 B12R2.2 c1ccc(nc1)c2ccoc2 271570a_100011218838_100011216584 [0,0,0,0,0,1|3,0,0]=4 178 B12R2.2 c1ccc(nc1)c2ccoc2 271570a_100011264011_100011215275 [0,0,0,0,0,1|3,0,0]=4 179 B12R2.2 c1ccc(nc1)c2ccsn2 271570a_100011264011_100009818082 [0,0,0,0,0,1|2,1,0]=4 180 B12R2.2 c1ccc(nc1)c2cscn2 271570a_100011264011_100000751502 [0,0,0,0,0,1|2,1,0]=4 181 B12R2.2 c1ccc(nc1)c2nc[nH]n2 271570a_100011264011_100000761765 [0,0,0,0,0,1|2,0,0]=3 182 B12R2.2 c1ccc(nc1)c2ncc[nH]2 271570a_100011264011_100025796157 [0,0,0,0,0,1|2,0,1]=4 183 B12R2.2 c1ccc(nc1)c2ncc[nH]2 271570a_100016988920_100011216584 [0,0,0,0,0,1|2,0,1]=4 184 B12R2.2 c1ccc(nc1)c2ncco2 271570a_100011264011_100011787736 [0,0,0,0,0,1|3,0,0]=4 185 B12R2.2 c1ccc(nc1)c2nccs2 271570a_100011264011_100000211983 [0,0,0,0,0,1|3,0,0]=4 186 B12R2.2 c1ccc(nc1)c2ncns2 271570a_100011264011_100000693119 [0,0,0,0,0,1|3,0,0]=4 187 B12R2.2 c1ccc(nc1)c2nncs2 271570a_100011264011_100000739804 [0,0,0,0,0,1|3,0,0]=4 188 B12R2.2 c1cnc(cn1)c2cc[nH]c2 271570a_100000102155_100000758340 [0,0,0,0,0,1|3,0,0]=4 189 B12R2.2 c1cnc(cn1)c2ccoc2 271570a_100011218838_100000758340 [0,0,0,0,0,1|3,0,0]=4 190 B12R2.2 c1cnc(cn1)c2ccoc2 271570a_100011962566_100011215275 [0,0,0,0,0,1|3,0,0]=4 191 B12R2.2 c1cnc(cn1)c2ccsc2 271570a_100011934443_100000758340 [0,0,0,0,0,1|3,0,0]=4 192 B12R2.2 c1cnc(cn1)c2ccsc2 271570a_100011962566_100000738268 [0,0,0,0,0,1|3,0,0]=4 193 B12R2.2 c1cnc(cn1)c2nc[nH]n2 271570a_100011962566_100000761765 [0,0,0,0,0,1|3,0,0]=4 194 B12R2.2 c1cnc(nc1)c2cc[nH]c2 271570a_100000102155_100000211032 [0,0,0,0,0,1|3,0,0]=4 195 B12R2.2 c1cnc(nc1)c2ccco2 271570a_100000750936_100000211032 [0,0,0,0,0,1|3,0,0]=4 196 B12R2.2 c1cnc(nc1)c2cccs2 271570a_100000742291_100000211032 [0,0,0,0,0,1|3,0,0]=4 197 B12R2.2 c1cnc(nc1)c2ccoc2 271570a_100011218838_100000211032 [0,0,0,0,0,1|3,0,0]=4 198 B12R2.2 c1cnc(nc1)c2ccsc2 271570a_100011934443_100000211032 [0,0,0,0,0,1|3,0,0]=4 199 B12R2.2 c1cncc(c1)c2c[nH]cn2 271570a_100000757648_100000756875 [0,0,0,0,0,1|3,0,0]=4 200 B12R2.2 c1cncc(c1)c2cc[nH]n2 271570a_100000062414_100000752921 [0,0,0,0,0,1|3,0,0]=4 201 B12R2.2 c1cncc(c1)c2cc[nH]n2 271570a_100000757648_100000062575 [0,0,0,0,0,1|3,0,0]=4 202 B12R2.2 c1cncc(c1)c2ccoc2 271570a_100000757648_100011215275 [0,0,0,0,0,1|3,0,0]=4 203 B12R2.2 c1cncc(c1)c2ccoc2 271570a_100011218838_100000752921 [0,0,0,0,0,1|3,0,0]=4 204 B12R2.2 c1cncc(c1)c2ccsn2 271570a_100000757648_100009818082 [0,0,0,0,0,1|2,1,0]=4 205 B12R2.2 c1cncc(c1)c2cscn2 271570a_100000757648_100000751502 [0,0,0,0,0,1|2,1,0]=4 206 B12R2.2 c1cncc(c1)c2nc[nH]n2 271570a_100000757648_100000761765 [0,0,0,0,0,1|2,0,0]=3 207 B12R2.2 c1cncc(c1)c2ncc[nH]2 271570a_100000757648_100025796157 [0,0,0,0,0,1|2,0,1]=4 208 B12R2.2 c1cncc(c1)c2ncc[nH]2 271570a_100016988920_100000752921 [0,0,0,0,0,1|2,0,1]=4 209 B12R2.2 c1cncc(c1)c2ncco2 271570a_100000757648_100011787736 [0,0,0,0,0,1|3,0,0]=4 210 B12R2.2 c1cncc(c1)c2nccs2 271570a_100000757648_100000211983 [0,0,0,0,0,1|3,0,0]=4 211 B12R2.2 c1cncc(c1)c2ncns2 271570a_100000757648_100000693119 [0,0,0,0,0,1|3,0,0]=4 212 B12R2.2 c1cncc(c1)c2nncs2 271570a_100000757648_100000739804 [0,0,0,0,0,1|3,0,0]=4 213 B12R2.2 c1coc(c1)c2cnccn2 271570a_100000750936_100000758340 [0,0,0,0,0,1|3,0,0]=4 214 B12R2.2 c1coc(c1)c2cnccn2 271570a_100011962566_100009814098 [0,0,0,0,0,1|3,0,0]=4 215 B12R2.2 c1csc(c1)c2cnccn2 271570a_100000742291_100000758340 [0,0,0,0,0,1|3,0,0]=4 216 B12R2.2 c1csc(c1)c2cnccn2 271570a_100011962566_100011215356 [0,0,0,0,0,1|3,0,0]=4 217 B12R2.2 c1ncc(cn1)c2nc[nH]n2 271570a_100000707473_100000761765 [0,0,0,0,0,1|3,0,0]=4 218 B12R2.98 C1=CCN(C1)Cc2ccon2 269982a_100015195280_100000234950 [0,0,0,0,0,1|1,0,2]=4 219 B12R2.98 C1=CCN(C1)Cc2ncon2 269982a_100015195280_100000233494 [0,0,0,0,0,1|0,0,2]=3 220 B12R2.98 c1cc(co1)Sc2ccon2 62a_100009818083_100011215275 [0,0,0,0,0,1|3,0,0]=4 221 B12R2.98 c1cc(co1)Sc2ccon2 62a_100011215275_100009818083 [0,0,0,0,0,1|3,0,0]=4 222 B12R2.98 c1cc(no1)Sc2ccsc2 62a_100000738268_100009818083 [0,0,0,0,0,1|3,0,0]=4 223 B12R2.98 c1cc(no1)Sc2ccsc2 62a_100009818083_100000738268 [0,0,0,0,0,1|3,0,0]=4 224 B12R2.98 c1coc(c1)Sc2ccon2 62a_100009814098_100009818083 [0,0,0,0,0,1|3,0,0]=4 225 B12R2.98 c1coc(c1)Sc2ccon2 62a_100009818083_100009814098 [0,0,0,0,0,1|3,0,0]=4 226 B12R2.98 c1coc(c1)Sc2nc[nH]n2 62a_100000761765_100009814098 [0,0,0,0,0,1|3,0,0]=4 227 B12R2.98 c1coc(c1)Sc2nc[nH]n2 62a_100009814098_100000761765 [0,0,0,0,0,1|3,0,0]=4 228 B12R2.98 c1csc(c1)Sc2ccon2 62a_100009818083_100011215356 [0,0,0,0,0,1|3,0,0]=4 229 B12R2.98 c1csc(c1)Sc2ccon2 62a_100011215356_100009818083 [0,0,0,0,0,1|3,0,0]=4 230 B12R2.98 c1csc(c1)Sc2nc[nH]n2 62a_100000761765_100011215356 [0,0,0,0,0,1|3,0,0]=4 231 B12R2.98 c1csc(c1)Sc2nc[nH]n2 62a_100011215356_100000761765 [0,0,0,0,0,1|3,0,0]=4 232 B12R2.98 c1nc(n[nH]1)Sc2ccoc2 62a_100000761765_100011215275 [0,0,0,0,0,1|3,0,0]=4 233 B12R2.98 c1nc(n[nH]1)Sc2ccoc2 62a_100011215275_100000761765 [0,0,0,0,0,1|3,0,0]=4 234 B12R2.98 c1nc(n[nH]1)Sc2ccsc2 62a_100000738268_100000761765 [0,0,0,0,0,1|3,0,0]=4 235 B12R2.98 c1nc(n[nH]1)Sc2ccsc2 62a_100000761765_100000738268 [0,0,0,0,0,1|3,0,0]=4 236 B11R1.27 C=CCCNc1noc(n1)C 27a_100015191253_100012003639 [0,1,1,0,0,0|0,0,2]=4 237 B13R2.10 Cc1nc(n[nH]1)c2ccccc2 271570a_100011218836_100000732540 [0,1,0,0,0,1|2,0,0]=4 238 B13R2.10 Cc1nc(n[nH]1)c2ccccn2 271570a_100011264011_100000732540 [0,1,0,0,0,1|2,0,0]=4 239 B13R2.10 Cc1nc(n[nH]1)c2cccnc2 271570a_100000757648_100000732540 [0,1,0,0,0,1|2,0,0]=4 240 B13R2.10 Cc1nc(n[nH]1)c2ccncc2 271570a_100000752145_100000732540 [0,1,0,0,0,1|2,0,0]=4 241 B13R2.10 Cc1nc(no1)N2CC=CCC2 27a_100000698166_100012003639 [0,1,0,0,0,1|0,0,2]=4 242 B13R2.10 Cc1nc(no1)c2ccccc2 270196a_100000210280_100000070787 [0,1,0,0,0,1|1,0,0]=3 243 B13R2.10 Cc1nc(no1)c2ccccc2 271570a_100011218836_100012003639 [0,1,0,0,0,1|1,0,0]=3 244 B13R2.10 Cc1nc(no1)c2ccccn2 270196a_100000188563_100000070787 [0,1,0,0,0,1|1,0,0]=3 245 B13R2.10 Cc1nc(no1)c2ccccn2 271570a_100011264011_100012003639 [0,1,0,0,0,1|1,0,0]=3 246 B13R2.10 Cc1nc(no1)c2cccnc2 270196a_100000188564_100000070787 [0,1,0,0,0,1|1,0,0]=3 247 B13R2.10 Cc1nc(no1)c2cccnc2 271570a_100000757648_100012003639 [0,1,0,0,0,1|1,0,0]=3 248 B13R2.10 Cc1nc(no1)c2cccnn2 270196a_100000047776_100000070787 [0,1,0,0,0,1|2,0,0]=4 249 B13R2.10 Cc1nc(no1)c2ccncc2 270196a_100000188565_100000070787 [0,1,0,0,0,1|1,0,0]=3 250 B13R2.10 Cc1nc(no1)c2ccncc2 271570a_100000752145_100012003639 [0,1,0,0,0,1|1,0,0]=3 251 B13R2.10 Cc1nc(no1)c2ccncn2 270196a_100000755281_100000070787 [0,1,0,0,0,1|2,0,0]=4 252 B13R2.10 Cc1nc(no1)c2ccnnc2 270196a_100011830395_100000070787 [0,1,0,0,0,1|2,0,0]=4 253 B13R2.10 Cc1nc(no1)c2cnccn2 270196a_100011215543_100000070787 [0,1,0,0,0,1|2,0,0]=4 254 B13R2.10 Cc1nc(no1)c2cnccn2 271570a_100011962566_100012003639 [0,1,0,0,0,1|2,0,0]=4 255 B13R2.10 Cc1nc(no1)c2cncnc2 270196a_100011219289_100000070787 [0,1,0,0,0,1|2,0,0]=4 256 B13R2.10 Cc1nc(no1)c2cncnc2 271570a_100000707473_100012003639 [0,1,0,0,0,1|2,0,0]=4 257 B13R2.10 Cc1nc(no1)c2ncccn2 270196a_100000034951_100000070787 [0,1,0,0,0,1|2,0,0]=4 258 B13R2.10 Cn1cnc(n1)c2ccccc2 271570a_100011218836_100009819955 [0,1,0,0,0,1|2,0,0]=4 259 B13R2.10 Cn1cnc(n1)c2ccccn2 271570a_100011264011_100009819955 [0,1,0,0,0,1|2,0,0]=4 260 B13R2.10 Cn1cnc(n1)c2cccnc2 271570a_100000757648_100009819955 [0,1,0,0,0,1|2,0,0]=4 261 B13R2.10 Cn1cnc(n1)c2ccncc2 271570a_100000752145_100009819955 [0,1,0,0,0,1|2,0,0]=4 262 B13R2.10 Nc1nc(n[nH]1)c2ccccc2 271570a_100011218836_100015184587 [0,1,0,0,0,1|2,0,0]=4 263 B13R2.10 Nc1nc(n[nH]1)c2ccccn2 271570a_100011264011_100015184587 [0,1,0,0,0,1|2,0,0]=4 264 B13R2.10 Nc1nc(n[nH]1)c2cccnc2 271570a_100000757648_100015184587 [0,1,0,0,0,1|2,0,0]=4 265 B13R2.10 Nc1nc(n[nH]1)c2ccncc2 271570a_100000752145_100015184587 [0,1,0,0,0,1|2,0,0]=4 266 B13R2.10 Oc1cnn(c1)c2cnccn2 271570a_203496583355_100000709922 [0,1,0,0,0,1|2,0,0]=4 267 B13R2.10 Oc1cnn(c1)c2ncccn2 271570a_203496583355_100011400310 [0,1,0,0,0,1|2,0,0]=4 268 B13R2.10 Oc1nc(no1)c2ccccc2 270196a_100000210280_100015183105 [0,1,0,0,0,1|1,0,0]=3 269 B13R2.10 Oc1nc(no1)c2ccccn2 270196a_100000188563_100015183105 [0,1,0,0,0,1|1,0,0]=3 270 B13R2.10 Oc1nc(no1)c2cccnc2 270196a_100000188564_100015183105 [0,1,0,0,0,1|1,0,0]=3 271 B13R2.10 Oc1nc(no1)c2cccnn2 270196a_100000047776_100015183105 [0,1,0,0,0,1|2,0,0]=4 272 B13R2.10 Oc1nc(no1)c2ccncc2 270196a_100000188565_100015183105 [0,1,0,0,0,1|1,0,0]=3 273 B13R2.10 Oc1nc(no1)c2ccncn2 270196a_100000755281_100015183105 [0,1,0,0,0,1|2,0,0]=4 274 B13R2.10 Oc1nc(no1)c2ccnnc2 270196a_100011830395_100015183105 [0,1,0,0,0,1|2,0,0]=4 275 B13R2.10 Oc1nc(no1)c2cnccn2 270196a_100011215543_100015183105 [0,1,0,0,0,1|2,0,0]=4 276 B13R2.10 Oc1nc(no1)c2cncnc2 270196a_100011219289_100015183105 [0,1,0,0,0,1|2,0,0]=4 277 B13R2.10 Oc1nc(no1)c2ncccn2 270196a_100000034951_100015183105 [0,1,0,0,0,1|2,0,0]=4 278 B13R2.12 Brc1ccc(cc1)c2nc[nH]n2 271570a_100010235827_100000761765 [0,1,0,0,0,1|2,0,0]=4 279 B13R2.12 C[n+]1ccc(cc1)c2nc[nH]n2 271570a_100010897472_100000761765 [0,1,0,0,0,1|2,0,0]=4 280 B13R2.12 Cc1ccc(cc1)c2nc[nH]n2 271570a_100000708704_100000761765 [0,1,0,0,0,1|2,0,0]=4 281 B13R2.12 Cc1ccc(cn1)c2nc[nH]n2 271570a_100012354835_100000761765 [0,1,0,0,0,1|2,0,0]=4 282 B13R2.12 Cc1ccc(nc1)c2nc[nH]n2 271570a_100000066433_100000761765 [0,1,0,0,0,1|2,0,0]=4 283 B13R2.12 Clc1ccc(cc1)c2nc[nH]n2 271570a_100011213355_100000761765 [0,1,0,0,0,1|2,0,0]=4 284 B13R2.12 Clc1ccc(cn1)c2nc[nH]n2 271570a_100000037156_100000761765 [0,1,0,0,0,1|2,0,0]=4 285 B13R2.12 Clc1ccc(nc1)c2nc[nH]n2 271570a_200000049369_100000761765 [0,1,0,0,0,1|2,0,0]=4 286 B13R2.12 Fc1ccc(cc1)c2nc[nH]n2 271570a_100011934326_100000761765 [0,1,0,0,0,1|2,0,0]=4 287 B13R2.12 Fc1ccc(cn1)c2nc[nH]n2 271570a_100000041719_100000761765 [0,1,0,0,0,1|2,0,0]=4 288 B13R2.12 Fc1ccc(nc1)c2nc[nH]n2 271570a_100000117362_100000761765 [0,1,0,0,0,1|2,0,0]=4 289 B13R2.12 Ic1ccc(cc1)c2nc[nH]n2 271570a_100000033156_100000761765 [0,1,0,0,0,1|2,0,0]=4 290 B13R2.12 Nc1ccc(cc1)c2nc[nH]n2 271570a_100015188457_100000761765 [0,1,0,0,0,1|2,0,0]=4 291 B13R2.12 Nc1ccc(cn1)c2nc[nH]n2 271570a_100000062249_100000761765 [0,1,0,0,0,1|2,0,0]=4 292 B13R2.12 Oc1ccc(cc1)c2ccon2 271570a_203496583355_200011934941 [0,1,0,0,0,1|2,0,0]=4 293 B13R2.12 Oc1ccc(cc1)c2nc[nH]n2 271570a_100015205159_100000761765 [0,1,0,0,0,1|2,0,0]=4 294 B13R2.12 Oc1ccc(cc1)c2ncon2 271570a_203496583355_100000756724 [0,1,0,0,0,1|1,0,0]=3 295 B13R2.12 Oc1ccc(cn1)c2nc[nH]n2 271570a_100000062254_100000761765 [0,1,0,0,0,1|2,0,0]=4 296 B13R2.12 Oc1ccc(nn1)n2cccc2 271570a_203496583355_100000066497 [0,1,0,0,0,1|2,0,0]=4 297 B13R2.12 Oc1cnc(nc1)n2cccn2 271570a_203496583355_200011939098 [0,1,0,0,0,1|2,0,0]=4 298 B13R2.12 Oc1cnc(nc1)n2ccnc2 271570a_203496583355_100011939099 [0,1,0,0,0,1|2,0,0]=4 299 B13R2.13 Brc1cncc(c1)c2nc[nH]n2 271570a_200009814628_100000761765 [0,1,0,0,0,1|2,0,0]=4 300 B13R2.13 Cc1cc(ccn1)c2nc[nH]n2 271570a_100011830414_100000761765 [0,1,0,0,0,1|2,0,0]=4 301 B13R2.13 Cc1cccc(c1)c2nc[nH]n2 271570a_100000749446_100000761765 [0,1,0,0,0,1|2,0,0]=4 302 B13R2.13 Cc1cccc(n1)c2nc[nH]n2 271570a_100000046275_100000761765 [0,1,0,0,0,1|2,0,0]=4 303 B13R2.13 Cc1ccnc(c1)c2nc[nH]n2 271570a_100000049243_100000761765 [0,1,0,0,0,1|2,0,0]=4 304 B13R2.13 Cc1cncc(c1)c2nc[nH]n2 271570a_100012355712_100000761765 [0,1,0,0,0,1|2,0,0]=4 305 B13R2.13 Clc1cc(ccn1)c2nc[nH]n2 271570a_100000049459_100000761765 [0,1,0,0,0,1|2,0,0]=4 306 B13R2.13 Clc1cccc(c1)c2nc[nH]n2 271570a_100011214927_100000761765 [0,1,0,0,0,1|2,0,0]=4 307 B13R2.13 Clc1cccc(n1)c2nc[nH]n2 271570a_100000062326_100000761765 [0,1,0,0,0,1|2,0,0]=4 308 B13R2.13 Clc1cncc(c1)c2nc[nH]n2 271570a_100000049213_100000761765 [0,1,0,0,0,1|2,0,0]=4 309 B13R2.13 Fc1cc(ccn1)c2nc[nH]n2 271570a_100000062321_100000761765 [0,1,0,0,0,1|2,0,0]=4 310 B13R2.13 Fc1cccc(c1)c2nc[nH]n2 271570a_100012349223_100000761765 [0,1,0,0,0,1|2,0,0]=4 311 B13R2.13 Fc1cccc(n1)c2nc[nH]n2 271570a_100000090185_100000761765 [0,1,0,0,0,1|2,0,0]=4 312 B13R2.13 Fc1ccnc(c1)c2nc[nH]n2 271570a_200000087102_100000761765 [0,1,0,0,0,1|2,0,0]=4 313 B13R2.13 Fc1cncc(c1)c2nc[nH]n2 271570a_100000757375_100000761765 [0,1,0,0,0,1|2,0,0]=4 314 B13R2.13 Ic1cccc(c1)c2nc[nH]n2 271570a_100000043368_100000761765 [0,1,0,0,0,1|2,0,0]=4 315 B13R2.13 Nc1cc(ccn1)c2nc[nH]n2 271570a_102125402725_100000761765 [0,1,0,0,0,1|2,0,0]=4 316 B13R2.13 Nc1cccc(c1)c2nc[nH]n2 271570a_100000699968_100000761765 [0,1,0,0,0,1|2,0,0]=4 317 B13R2.13 Nc1cncc(c1)c2nc[nH]n2 271570a_100000069896_100000761765 [0,1,0,0,0,1|2,0,0]=4 318 B13R2.13 Oc1cc(ccn1)c2nc[nH]n2 271570a_100010237957_100000761765 [0,1,0,0,0,1|2,0,0]=4 319 B13R2.13 Oc1cccc(c1)c2nc[nH]n2 271570a_100000693801_100000761765 [0,1,0,0,0,1|2,0,0]=4 320 B13R2.13 Oc1cccc(c1)c2ncon2 271570a_203496583355_200000756725 [0,1,0,0,0,1|1,0,0]=3 321 B13R2.13 Oc1cccc(n1)c2nc[nH]n2 271570a_100010195584_100000761765 [0,1,0,0,0,1|2,0,0]=4 322 B13R2.13 Oc1cncc(c1)c2nc[nH]n2 271570a_100010248756_100000761765 [0,1,0,0,0,1|2,0,0]=4 323 B13R2.13 Oc1cncc(n1)n2cccn2 271570a_203496583355_100000740847 [0,1,0,0,0,1|2,0,0]=4 324 B13R2.13 Oc1cncc(n1)n2ccnc2 271570a_203496583355_100011281197 [0,1,0,0,0,1|2,0,0]=4 325 B13R2.18 Cc1ccccc1c2nc[nH]n2 271570a_100000747142_100000761765 [0,1,0,0,0,1|2,0,0]=4 326 B13R2.18 Cc1ccncc1c2nc[nH]n2 271570a_100011935247_100000761765 [0,1,0,0,0,1|2,0,0]=4 327 B13R2.18 Cc1cnccc1c2nc[nH]n2 271570a_100000701363_100000761765 [0,1,0,0,0,1|2,0,0]=4 328 B13R2.18 Cc1ncccc1c2nc[nH]n2 271570a_100011934933_100000761765 [0,1,0,0,0,1|2,0,0]=4 329 B13R2.18 Clc1ccccc1c2nc[nH]n2 271570a_100011934419_100000761765 [0,1,0,0,0,1|2,0,0]=4 330 B13R2.18 Clc1cccnc1c2nc[nH]n2 271570a_100009857861_100000761765 [0,1,0,0,0,1|2,0,0]=4 331 B13R2.18 Clc1ccncc1c2nc[nH]n2 271570a_100000062317_100000761765 [0,1,0,0,0,1|2,0,0]=4 332 B13R2.18 Clc1cnccc1c2nc[nH]n2 271570a_100000062318_100000761765 [0,1,0,0,0,1|2,0,0]=4 333 B13R2.18 Clc1ncccc1c2nc[nH]n2 271570a_100000047009_100000761765 [0,1,0,0,0,1|2,0,0]=4 334 B13R2.18 Fc1ccccc1c2nc[nH]n2 271570a_100000761933_100000761765 [0,1,0,0,0,1|2,0,0]=4 335 B13R2.18 Fc1cnccc1c2nc[nH]n2 271570a_100011290801_100000761765 [0,1,0,0,0,1|2,0,0]=4 336 B13R2.18 Fc1ncccc1c2nc[nH]n2 271570a_100000042387_100000761765 [0,1,0,0,0,1|2,0,0]=4 337 B13R2.18 Ic1ccccc1c2nc[nH]n2 271570a_100000069755_100000761765 [0,1,0,0,0,1|2,0,0]=4 338 B13R2.18 Nc1ccccc1c2nc[nH]n2 271570a_100000034411_100000761765 [0,1,0,0,0,1|2,0,0]=4 339 B13R2.18 Nc1ccncc1c2nc[nH]n2 271570a_200010248739_100000761765 [0,1,0,0,0,1|2,0,0]=4 340 B13R2.18 Nc1ncccc1c2nc[nH]n2 271570a_100000071976_100000761765 [0,1,0,0,0,1|2,0,0]=4 341 B13R2.18 O=c1[nH]cccc1c2nc[nH]n2 271570a_100000099769_100000761765 [0,1,0,0,0,1|2,0,0]=4 342 B13R2.18 Oc1ccccc1c2cocn2 271570a_203496583355_100010198669 [0,1,0,0,0,1|2,0,0]=4 343 B13R2.18 Oc1ccccc1c2nc[nH]n2 271570a_100000035170_100000761765 [0,1,0,0,0,1|2,0,0]=4 344 B13R2.18 Oc1ncccc1n2cccc2 271570a_203496583355_200000008450 [0,1,0,0,0,1|2,0,0]=4 345 B13R2.142 Cc1cn(nn1)Cc2ncon2 274090a_100000233494_200000242740 [0,1,0,0,0,1|2,0,0]=4 346 B13R2.142 Cc1nc(no1)CN2CC=CC2 269982a_100015195280_100000231061 [0,1,0,0,0,1|0,0,2]=4 347 B13R2.142 Cc1nc(no1)Cc2ccc[nH]2 270196a_100000744935_100000070787 [0,1,0,0,0,1|2,0,0]=4 348 B13R2.142 Cc1nc(no1)Cc2cccs2 270196a_100000212033_100000070787 [0,1,0,0,0,1|2,0,0]=4 349 B13R2.142 Cc1nc(no1)Cc2ccsc2 270196a_100000216512_100000070787 [0,1,0,0,0,1|2,0,0]=4 350 B13R2.142 Cc1nc(no1)Cn2cccn2 270196a_100000742235_100000070787 [0,1,0,0,0,1|1,0,0]=3 351 B13R2.142 Cc1nc(no1)Cn2ccnc2 270196a_100000188493_100000070787 [0,1,0,0,0,1|1,0,0]=3 352 B13R2.142 Cc1nc(no1)Cn2cncn2 270196a_100000750853_100000070787 [0,1,0,0,0,1|2,0,0]=4 353 B13R2.142 Cc1nc(no1)Sc2ccco2 62a_100009814098_100012003639 [0,1,0,0,0,1|2,0,0]=4 354 B13R2.142 Cc1nc(no1)Sc2ccco2 62a_100012003639_100009814098 [0,1,0,0,0,1|2,0,0]=4 355 B13R2.142 Cc1nc(no1)Sc2cccs2 62a_100011215356_100012003639 [0,1,0,0,0,1|2,0,0]=4 356 B13R2.142 Cc1nc(no1)Sc2cccs2 62a_100012003639_100011215356 [0,1,0,0,0,1|2,0,0]=4 357 B13R2.142 Cc1nc(no1)Sc2ccoc2 62a_100011215275_100012003639 [0,1,0,0,0,1|2,0,0]=4 358 B13R2.142 Cc1nc(no1)Sc2ccoc2 62a_100012003639_100011215275 [0,1,0,0,0,1|2,0,0]=4 359 B13R2.142 Cc1nc(no1)Sc2ccsc2 62a_100000738268_100012003639 [0,1,0,0,0,1|2,0,0]=4 360 B13R2.142 Cc1nc(no1)Sc2ccsc2 62a_100012003639_100000738268 [0,1,0,0,0,1|2,0,0]=4 361 B13R2.142 Cc1noc(n1)Cn2cccc2 270196a_100000212224_100011196272 [0,1,0,0,0,1|2,0,0]=4 362 B13R2.142 Oc1nc(no1)Cc2ccc[nH]2 270196a_100000744935_100015183105 [0,1,0,0,0,1|2,0,0]=4 363 B13R2.142 Oc1nc(no1)Cc2cccs2 270196a_100000212033_100015183105 [0,1,0,0,0,1|2,0,0]=4 364 B13R2.142 Oc1nc(no1)Cc2ccsc2 270196a_100000216512_100015183105 [0,1,0,0,0,1|2,0,0]=4 365 B13R2.142 Oc1nc(no1)Cn2cccn2 270196a_100000742235_100015183105 [0,1,0,0,0,1|1,0,0]=3 366 B13R2.142 Oc1nc(no1)Cn2ccnc2 270196a_100000188493_100015183105 [0,1,0,0,0,1|1,0,0]=3 367 B13R2.142 Oc1nc(no1)Cn2cncn2 270196a_100000750853_100015183105 [0,1,0,0,0,1|2,0,0]=4 368 B13R2.4 CCc1nc(no1)N2CC=CC2 27a_100015195280_100012003642 [0,2,0,0,0,0|0,0,2]=4 369 B13R2.4 CCc1nc(no1)c2cc[nH]c2 270196a_100000766402_100000210414 [0,2,0,0,0,0|2,0,0]=4 370 B13R2.4 CCc1nc(no1)c2cc[nH]c2 271570a_100000102155_100012003642 [0,2,0,0,0,0|2,0,0]=4 371 B13R2.4 CCc1nc(no1)c2ccc[nH]2 270196a_100000764488_100000210414 [0,2,0,0,0,0|2,0,0]=4 372 B13R2.4 CCc1nc(no1)c2ccco2 270196a_100000735424_100000210414 [0,2,0,0,0,0|2,0,0]=4 373 B13R2.4 CCc1nc(no1)c2ccco2 271570a_100000750936_100012003642 [0,2,0,0,0,0|2,0,0]=4 374 B13R2.4 CCc1nc(no1)c2cccs2 270196a_100000184399_100000210414 [0,2,0,0,0,0|2,0,0]=4 375 B13R2.4 CCc1nc(no1)c2cccs2 271570a_100000742291_100012003642 [0,2,0,0,0,0|2,0,0]=4 376 B13R2.4 CCc1nc(no1)c2ccoc2 270196a_100011215940_100000210414 [0,2,0,0,0,0|2,0,0]=4 377 B13R2.4 CCc1nc(no1)c2ccoc2 271570a_100011218838_100012003642 [0,2,0,0,0,0|2,0,0]=4 378 B13R2.4 CCc1nc(no1)c2ccsc2 270196a_100000188589_100000210414 [0,2,0,0,0,0|2,0,0]=4 379 B13R2.4 CCc1nc(no1)c2ccsc2 271570a_100011934443_100012003642 [0,2,0,0,0,0|2,0,0]=4 380 B13R2.4 OCc1nc(no1)c2cc[nH]c2 270196a_100000766402_100000210174 [0,2,0,0,0,0|2,0,0]=4 381 B13R2.4 OCc1nc(no1)c2ccc[nH]2 270196a_100000764488_100000210174 [0,2,0,0,0,0|2,0,0]=4 382 B13R2.4 OCc1nc(no1)c2ccco2 270196a_100000735424_100000210174 [0,2,0,0,0,0|2,0,0]=4 383 B13R2.4 OCc1nc(no1)c2cccs2 270196a_100000184399_100000210174 [0,2,0,0,0,0|2,0,0]=4 384 B13R2.4 OCc1nc(no1)c2ccoc2 270196a_100011215940_100000210174 [0,2,0,0,0,0|2,0,0]=4 385 B13R2.4 OCc1nc(no1)c2ccsc2 270196a_100000188589_100000210174 [0,2,0,0,0,0|2,0,0]=4 386 B13R2.11 Cc1ccc([nH]1)c2noc(n2)C 270196a_100009830067_100000070787 [0,2,0,0,0,0|2,0,0]=4 387 B13R2.11 Cc1ccc([nH]1)c2noc(n2)O 270196a_100009830067_100015183105 [0,2,0,0,0,0|2,0,0]=4 388 B13R2.11 Cc1ccc(o1)c2noc(n2)C 270196a_100000184601_100000070787 [0,2,0,0,0,0|2,0,0]=4 389 B13R2.11 Cc1ccc(o1)c2noc(n2)C 271570a_100000061910_100012003639 [0,2,0,0,0,0|2,0,0]=4 390 B13R2.11 Cc1ccc(o1)c2noc(n2)O 270196a_100000184601_100015183105 [0,2,0,0,0,0|2,0,0]=4 391 B13R2.11 Cc1ccc(s1)c2noc(n2)O 270196a_100000688915_100015183105 [0,2,0,0,0,0|2,0,0]=4 392 B13R2.11 Cc1csc(c1)c2noc(n2)C 270196a_100000084081_100000070787 [0,2,0,0,0,0|2,0,0]=4 393 B13R2.11 Cc1csc(c1)c2noc(n2)C 271570a_100000038307_100012003639 [0,2,0,0,0,0|2,0,0]=4 394 B13R2.11 Cc1csc(c1)c2noc(n2)O 270196a_100000084081_100015183105 [0,2,0,0,0,0|2,0,0]=4 395 B13R2.11 Cc1nc(no1)c2cc(c[nH]2)Br 270196a_100009952751_100000070787 [0,2,0,0,0,0|2,0,0]=4 396 B13R2.11 Cc1nc(no1)c2cc(cs2)Br 270196a_100000742465_100000070787 [0,2,0,0,0,0|2,0,0]=4 397 B13R2.11 Cc1nc(no1)c2cc(cs2)Cl 270196a_100012184668_100000070787 [0,2,0,0,0,0|2,0,0]=4 398 B13R2.11 Cc1nc(no1)c2ccc(o2)Br 270196a_100000764468_100000070787 [0,2,0,0,0,0|2,0,0]=4 399 B13R2.11 Cc1nc(no1)c2ccc(s2)Br 270196a_100000737243_100000070787 [0,2,0,0,0,0|2,0,0]=4 400 B13R2.11 Cc1nc(no1)c2ccc(s2)C 270196a_100000688915_100000070787 [0,2,0,0,0,0|2,0,0]=4 401 B13R2.11 Cc1nc(no1)c2ccc(s2)C 271570a_100011934456_100012003639 [0,2,0,0,0,0|2,0,0]=4 402 B13R2.11 Cc1nc(no1)c2ccc(s2)Cl 270196a_100000749986_100000070787 [0,2,0,0,0,0|2,0,0]=4 403 B13R2.11 Cc1nc(no1)c2ccc(s2)Cl 271570a_100000708867_100012003639 [0,2,0,0,0,0|2,0,0]=4 404 B13R2.11 Cc1nc(no1)c2ccc(s2)F 270196a_100000100944_100000070787 [0,2,0,0,0,0|2,0,0]=4 405 B13R2.11 Cc1nc(no1)c2ccn(c2)C 270196a_100000731686_100000070787 [0,2,0,0,0,0|2,0,0]=4 406 B13R2.11 Cc1nc(no1)c2ccn(c2)C 271570a_100010172022_100012003639 [0,2,0,0,0,0|2,0,0]=4 407 B13R2.11 Cc1nc(no1)c2csc(c2)C 271570a_100000699828_100012003639 [0,2,0,0,0,0|2,0,0]=4 408 B13R2.11 Cc1nc(no1)c2csc(c2)Cl 270196a_100009862252_100000070787 [0,2,0,0,0,0|2,0,0]=4 409 B13R2.11 Cn1ccc(c1)c2noc(n2)O 270196a_100000731686_100015183105 [0,2,0,0,0,0|2,0,0]=4 410 B13R2.11 Oc1nc(no1)c2cc(c[nH]2)Br 270196a_100009952751_100015183105 [0,2,0,0,0,0|2,0,0]=4 411 B13R2.11 Oc1nc(no1)c2cc(cs2)Br 270196a_100000742465_100015183105 [0,2,0,0,0,0|2,0,0]=4 412 B13R2.11 Oc1nc(no1)c2cc(cs2)Cl 270196a_100012184668_100015183105 [0,2,0,0,0,0|2,0,0]=4 413 B13R2.11 Oc1nc(no1)c2ccc(o2)Br 270196a_100000764468_100015183105 [0,2,0,0,0,0|2,0,0]=4 414 B13R2.11 Oc1nc(no1)c2ccc(s2)Br 270196a_100000737243_100015183105 [0,2,0,0,0,0|2,0,0]=4 415 B13R2.11 Oc1nc(no1)c2ccc(s2)Cl 270196a_100000749986_100015183105 [0,2,0,0,0,0|2,0,0]=4 416 B13R2.11 Oc1nc(no1)c2ccc(s2)F 270196a_100000100944_100015183105 [0,2,0,0,0,0|2,0,0]=4 417 B13R2.11 Oc1nc(no1)c2csc(c2)Cl 270196a_100009862252_100015183105 [0,2,0,0,0,0|2,0,0]=4 418 B13R2.144 Cc1ccsc1c2noc(n2)O 270196a_100000731753_100015183105 [0,2,0,0,0,0|2,0,0]=4 419 B13R2.144 Cc1cscc1c2noc(n2)O 270196a_100000686843_100015183105 [0,2,0,0,0,0|2,0,0]=4 420 B13R2.144 Cc1nc(no1)c2cccn2C 270196a_100000181993_100000070787 [0,2,0,0,0,0|2,0,0]=4 421 B13R2.144 Cc1nc(no1)c2cccn2C 271570a_100000068268_100012003639 [0,2,0,0,0,0|2,0,0]=4 422 B13R2.144 Cc1nc(no1)c2ccoc2C 271570a_100000070625_100012003639 [0,2,0,0,0,0|2,0,0]=4 423 B13R2.144 Cc1nc(no1)c2ccsc2Br 270196a_100009817073_100000070787 [0,2,0,0,0,0|2,0,0]=4 424 B13R2.144 Cc1nc(no1)c2ccsc2C 271570a_100012356473_100012003639 [0,2,0,0,0,0|2,0,0]=4 425 B13R2.144 Cc1nc(no1)c2ccsc2Cl 271570a_100000117213_100012003639 [0,2,0,0,0,0|2,0,0]=4 426 B13R2.144 Cc1nc(no1)c2cscc2Br 270196a_100011934119_100000070787 [0,2,0,0,0,0|2,0,0]=4 427 B13R2.144 Cc1nc(no1)c2cscc2C 270196a_100000686843_100000070787 [0,2,0,0,0,0|2,0,0]=4 428 B13R2.144 Cc1nc(no1)c2cscc2C 271570a_100000069996_100012003639 [0,2,0,0,0,0|2,0,0]=4 429 B13R2.144 Cc1nc(no1)c2sccc2Br 270196a_100011215142_100000070787 [0,2,0,0,0,0|2,0,0]=4 430 B13R2.144 Cc1nc(no1)c2sccc2C 270196a_100000731753_100000070787 [0,2,0,0,0,0|2,0,0]=4 431 B13R2.144 Cc1nc(no1)c2sccc2C 271570a_100000734444_100012003639 [0,2,0,0,0,0|2,0,0]=4 432 B13R2.144 Cc1nc(no1)c2sccc2Cl 270196a_100011996795_100000070787 [0,2,0,0,0,0|2,0,0]=4 433 B13R2.144 Cc1nc(no1)c2sccc2F 270196a_100015109535_100000070787 [0,2,0,0,0,0|2,0,0]=4 434 B13R2.144 Cn1cccc1c2noc(n2)O 270196a_100000181993_100015183105 [0,2,0,0,0,0|2,0,0]=4 435 B13R2.144 Oc1nc(no1)c2ccsc2Br 270196a_100009817073_100015183105 [0,2,0,0,0,0|2,0,0]=4 436 B13R2.144 Oc1nc(no1)c2cscc2Br 270196a_100011934119_100015183105 [0,2,0,0,0,0|2,0,0]=4 437 B13R2.144 Oc1nc(no1)c2sccc2Br 270196a_100011215142_100015183105 [0,2,0,0,0,0|2,0,0]=4 438 B13R2.144 Oc1nc(no1)c2sccc2Cl 270196a_100011996795_100015183105 [0,2,0,0,0,0|2,0,0]=4 439 B13R2.144 Oc1nc(no1)c2sccc2F 270196a_100015109535_100015183105 [0,2,0,0,0,0|2,0,0]=4 440 B13R2.3 c1cc(ccn1)c2cnccn2 271570a_100000752145_100000758340 [0,0,0,0,0,2|2,0,0]=4 441 B13R2.3 c1cc(ccn1)c2cnccn2 271570a_100011962566_100000035832 [0,0,0,0,0,2|2,0,0]=4 442 B13R2.3 c1ccc(cc1)c2cnccn2 271570a_100011218836_100000758340 [0,0,0,0,0,2|2,0,0]=4 443 B13R2.3 c1ccc(cc1)c2cnccn2 271570a_100011962566_100000210277 [0,0,0,0,0,2|2,0,0]=4 444 B13R2.3 c1ccc(cc1)c2ncccn2 271570a_100011218836_100000211032 [0,0,0,0,0,2|2,0,0]=4 445 B13R2.3 c1ccc(nc1)c2cnccn2 271570a_100011264011_100000758340 [0,0,0,0,0,2|2,0,0]=4 446 B13R2.3 c1ccc(nc1)c2cnccn2 271570a_100011962566_100011216584 [0,0,0,0,0,2|2,0,0]=4 447 B13R2.3 c1ccc(nc1)c2ncccn2 271570a_100011264011_100000211032 [0,0,0,0,0,2|2,0,0]=4 448 B13R2.3 c1cnc(nc1)c2cccnc2 271570a_100000757648_100000211032 [0,0,0,0,0,2|2,0,0]=4 449 B13R2.3 c1cnc(nc1)c2ccncc2 271570a_100000752145_100000211032 [0,0,0,0,0,2|2,0,0]=4 450 B13R2.3 c1cncc(c1)c2cnccn2 271570a_100000757648_100000758340 [0,0,0,0,0,2|2,0,0]=4 451 B13R2.3 c1cncc(c1)c2cnccn2 271570a_100011962566_100000752921 [0,0,0,0,0,2|2,0,0]=4 452 B13R2.64 C1=CCN(CC1)Cc2ncon2 269982a_100000698166_100000233494 [0,0,0,0,0,2|0,0,2]=4 453 B13R2.64 C1=CCN(CC1)Cc2ncon2 34a_100000698166_100000233494 [0,0,0,0,0,2|0,0,2]=4 454 B13R2.64 c1cc(ccn1)Sc2ccon2 62a_100000728582_100009818083 [0,0,0,0,0,2|2,0,0]=4 455 B13R2.64 c1cc(ccn1)Sc2ccon2 62a_100009818083_100000728582 [0,0,0,0,0,2|2,0,0]=4 456 B13R2.64 c1cc(ccn1)Sc2nc[nH]n2 62a_100000728582_100000761765 [0,0,0,0,0,2|2,0,0]=4 457 B13R2.64 c1cc(ccn1)Sc2nc[nH]n2 62a_100000761765_100000728582 [0,0,0,0,0,2|2,0,0]=4 458 B13R2.64 c1ccc(cc1)Sc2ccon2 62a_100000719477_100009818083 [0,0,0,0,0,2|2,0,0]=4 459 B13R2.64 c1ccc(cc1)Sc2ccon2 62a_100009818083_100000041952 [0,0,0,0,0,2|2,0,0]=4 460 B13R2.64 c1ccc(cc1)Sc2nc[nH]n2 62a_100000719477_100000761765 [0,0,0,0,0,2|2,0,0]=4 461 B13R2.64 c1ccc(cc1)Sc2nc[nH]n2 62a_100000761765_100000041952 [0,0,0,0,0,2|2,0,0]=4 462 B13R2.64 c1ccc(nc1)Sc2ccon2 62a_100009818083_100011216584 [0,0,0,0,0,2|2,0,0]=4 463 B13R2.64 c1ccc(nc1)Sc2ccon2 62a_100011216584_100009818083 [0,0,0,0,0,2|2,0,0]=4 464 B13R2.64 c1ccc(nc1)Sc2nc[nH]n2 62a_100000761765_100011216584 [0,0,0,0,0,2|2,0,0]=4 465 B13R2.64 c1ccc(nc1)Sc2nc[nH]n2 62a_100011216584_100000761765 [0,0,0,0,0,2|2,0,0]=4 466 B13R2.64 c1cncc(c1)Sc2ccon2 62a_100000210063_100009818083 [0,0,0,0,0,2|2,0,0]=4 467 B13R2.64 c1cncc(c1)Sc2ccon2 62a_100009818083_100000210063 [0,0,0,0,0,2|2,0,0]=4 468 B13R2.64 c1cncc(c1)Sc2nc[nH]n2 62a_100000210063_100000761765 [0,0,0,0,0,2|2,0,0]=4 469 B13R2.64 c1cncc(c1)Sc2nc[nH]n2 62a_100000761765_100000210063 [0,0,0,0,0,2|2,0,0]=4 470 B13R2.183 c1cc(co1)SCc2ncon2 62a_100000233494_100011215275 [0,0,0,0,0,2|2,0,0]=4 471 B13R2.183 c1cc(co1)SCc2ncon2 62a_100011215275_100000233494 [0,0,0,0,0,2|2,0,0]=4 472 B13R2.183 c1coc(c1)SCc2ncon2 62a_100000233494_100009814098 [0,0,0,0,0,2|2,0,0]=4 473 B13R2.183 c1coc(c1)SCc2ncon2 62a_100009814098_100000233494 [0,0,0,0,0,2|2,0,0]=4 474 B13R2.183 c1csc(c1)SCc2ncon2 62a_100000233494_100011215356 [0,0,0,0,0,2|2,0,0]=4 475 B13R2.183 c1csc(c1)SCc2ncon2 62a_100011215356_100000233494 [0,0,0,0,0,2|2,0,0]=4 476 B13R2.183 c1nc(no1)COc2ccsc2 34a_100000106738_100000233494 [0,0,0,0,0,2|2,0,0]=4 477 B13R2.183 c1nc(no1)CSc2ccsc2 62a_100000233494_100000738268 [0,0,0,0,0,2|2,0,0]=4 478 B13R2.183 c1nc(no1)CSc2ccsc2 62a_100000738268_100000233494 [0,0,0,0,0,2|2,0,0]=4